Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 8: 1: 8 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./Cs2PtCl6.save/ file Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 77 56 15 3776 2387 336 Max 78 57 16 3780 2406 340 Sum 5551 4081 1111 272059 172575 24309 bravais-lattice index = 14 lattice parameter (alat) = 13.6189 a.u. unit-cell volume = 1786.1370 (a.u.)^3 number of atoms/cell = 9 number of atomic types = 3 number of electrons = 70.00 number of Kohn-Sham states= 84 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 13.618938 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 Cl read from file: /users/gautes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Pt read from file: /users/gautes/Pseudo/Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5a767c0d250ba2b616d7addddc548ecc 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 1277 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 Cs read from file: /users/gautes/Pseudo/Cs.rel-pbe-oncvpsp.UPF MD5 check sum: b26d75608c6aa7e713949ad9f7a49707 Pseudo is Norm-conserving, Zval = 9.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 2414 points, 14 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 l(11) = 3 l(12) = 3 l(13) = 3 l(14) = 3 atomic species valence mass pseudopotential Cl 7.00 35.45300 Cl( 1.00) Pt 10.00 195.08400 Pt( 1.00) Cs 9.00 132.90550 Cs( 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= 210 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0161290 -0.0093121 0.0131693), wk = 0.0047619 k( 3) = ( 0.0322581 -0.0186242 0.0263386), wk = 0.0047619 k( 4) = ( 0.0483871 -0.0279363 0.0395079), wk = 0.0047619 k( 5) = ( 0.0645161 -0.0372484 0.0526772), wk = 0.0047619 k( 6) = ( 0.0806452 -0.0465605 0.0658465), wk = 0.0047619 k( 7) = ( 0.0967742 -0.0558726 0.0790158), wk = 0.0047619 k( 8) = ( 0.1129032 -0.0651847 0.0921851), wk = 0.0047619 k( 9) = ( 0.1290323 -0.0744968 0.1053544), wk = 0.0047619 k( 10) = ( 0.1451613 -0.0838089 0.1185237), wk = 0.0047619 k( 11) = ( 0.1612903 -0.0931210 0.1316930), wk = 0.0047619 k( 12) = ( 0.1774194 -0.1024331 0.1448623), wk = 0.0047619 k( 13) = ( 0.1935484 -0.1117452 0.1580316), wk = 0.0047619 k( 14) = ( 0.2096774 -0.1210573 0.1712009), wk = 0.0047619 k( 15) = ( 0.2258064 -0.1303694 0.1843702), wk = 0.0047619 k( 16) = ( 0.2419355 -0.1396815 0.1975395), wk = 0.0047619 k( 17) = ( 0.2580645 -0.1489936 0.2107088), wk = 0.0047619 k( 18) = ( 0.2741936 -0.1583057 0.2238781), wk = 0.0047619 k( 19) = ( 0.2903226 -0.1676178 0.2370474), wk = 0.0047619 k( 20) = ( 0.3064516 -0.1769299 0.2502167), wk = 0.0047619 k( 21) = ( 0.3225807 -0.1862420 0.2633860), wk = 0.0047619 k( 22) = ( 0.3387097 -0.1955541 0.2765553), wk = 0.0047619 k( 23) = ( 0.3548387 -0.2048662 0.2897246), wk = 0.0047619 k( 24) = ( 0.3709677 -0.2141783 0.3028939), wk = 0.0047619 k( 25) = ( 0.3870968 -0.2234904 0.3160632), wk = 0.0047619 k( 26) = ( 0.4032258 -0.2328025 0.3292325), wk = 0.0047619 k( 27) = ( 0.4193548 -0.2421146 0.3424018), wk = 0.0047619 k( 28) = ( 0.4354839 -0.2514267 0.3555711), wk = 0.0047619 k( 29) = ( 0.4516129 -0.2607388 0.3687404), wk = 0.0047619 k( 30) = ( 0.4677419 -0.2700509 0.3819097), wk = 0.0047619 k( 31) = ( 0.4838710 -0.2793630 0.3950790), wk = 0.0047619 k( 32) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0047619 k( 33) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0047619 k( 34) = ( 0.5000000 -0.2706329 0.4210060), wk = 0.0047619 k( 35) = ( 0.5000000 -0.2525907 0.4337638), wk = 0.0047619 k( 36) = ( 0.5000000 -0.2345485 0.4465216), wk = 0.0047619 k( 37) = ( 0.5000000 -0.2165064 0.4592793), wk = 0.0047619 k( 38) = ( 0.5000000 -0.1984642 0.4720371), wk = 0.0047619 k( 39) = ( 0.5000000 -0.1804220 0.4847948), wk = 0.0047619 k( 40) = ( 0.5000000 -0.1623798 0.4975526), wk = 0.0047619 k( 41) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0047619 k( 42) = ( 0.5000000 -0.1262954 0.5230681), wk = 0.0047619 k( 43) = ( 0.5000000 -0.1082532 0.5358259), wk = 0.0047619 k( 44) = ( 0.5000000 -0.0902110 0.5485836), wk = 0.0047619 k( 45) = ( 0.5000000 -0.0721688 0.5613414), wk = 0.0047619 k( 46) = ( 0.5000000 -0.0541266 0.5740992), wk = 0.0047619 k( 47) = ( 0.5000000 -0.0360844 0.5868569), wk = 0.0047619 k( 48) = ( 0.5000000 -0.0180422 0.5996147), wk = 0.0047619 k( 49) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0047619 k( 50) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0047619 k( 51) = ( 0.4886364 0.0196824 0.6123724), wk = 0.0047619 k( 52) = ( 0.4772727 0.0393648 0.6123724), wk = 0.0047619 k( 53) = ( 0.4659091 0.0590472 0.6123724), wk = 0.0047619 k( 54) = ( 0.4545455 0.0787296 0.6123724), wk = 0.0047619 k( 55) = ( 0.4431818 0.0984120 0.6123724), wk = 0.0047619 k( 56) = ( 0.4318182 0.1180944 0.6123724), wk = 0.0047619 k( 57) = ( 0.4204545 0.1377768 0.6123724), wk = 0.0047619 k( 58) = ( 0.4090909 0.1574592 0.6123724), wk = 0.0047619 k( 59) = ( 0.3977273 0.1771416 0.6123724), wk = 0.0047619 k( 60) = ( 0.3863636 0.1968239 0.6123724), wk = 0.0047619 k( 61) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0047619 k( 62) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0047619 k( 63) = ( 0.3636364 0.2099456 0.5938157), wk = 0.0047619 k( 64) = ( 0.3522727 0.2033848 0.5752589), wk = 0.0047619 k( 65) = ( 0.3409091 0.1968240 0.5567022), wk = 0.0047619 k( 66) = ( 0.3295455 0.1902632 0.5381455), wk = 0.0047619 k( 67) = ( 0.3181818 0.1837024 0.5195887), wk = 0.0047619 k( 68) = ( 0.3068182 0.1771416 0.5010320), wk = 0.0047619 k( 69) = ( 0.2954545 0.1705808 0.4824752), wk = 0.0047619 k( 70) = ( 0.2840909 0.1640200 0.4639185), wk = 0.0047619 k( 71) = ( 0.2727273 0.1574592 0.4453618), wk = 0.0047619 k( 72) = ( 0.2613636 0.1508984 0.4268050), wk = 0.0047619 k( 73) = ( 0.2500000 0.1443376 0.4082483), wk = 0.0047619 k( 74) = ( 0.2386364 0.1377768 0.3896916), wk = 0.0047619 k( 75) = ( 0.2272727 0.1312160 0.3711348), wk = 0.0047619 k( 76) = ( 0.2159091 0.1246552 0.3525781), wk = 0.0047619 k( 77) = ( 0.2045454 0.1180944 0.3340213), wk = 0.0047619 k( 78) = ( 0.1931818 0.1115336 0.3154646), wk = 0.0047619 k( 79) = ( 0.1818182 0.1049728 0.2969078), wk = 0.0047619 k( 80) = ( 0.1704546 0.0984120 0.2783511), wk = 0.0047619 k( 81) = ( 0.1590909 0.0918512 0.2597944), wk = 0.0047619 k( 82) = ( 0.1477273 0.0852904 0.2412376), wk = 0.0047619 k( 83) = ( 0.1363636 0.0787296 0.2226809), wk = 0.0047619 k( 84) = ( 0.1250000 0.0721688 0.2041241), wk = 0.0047619 k( 85) = ( 0.1136364 0.0656080 0.1855674), wk = 0.0047619 k( 86) = ( 0.1022727 0.0590472 0.1670107), wk = 0.0047619 k( 87) = ( 0.0909091 0.0524864 0.1484539), wk = 0.0047619 k( 88) = ( 0.0795455 0.0459256 0.1298972), wk = 0.0047619 k( 89) = ( 0.0681818 0.0393648 0.1113404), wk = 0.0047619 k( 90) = ( 0.0568182 0.0328040 0.0927837), wk = 0.0047619 k( 91) = ( 0.0454546 0.0262432 0.0742270), wk = 0.0047619 k( 92) = ( 0.0340909 0.0196824 0.0556702), wk = 0.0047619 k( 93) = ( 0.0227273 0.0131216 0.0371135), wk = 0.0047619 k( 94) = ( 0.0113636 0.0065608 0.0185567), wk = 0.0047619 k( 95) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 96) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 97) = ( 0.0185185 0.0106917 0.0075602), wk = 0.0047619 k( 98) = ( 0.0370370 0.0213833 0.0151203), wk = 0.0047619 k( 99) = ( 0.0555556 0.0320750 0.0226805), wk = 0.0047619 k( 100) = ( 0.0740741 0.0427667 0.0302406), wk = 0.0047619 k( 101) = ( 0.0925926 0.0534584 0.0378008), wk = 0.0047619 k( 102) = ( 0.1111111 0.0641500 0.0453609), wk = 0.0047619 k( 103) = ( 0.1296296 0.0748417 0.0529211), wk = 0.0047619 k( 104) = ( 0.1481482 0.0855334 0.0604812), wk = 0.0047619 k( 105) = ( 0.1666667 0.0962250 0.0680414), wk = 0.0047619 k( 106) = ( 0.1851852 0.1069167 0.0756015), wk = 0.0047619 k( 107) = ( 0.2037037 0.1176084 0.0831617), wk = 0.0047619 k( 108) = ( 0.2222222 0.1283001 0.0907218), wk = 0.0047619 k( 109) = ( 0.2407407 0.1389917 0.0982820), wk = 0.0047619 k( 110) = ( 0.2592593 0.1496834 0.1058421), wk = 0.0047619 k( 111) = ( 0.2777778 0.1603751 0.1134023), wk = 0.0047619 k( 112) = ( 0.2962963 0.1710667 0.1209625), wk = 0.0047619 k( 113) = ( 0.3148148 0.1817584 0.1285226), wk = 0.0047619 k( 114) = ( 0.3333333 0.1924501 0.1360828), wk = 0.0047619 k( 115) = ( 0.3518519 0.2031418 0.1436429), wk = 0.0047619 k( 116) = ( 0.3703704 0.2138334 0.1512031), wk = 0.0047619 k( 117) = ( 0.3888889 0.2245251 0.1587632), wk = 0.0047619 k( 118) = ( 0.4074074 0.2352168 0.1663234), wk = 0.0047619 k( 119) = ( 0.4259259 0.2459085 0.1738835), wk = 0.0047619 k( 120) = ( 0.4444444 0.2566001 0.1814437), wk = 0.0047619 k( 121) = ( 0.4629630 0.2672918 0.1890038), wk = 0.0047619 k( 122) = ( 0.4814815 0.2779835 0.1965640), wk = 0.0047619 k( 123) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0047619 k( 124) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0047619 k( 125) = ( 0.5065789 0.2696834 0.2148675), wk = 0.0047619 k( 126) = ( 0.5131579 0.2506916 0.2256109), wk = 0.0047619 k( 127) = ( 0.5197368 0.2316998 0.2363543), wk = 0.0047619 k( 128) = ( 0.5263158 0.2127080 0.2470977), wk = 0.0047619 k( 129) = ( 0.5328947 0.1937162 0.2578410), wk = 0.0047619 k( 130) = ( 0.5394737 0.1747244 0.2685844), wk = 0.0047619 k( 131) = ( 0.5460526 0.1557326 0.2793278), wk = 0.0047619 k( 132) = ( 0.5526316 0.1367409 0.2900712), wk = 0.0047619 k( 133) = ( 0.5592105 0.1177491 0.3008145), wk = 0.0047619 k( 134) = ( 0.5657895 0.0987573 0.3115579), wk = 0.0047619 k( 135) = ( 0.5723684 0.0797655 0.3223013), wk = 0.0047619 k( 136) = ( 0.5789474 0.0607737 0.3330447), wk = 0.0047619 k( 137) = ( 0.5855263 0.0417819 0.3437880), wk = 0.0047619 k( 138) = ( 0.5921053 0.0227901 0.3545314), wk = 0.0047619 k( 139) = ( 0.5986842 0.0037984 0.3652748), wk = 0.0047619 k( 140) = ( 0.6052632 -0.0151934 0.3760182), wk = 0.0047619 k( 141) = ( 0.6118421 -0.0341852 0.3867615), wk = 0.0047619 k( 142) = ( 0.6184211 -0.0531770 0.3975049), wk = 0.0047619 k( 143) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0047619 k( 144) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0047619 k( 145) = ( 0.6136364 -0.0656080 0.4268050), wk = 0.0047619 k( 146) = ( 0.6022727 -0.0590472 0.4453618), wk = 0.0047619 k( 147) = ( 0.5909091 -0.0524864 0.4639185), wk = 0.0047619 k( 148) = ( 0.5795455 -0.0459256 0.4824753), wk = 0.0047619 k( 149) = ( 0.5681818 -0.0393648 0.5010320), wk = 0.0047619 k( 150) = ( 0.5568182 -0.0328040 0.5195887), wk = 0.0047619 k( 151) = ( 0.5454545 -0.0262432 0.5381455), wk = 0.0047619 k( 152) = ( 0.5340909 -0.0196824 0.5567022), wk = 0.0047619 k( 153) = ( 0.5227273 -0.0131216 0.5752590), wk = 0.0047619 k( 154) = ( 0.5113636 -0.0065608 0.5938157), wk = 0.0047619 k( 155) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0047619 k( 156) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0047619 k( 157) = ( 0.5000000 0.0131216 0.5938157), wk = 0.0047619 k( 158) = ( 0.5000000 0.0262432 0.5752590), wk = 0.0047619 k( 159) = ( 0.5000000 0.0393648 0.5567022), wk = 0.0047619 k( 160) = ( 0.5000000 0.0524864 0.5381455), wk = 0.0047619 k( 161) = ( 0.5000000 0.0656080 0.5195887), wk = 0.0047619 k( 162) = ( 0.5000000 0.0787296 0.5010320), wk = 0.0047619 k( 163) = ( 0.5000000 0.0918512 0.4824753), wk = 0.0047619 k( 164) = ( 0.5000000 0.1049728 0.4639185), wk = 0.0047619 k( 165) = ( 0.5000000 0.1180944 0.4453618), wk = 0.0047619 k( 166) = ( 0.5000000 0.1312160 0.4268050), wk = 0.0047619 k( 167) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0047619 k( 168) = ( 0.5000000 0.1574592 0.3896915), wk = 0.0047619 k( 169) = ( 0.5000000 0.1705808 0.3711348), wk = 0.0047619 k( 170) = ( 0.5000000 0.1837024 0.3525781), wk = 0.0047619 k( 171) = ( 0.5000000 0.1968240 0.3340213), wk = 0.0047619 k( 172) = ( 0.5000000 0.2099456 0.3154646), wk = 0.0047619 k( 173) = ( 0.5000000 0.2230672 0.2969078), wk = 0.0047619 k( 174) = ( 0.5000000 0.2361887 0.2783511), wk = 0.0047619 k( 175) = ( 0.5000000 0.2493103 0.2597944), wk = 0.0047619 k( 176) = ( 0.5000000 0.2624319 0.2412376), wk = 0.0047619 k( 177) = ( 0.5000000 0.2755535 0.2226809), wk = 0.0047619 k( 178) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0047619 k( 179) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0047619 k( 180) = ( 0.4934211 0.2848768 0.2256109), wk = 0.0047619 k( 181) = ( 0.4868421 0.2810784 0.2470976), wk = 0.0047619 k( 182) = ( 0.4802632 0.2772801 0.2685844), wk = 0.0047619 k( 183) = ( 0.4736842 0.2734817 0.2900712), wk = 0.0047619 k( 184) = ( 0.4671053 0.2696833 0.3115579), wk = 0.0047619 k( 185) = ( 0.4605263 0.2658850 0.3330447), wk = 0.0047619 k( 186) = ( 0.4539474 0.2620866 0.3545314), wk = 0.0047619 k( 187) = ( 0.4473684 0.2582883 0.3760182), wk = 0.0047619 k( 188) = ( 0.4407895 0.2544899 0.3975049), wk = 0.0047619 k( 189) = ( 0.4342105 0.2506916 0.4189917), wk = 0.0047619 k( 190) = ( 0.4276316 0.2468932 0.4404784), wk = 0.0047619 k( 191) = ( 0.4210526 0.2430948 0.4619652), wk = 0.0047619 k( 192) = ( 0.4144737 0.2392965 0.4834519), wk = 0.0047619 k( 193) = ( 0.4078947 0.2354981 0.5049387), wk = 0.0047619 k( 194) = ( 0.4013158 0.2316998 0.5264254), wk = 0.0047619 k( 195) = ( 0.3947368 0.2279014 0.5479122), wk = 0.0047619 k( 196) = ( 0.3881579 0.2241031 0.5693989), wk = 0.0047619 k( 197) = ( 0.3815789 0.2203047 0.5908857), wk = 0.0047619 k( 198) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0047619 k( 199) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0047619 k( 200) = ( 0.6136364 -0.0918512 0.4082483), wk = 0.0047619 k( 201) = ( 0.6022727 -0.1115336 0.4082483), wk = 0.0047619 k( 202) = ( 0.5909091 -0.1312160 0.4082483), wk = 0.0047619 k( 203) = ( 0.5795455 -0.1508984 0.4082483), wk = 0.0047619 k( 204) = ( 0.5681818 -0.1705808 0.4082483), wk = 0.0047619 k( 205) = ( 0.5568182 -0.1902632 0.4082483), wk = 0.0047619 k( 206) = ( 0.5454545 -0.2099456 0.4082483), wk = 0.0047619 k( 207) = ( 0.5340909 -0.2296279 0.4082483), wk = 0.0047619 k( 208) = ( 0.5227273 -0.2493103 0.4082483), wk = 0.0047619 k( 209) = ( 0.5113636 -0.2689927 0.4082483), wk = 0.0047619 k( 210) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0047619 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0161290 0.0000000 0.0161290), wk = 0.0047619 k( 3) = ( 0.0322581 0.0000000 0.0322581), wk = 0.0047619 k( 4) = ( 0.0483871 -0.0000000 0.0483871), wk = 0.0047619 k( 5) = ( 0.0645161 0.0000000 0.0645161), wk = 0.0047619 k( 6) = ( 0.0806452 -0.0000000 0.0806452), wk = 0.0047619 k( 7) = ( 0.0967742 -0.0000000 0.0967742), wk = 0.0047619 k( 8) = ( 0.1129032 -0.0000000 0.1129032), wk = 0.0047619 k( 9) = ( 0.1290323 0.0000000 0.1290323), wk = 0.0047619 k( 10) = ( 0.1451613 0.0000000 0.1451613), wk = 0.0047619 k( 11) = ( 0.1612903 -0.0000000 0.1612903), wk = 0.0047619 k( 12) = ( 0.1774194 -0.0000000 0.1774194), wk = 0.0047619 k( 13) = ( 0.1935484 -0.0000000 0.1935484), wk = 0.0047619 k( 14) = ( 0.2096774 -0.0000000 0.2096774), wk = 0.0047619 k( 15) = ( 0.2258064 0.0000000 0.2258065), wk = 0.0047619 k( 16) = ( 0.2419355 -0.0000000 0.2419355), wk = 0.0047619 k( 17) = ( 0.2580645 0.0000000 0.2580645), wk = 0.0047619 k( 18) = ( 0.2741936 0.0000000 0.2741936), wk = 0.0047619 k( 19) = ( 0.2903226 0.0000000 0.2903226), wk = 0.0047619 k( 20) = ( 0.3064516 0.0000000 0.3064516), wk = 0.0047619 k( 21) = ( 0.3225807 0.0000000 0.3225807), wk = 0.0047619 k( 22) = ( 0.3387097 0.0000000 0.3387097), wk = 0.0047619 k( 23) = ( 0.3548387 0.0000000 0.3548387), wk = 0.0047619 k( 24) = ( 0.3709677 0.0000000 0.3709677), wk = 0.0047619 k( 25) = ( 0.3870968 0.0000000 0.3870968), wk = 0.0047619 k( 26) = ( 0.4032258 -0.0000000 0.4032258), wk = 0.0047619 k( 27) = ( 0.4193548 -0.0000000 0.4193548), wk = 0.0047619 k( 28) = ( 0.4354839 0.0000000 0.4354839), wk = 0.0047619 k( 29) = ( 0.4516129 0.0000000 0.4516129), wk = 0.0047619 k( 30) = ( 0.4677419 -0.0000000 0.4677419), wk = 0.0047619 k( 31) = ( 0.4838710 -0.0000000 0.4838710), wk = 0.0047619 k( 32) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0047619 k( 33) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0047619 k( 34) = ( 0.5000000 0.0156250 0.5156250), wk = 0.0047619 k( 35) = ( 0.5000000 0.0312500 0.5312500), wk = 0.0047619 k( 36) = ( 0.5000000 0.0468750 0.5468750), wk = 0.0047619 k( 37) = ( 0.5000000 0.0625000 0.5625000), wk = 0.0047619 k( 38) = ( 0.5000000 0.0781250 0.5781250), wk = 0.0047619 k( 39) = ( 0.5000000 0.0937500 0.5937500), wk = 0.0047619 k( 40) = ( 0.5000000 0.1093750 0.6093750), wk = 0.0047619 k( 41) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0047619 k( 42) = ( 0.5000000 0.1406250 0.6406250), wk = 0.0047619 k( 43) = ( 0.5000000 0.1562500 0.6562500), wk = 0.0047619 k( 44) = ( 0.5000000 0.1718750 0.6718750), wk = 0.0047619 k( 45) = ( 0.5000000 0.1875000 0.6875000), wk = 0.0047619 k( 46) = ( 0.5000000 0.2031250 0.7031250), wk = 0.0047619 k( 47) = ( 0.5000000 0.2187500 0.7187500), wk = 0.0047619 k( 48) = ( 0.5000000 0.2343750 0.7343750), wk = 0.0047619 k( 49) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0047619 k( 50) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0047619 k( 51) = ( 0.4886364 0.2613636 0.7500000), wk = 0.0047619 k( 52) = ( 0.4772727 0.2727273 0.7500000), wk = 0.0047619 k( 53) = ( 0.4659091 0.2840909 0.7500000), wk = 0.0047619 k( 54) = ( 0.4545455 0.2954545 0.7500000), wk = 0.0047619 k( 55) = ( 0.4431818 0.3068182 0.7500000), wk = 0.0047619 k( 56) = ( 0.4318182 0.3181818 0.7500000), wk = 0.0047619 k( 57) = ( 0.4204545 0.3295455 0.7500000), wk = 0.0047619 k( 58) = ( 0.4090909 0.3409091 0.7500000), wk = 0.0047619 k( 59) = ( 0.3977273 0.3522727 0.7500000), wk = 0.0047619 k( 60) = ( 0.3863636 0.3636364 0.7500000), wk = 0.0047619 k( 61) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0047619 k( 62) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0047619 k( 63) = ( 0.3636364 0.3636364 0.7272727), wk = 0.0047619 k( 64) = ( 0.3522727 0.3522727 0.7045455), wk = 0.0047619 k( 65) = ( 0.3409091 0.3409091 0.6818182), wk = 0.0047619 k( 66) = ( 0.3295455 0.3295455 0.6590909), wk = 0.0047619 k( 67) = ( 0.3181818 0.3181818 0.6363636), wk = 0.0047619 k( 68) = ( 0.3068182 0.3068182 0.6136364), wk = 0.0047619 k( 69) = ( 0.2954545 0.2954545 0.5909091), wk = 0.0047619 k( 70) = ( 0.2840909 0.2840909 0.5681818), wk = 0.0047619 k( 71) = ( 0.2727273 0.2727273 0.5454545), wk = 0.0047619 k( 72) = ( 0.2613636 0.2613636 0.5227273), wk = 0.0047619 k( 73) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0047619 k( 74) = ( 0.2386364 0.2386364 0.4772727), wk = 0.0047619 k( 75) = ( 0.2272727 0.2272727 0.4545455), wk = 0.0047619 k( 76) = ( 0.2159091 0.2159091 0.4318182), wk = 0.0047619 k( 77) = ( 0.2045454 0.2045454 0.4090909), wk = 0.0047619 k( 78) = ( 0.1931818 0.1931818 0.3863636), wk = 0.0047619 k( 79) = ( 0.1818182 0.1818182 0.3636364), wk = 0.0047619 k( 80) = ( 0.1704546 0.1704546 0.3409091), wk = 0.0047619 k( 81) = ( 0.1590909 0.1590909 0.3181818), wk = 0.0047619 k( 82) = ( 0.1477273 0.1477273 0.2954545), wk = 0.0047619 k( 83) = ( 0.1363636 0.1363636 0.2727273), wk = 0.0047619 k( 84) = ( 0.1250000 0.1250000 0.2500000), wk = 0.0047619 k( 85) = ( 0.1136364 0.1136364 0.2272727), wk = 0.0047619 k( 86) = ( 0.1022727 0.1022727 0.2045454), wk = 0.0047619 k( 87) = ( 0.0909091 0.0909091 0.1818182), wk = 0.0047619 k( 88) = ( 0.0795455 0.0795455 0.1590909), wk = 0.0047619 k( 89) = ( 0.0681818 0.0681818 0.1363636), wk = 0.0047619 k( 90) = ( 0.0568182 0.0568182 0.1136364), wk = 0.0047619 k( 91) = ( 0.0454546 0.0454546 0.0909091), wk = 0.0047619 k( 92) = ( 0.0340909 0.0340909 0.0681818), wk = 0.0047619 k( 93) = ( 0.0227273 0.0227273 0.0454546), wk = 0.0047619 k( 94) = ( 0.0113636 0.0113636 0.0227273), wk = 0.0047619 k( 95) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 96) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 97) = ( 0.0185185 0.0185185 0.0185185), wk = 0.0047619 k( 98) = ( 0.0370370 0.0370370 0.0370370), wk = 0.0047619 k( 99) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0047619 k( 100) = ( 0.0740741 0.0740741 0.0740741), wk = 0.0047619 k( 101) = ( 0.0925926 0.0925926 0.0925926), wk = 0.0047619 k( 102) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0047619 k( 103) = ( 0.1296296 0.1296296 0.1296296), wk = 0.0047619 k( 104) = ( 0.1481482 0.1481482 0.1481482), wk = 0.0047619 k( 105) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0047619 k( 106) = ( 0.1851852 0.1851852 0.1851852), wk = 0.0047619 k( 107) = ( 0.2037037 0.2037037 0.2037037), wk = 0.0047619 k( 108) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0047619 k( 109) = ( 0.2407407 0.2407407 0.2407407), wk = 0.0047619 k( 110) = ( 0.2592593 0.2592593 0.2592593), wk = 0.0047619 k( 111) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0047619 k( 112) = ( 0.2962963 0.2962963 0.2962963), wk = 0.0047619 k( 113) = ( 0.3148148 0.3148148 0.3148148), wk = 0.0047619 k( 114) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0047619 k( 115) = ( 0.3518519 0.3518519 0.3518519), wk = 0.0047619 k( 116) = ( 0.3703704 0.3703704 0.3703704), wk = 0.0047619 k( 117) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0047619 k( 118) = ( 0.4074074 0.4074074 0.4074074), wk = 0.0047619 k( 119) = ( 0.4259259 0.4259259 0.4259259), wk = 0.0047619 k( 120) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0047619 k( 121) = ( 0.4629630 0.4629630 0.4629630), wk = 0.0047619 k( 122) = ( 0.4814815 0.4814815 0.4814815), wk = 0.0047619 k( 123) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 124) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 125) = ( 0.5065789 0.4868421 0.5065789), wk = 0.0047619 k( 126) = ( 0.5131579 0.4736842 0.5131579), wk = 0.0047619 k( 127) = ( 0.5197368 0.4605263 0.5197368), wk = 0.0047619 k( 128) = ( 0.5263158 0.4473684 0.5263158), wk = 0.0047619 k( 129) = ( 0.5328947 0.4342105 0.5328947), wk = 0.0047619 k( 130) = ( 0.5394737 0.4210526 0.5394737), wk = 0.0047619 k( 131) = ( 0.5460526 0.4078947 0.5460526), wk = 0.0047619 k( 132) = ( 0.5526316 0.3947368 0.5526316), wk = 0.0047619 k( 133) = ( 0.5592105 0.3815789 0.5592105), wk = 0.0047619 k( 134) = ( 0.5657895 0.3684211 0.5657895), wk = 0.0047619 k( 135) = ( 0.5723684 0.3552632 0.5723684), wk = 0.0047619 k( 136) = ( 0.5789474 0.3421053 0.5789474), wk = 0.0047619 k( 137) = ( 0.5855263 0.3289474 0.5855263), wk = 0.0047619 k( 138) = ( 0.5921053 0.3157895 0.5921053), wk = 0.0047619 k( 139) = ( 0.5986842 0.3026316 0.5986842), wk = 0.0047619 k( 140) = ( 0.6052632 0.2894737 0.6052632), wk = 0.0047619 k( 141) = ( 0.6118421 0.2763158 0.6118421), wk = 0.0047619 k( 142) = ( 0.6184211 0.2631579 0.6184211), wk = 0.0047619 k( 143) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0047619 k( 144) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0047619 k( 145) = ( 0.6136364 0.2500000 0.6363636), wk = 0.0047619 k( 146) = ( 0.6022727 0.2500000 0.6477273), wk = 0.0047619 k( 147) = ( 0.5909091 0.2500000 0.6590909), wk = 0.0047619 k( 148) = ( 0.5795455 0.2500000 0.6704545), wk = 0.0047619 k( 149) = ( 0.5681818 0.2500000 0.6818182), wk = 0.0047619 k( 150) = ( 0.5568182 0.2500000 0.6931818), wk = 0.0047619 k( 151) = ( 0.5454545 0.2500000 0.7045455), wk = 0.0047619 k( 152) = ( 0.5340909 0.2500000 0.7159091), wk = 0.0047619 k( 153) = ( 0.5227273 0.2500000 0.7272727), wk = 0.0047619 k( 154) = ( 0.5113636 0.2500000 0.7386364), wk = 0.0047619 k( 155) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0047619 k( 156) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0047619 k( 157) = ( 0.5000000 0.2613636 0.7386364), wk = 0.0047619 k( 158) = ( 0.5000000 0.2727273 0.7272727), wk = 0.0047619 k( 159) = ( 0.5000000 0.2840909 0.7159091), wk = 0.0047619 k( 160) = ( 0.5000000 0.2954545 0.7045455), wk = 0.0047619 k( 161) = ( 0.5000000 0.3068182 0.6931818), wk = 0.0047619 k( 162) = ( 0.5000000 0.3181818 0.6818182), wk = 0.0047619 k( 163) = ( 0.5000000 0.3295455 0.6704545), wk = 0.0047619 k( 164) = ( 0.5000000 0.3409091 0.6590909), wk = 0.0047619 k( 165) = ( 0.5000000 0.3522727 0.6477273), wk = 0.0047619 k( 166) = ( 0.5000000 0.3636364 0.6363636), wk = 0.0047619 k( 167) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0047619 k( 168) = ( 0.5000000 0.3863636 0.6136364), wk = 0.0047619 k( 169) = ( 0.5000000 0.3977273 0.6022727), wk = 0.0047619 k( 170) = ( 0.5000000 0.4090909 0.5909091), wk = 0.0047619 k( 171) = ( 0.5000000 0.4204545 0.5795455), wk = 0.0047619 k( 172) = ( 0.5000000 0.4318182 0.5681818), wk = 0.0047619 k( 173) = ( 0.5000000 0.4431818 0.5568182), wk = 0.0047619 k( 174) = ( 0.5000000 0.4545455 0.5454545), wk = 0.0047619 k( 175) = ( 0.5000000 0.4659091 0.5340909), wk = 0.0047619 k( 176) = ( 0.5000000 0.4772727 0.5227273), wk = 0.0047619 k( 177) = ( 0.5000000 0.4886364 0.5113636), wk = 0.0047619 k( 178) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 179) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 180) = ( 0.4934211 0.4934211 0.5131579), wk = 0.0047619 k( 181) = ( 0.4868421 0.4868421 0.5263158), wk = 0.0047619 k( 182) = ( 0.4802632 0.4802632 0.5394737), wk = 0.0047619 k( 183) = ( 0.4736842 0.4736842 0.5526316), wk = 0.0047619 k( 184) = ( 0.4671053 0.4671053 0.5657895), wk = 0.0047619 k( 185) = ( 0.4605263 0.4605263 0.5789474), wk = 0.0047619 k( 186) = ( 0.4539474 0.4539474 0.5921053), wk = 0.0047619 k( 187) = ( 0.4473684 0.4473684 0.6052632), wk = 0.0047619 k( 188) = ( 0.4407895 0.4407895 0.6184211), wk = 0.0047619 k( 189) = ( 0.4342105 0.4342105 0.6315789), wk = 0.0047619 k( 190) = ( 0.4276316 0.4276316 0.6447368), wk = 0.0047619 k( 191) = ( 0.4210526 0.4210526 0.6578947), wk = 0.0047619 k( 192) = ( 0.4144737 0.4144737 0.6710526), wk = 0.0047619 k( 193) = ( 0.4078947 0.4078947 0.6842105), wk = 0.0047619 k( 194) = ( 0.4013158 0.4013158 0.6973684), wk = 0.0047619 k( 195) = ( 0.3947368 0.3947368 0.7105263), wk = 0.0047619 k( 196) = ( 0.3881579 0.3881579 0.7236842), wk = 0.0047619 k( 197) = ( 0.3815789 0.3815789 0.7368421), wk = 0.0047619 k( 198) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0047619 k( 199) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0047619 k( 200) = ( 0.6136364 0.2272727 0.6136364), wk = 0.0047619 k( 201) = ( 0.6022727 0.2045454 0.6022727), wk = 0.0047619 k( 202) = ( 0.5909091 0.1818182 0.5909091), wk = 0.0047619 k( 203) = ( 0.5795455 0.1590909 0.5795455), wk = 0.0047619 k( 204) = ( 0.5681818 0.1363636 0.5681818), wk = 0.0047619 k( 205) = ( 0.5568182 0.1136364 0.5568182), wk = 0.0047619 k( 206) = ( 0.5454545 0.0909091 0.5454545), wk = 0.0047619 k( 207) = ( 0.5340909 0.0681818 0.5340909), wk = 0.0047619 k( 208) = ( 0.5227273 0.0454546 0.5227273), wk = 0.0047619 k( 209) = ( 0.5113636 0.0227273 0.5113636), wk = 0.0047619 k( 210) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0047619 Dense grid: 272059 G-vectors FFT dimensions: ( 96, 96, 96) Smooth grid: 172575 G-vectors FFT dimensions: ( 80, 80, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.78 Mb ( 606, 84) NL pseudopotentials 1.67 Mb ( 303, 362) Each V/rho on FFT grid 0.28 Mb ( 18432) Each G-vector array 0.03 Mb ( 3780) G-vector shells 0.01 Mb ( 1118) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 3.11 Mb ( 606, 336) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.93 Mb ( 362, 2, 84) The potential is recalculated from file : ./Cs2PtCl6.save/charge-density.dat Starting wfc are 86 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 7.3 secs Computing kpt #: 2 total cpu time spent up to now is 12.2 secs Computing kpt #: 3 total cpu time spent up to now is 16.9 secs Computing kpt #: 4 total cpu time spent up to now is 21.4 secs Computing kpt #: 5 total cpu time spent up to now is 25.6 secs Computing kpt #: 6 total cpu time spent up to now is 29.9 secs Computing kpt #: 7 total cpu time spent up to now is 34.2 secs Computing kpt #: 8 total cpu time spent up to now is 39.0 secs Computing kpt #: 9 total cpu time spent up to now is 44.6 secs Computing kpt #: 10 total cpu time spent up to now is 49.2 secs Computing kpt #: 11 total cpu time spent up to now is 54.4 secs Computing kpt #: 12 total cpu time spent up to now is 59.7 secs Computing kpt #: 13 total cpu time spent up to now is 65.1 secs Computing kpt #: 14 total cpu time spent up to now is 69.8 secs Computing kpt #: 15 total cpu time spent up to now is 75.0 secs Computing kpt #: 16 total cpu time spent up to now is 80.3 secs Computing kpt #: 17 total cpu time spent up to now is 85.6 secs Computing kpt #: 18 total cpu time spent up to now is 90.9 secs Computing kpt #: 19 total cpu time spent up to now is 96.3 secs Computing kpt #: 20 total cpu time spent up to now is 102.3 secs Computing kpt #: 21 total cpu time spent up to now is 107.0 secs Computing kpt #: 22 total cpu time spent up to now is 111.6 secs Computing kpt #: 23 total cpu time spent up to now is 116.1 secs Computing kpt #: 24 total cpu time spent up to now is 120.2 secs Computing kpt #: 25 total cpu time spent up to now is 124.7 secs Computing kpt #: 26 total cpu time spent up to now is 129.2 secs Computing kpt #: 27 total cpu time spent up to now is 133.7 secs Computing kpt #: 28 total cpu time spent up to now is 138.1 secs Computing kpt #: 29 total cpu time spent up to now is 142.6 secs Computing kpt #: 30 total cpu time spent up to now is 146.9 secs Computing kpt #: 31 total cpu time spent up to now is 151.3 secs Computing kpt #: 32 total cpu time spent up to now is 155.9 secs Computing kpt #: 33 total cpu time spent up to now is 160.4 secs Computing kpt #: 34 total cpu time spent up to now is 165.4 secs Computing kpt #: 35 total cpu time spent up to now is 171.9 secs Computing kpt #: 36 total cpu time spent up to now is 176.4 secs Computing kpt #: 37 total cpu time spent up to now is 181.0 secs Computing kpt #: 38 total cpu time spent up to now is 185.7 secs Computing kpt #: 39 total cpu time spent up to now is 190.9 secs Computing kpt #: 40 total cpu time spent up to now is 195.6 secs Computing kpt #: 41 total cpu time spent up to now is 200.6 secs Computing kpt #: 42 total cpu time spent up to now is 205.9 secs Computing kpt #: 43 total cpu time spent up to now is 210.5 secs Computing kpt #: 44 total cpu time spent up to now is 216.1 secs Computing kpt #: 45 total cpu time spent up to now is 222.2 secs Computing kpt #: 46 total cpu time spent up to now is 228.9 secs Computing kpt #: 47 total cpu time spent up to now is 235.4 secs Computing kpt #: 48 total cpu time spent up to now is 240.8 secs Computing kpt #: 49 total cpu time spent up to now is 245.7 secs Computing kpt #: 50 total cpu time spent up to now is 250.5 secs Computing kpt #: 51 total cpu time spent up to now is 255.4 secs Computing kpt #: 52 total cpu time spent up to now is 260.1 secs Computing kpt #: 53 total cpu time spent up to now is 264.9 secs Computing kpt #: 54 total cpu time spent up to now is 270.1 secs Computing kpt #: 55 total cpu time spent up to now is 274.7 secs Computing kpt #: 56 total cpu time spent up to now is 279.2 secs Computing kpt #: 57 total cpu time spent up to now is 284.4 secs Computing kpt #: 58 total cpu time spent up to now is 289.0 secs Computing kpt #: 59 total cpu time spent up to now is 293.5 secs Computing kpt #: 60 total cpu time spent up to now is 298.0 secs Computing kpt #: 61 total cpu time spent up to now is 302.7 secs Computing kpt #: 62 total cpu time spent up to now is 306.8 secs Computing kpt #: 63 total cpu time spent up to now is 311.3 secs Computing kpt #: 64 total cpu time spent up to now is 315.5 secs Computing kpt #: 65 total cpu time spent up to now is 319.8 secs Computing kpt #: 66 total cpu time spent up to now is 325.0 secs Computing kpt #: 67 total cpu time spent up to now is 329.8 secs Computing kpt #: 68 total cpu time spent up to now is 334.9 secs Computing kpt #: 69 total cpu time spent up to now is 339.1 secs Computing kpt #: 70 total cpu time spent up to now is 343.3 secs Computing kpt #: 71 total cpu time spent up to now is 347.2 secs Computing kpt #: 72 total cpu time spent up to now is 351.3 secs Computing kpt #: 73 total cpu time spent up to now is 355.2 secs Computing kpt #: 74 total cpu time spent up to now is 359.3 secs Computing kpt #: 75 total cpu time spent up to now is 363.7 secs Computing kpt #: 76 total cpu time spent up to now is 369.2 secs Computing kpt #: 77 total cpu time spent up to now is 374.0 secs Computing kpt #: 78 total cpu time spent up to now is 378.9 secs Computing kpt #: 79 total cpu time spent up to now is 383.4 secs Computing kpt #: 80 total cpu time spent up to now is 387.9 secs Computing kpt #: 81 total cpu time spent up to now is 392.3 secs Computing kpt #: 82 total cpu time spent up to now is 396.9 secs Computing kpt #: 83 total cpu time spent up to now is 401.6 secs Computing kpt #: 84 total cpu time spent up to now is 406.5 secs Computing kpt #: 85 total cpu time spent up to now is 411.0 secs Computing kpt #: 86 total cpu time spent up to now is 416.2 secs Computing kpt #: 87 total cpu time spent up to now is 420.9 secs Computing kpt #: 88 total cpu time spent up to now is 425.5 secs Computing kpt #: 89 total cpu time spent up to now is 430.3 secs Computing kpt #: 90 total cpu time spent up to now is 435.0 secs Computing kpt #: 91 total cpu time spent up to now is 439.4 secs Computing kpt #: 92 total cpu time spent up to now is 444.3 secs Computing kpt #: 93 total cpu time spent up to now is 449.0 secs Computing kpt #: 94 total cpu time spent up to now is 453.7 secs Computing kpt #: 95 total cpu time spent up to now is 458.4 secs Computing kpt #: 96 total cpu time spent up to now is 463.6 secs Computing kpt #: 97 total cpu time spent up to now is 468.2 secs Computing kpt #: 98 total cpu time spent up to now is 472.9 secs Computing kpt #: 99 total cpu time spent up to now is 477.2 secs Computing kpt #: 100 total cpu time spent up to now is 482.5 secs Computing kpt #: 101 total cpu time spent up to now is 487.0 secs Computing kpt #: 102 total cpu time spent up to now is 491.4 secs Computing kpt #: 103 total cpu time spent up to now is 495.7 secs Computing kpt #: 104 total cpu time spent up to now is 500.1 secs Computing kpt #: 105 total cpu time spent up to now is 504.4 secs Computing kpt #: 106 total cpu time spent up to now is 508.7 secs Computing kpt #: 107 total cpu time spent up to now is 512.9 secs Computing kpt #: 108 total cpu time spent up to now is 516.9 secs Computing kpt #: 109 total cpu time spent up to now is 521.4 secs Computing kpt #: 110 total cpu time spent up to now is 525.1 secs Computing kpt #: 111 total cpu time spent up to now is 528.8 secs Computing kpt #: 112 total cpu time spent up to now is 532.4 secs Computing kpt #: 113 total cpu time spent up to now is 536.1 secs Computing kpt #: 114 total cpu time spent up to now is 539.7 secs Computing kpt #: 115 total cpu time spent up to now is 543.4 secs Computing kpt #: 116 total cpu time spent up to now is 547.2 secs Computing kpt #: 117 total cpu time spent up to now is 551.0 secs Computing kpt #: 118 total cpu time spent up to now is 554.8 secs Computing kpt #: 119 total cpu time spent up to now is 558.7 secs Computing kpt #: 120 total cpu time spent up to now is 563.3 secs Computing kpt #: 121 total cpu time spent up to now is 567.5 secs Computing kpt #: 122 total cpu time spent up to now is 572.2 secs Computing kpt #: 123 total cpu time spent up to now is 576.9 secs Computing kpt #: 124 total cpu time spent up to now is 581.7 secs Computing kpt #: 125 total cpu time spent up to now is 586.3 secs Computing kpt #: 126 total cpu time spent up to now is 591.0 secs Computing kpt #: 127 total cpu time spent up to now is 595.7 secs Computing kpt #: 128 total cpu time spent up to now is 600.5 secs Computing kpt #: 129 total cpu time spent up to now is 605.6 secs Computing kpt #: 130 total cpu time spent up to now is 610.4 secs Computing kpt #: 131 total cpu time spent up to now is 615.1 secs Computing kpt #: 132 total cpu time spent up to now is 619.3 secs Computing kpt #: 133 total cpu time spent up to now is 623.6 secs Computing kpt #: 134 total cpu time spent up to now is 627.9 secs Computing kpt #: 135 total cpu time spent up to now is 632.1 secs Computing kpt #: 136 total cpu time spent up to now is 636.3 secs Computing kpt #: 137 total cpu time spent up to now is 640.6 secs Computing kpt #: 138 total cpu time spent up to now is 645.5 secs Computing kpt #: 139 total cpu time spent up to now is 650.1 secs Computing kpt #: 140 total cpu time spent up to now is 654.7 secs Computing kpt #: 141 total cpu time spent up to now is 659.0 secs Computing kpt #: 142 total cpu time spent up to now is 663.6 secs Computing kpt #: 143 total cpu time spent up to now is 668.2 secs Computing kpt #: 144 total cpu time spent up to now is 672.9 secs Computing kpt #: 145 total cpu time spent up to now is 677.6 secs Computing kpt #: 146 total cpu time spent up to now is 682.9 secs Computing kpt #: 147 total cpu time spent up to now is 687.4 secs Computing kpt #: 148 total cpu time spent up to now is 692.0 secs Computing kpt #: 149 total cpu time spent up to now is 696.5 secs Computing kpt #: 150 total cpu time spent up to now is 701.2 secs Computing kpt #: 151 total cpu time spent up to now is 706.0 secs Computing kpt #: 152 total cpu time spent up to now is 710.9 secs Computing kpt #: 153 total cpu time spent up to now is 715.7 secs Computing kpt #: 154 total cpu time spent up to now is 720.7 secs Computing kpt #: 155 total cpu time spent up to now is 727.2 secs Computing kpt #: 156 total cpu time spent up to now is 732.1 secs Computing kpt #: 157 total cpu time spent up to now is 737.0 secs Computing kpt #: 158 total cpu time spent up to now is 741.7 secs Computing kpt #: 159 total cpu time spent up to now is 746.4 secs Computing kpt #: 160 total cpu time spent up to now is 750.5 secs Computing kpt #: 161 total cpu time spent up to now is 754.8 secs Computing kpt #: 162 total cpu time spent up to now is 759.0 secs Computing kpt #: 163 total cpu time spent up to now is 763.7 secs Computing kpt #: 164 total cpu time spent up to now is 767.9 secs Computing kpt #: 165 total cpu time spent up to now is 772.0 secs Computing kpt #: 166 total cpu time spent up to now is 776.3 secs Computing kpt #: 167 total cpu time spent up to now is 780.3 secs Computing kpt #: 168 total cpu time spent up to now is 785.5 secs Computing kpt #: 169 total cpu time spent up to now is 804.2 secs Computing kpt #: 170 total cpu time spent up to now is 809.2 secs Computing kpt #: 171 total cpu time spent up to now is 814.3 secs Computing kpt #: 172 total cpu time spent up to now is 819.0 secs Computing kpt #: 173 total cpu time spent up to now is 823.7 secs Computing kpt #: 174 total cpu time spent up to now is 828.3 secs Computing kpt #: 175 total cpu time spent up to now is 833.1 secs Computing kpt #: 176 total cpu time spent up to now is 837.7 secs Computing kpt #: 177 total cpu time spent up to now is 842.5 secs Computing kpt #: 178 total cpu time spent up to now is 847.3 secs Computing kpt #: 179 total cpu time spent up to now is 852.5 secs Computing kpt #: 180 total cpu time spent up to now is 857.0 secs Computing kpt #: 181 total cpu time spent up to now is 861.6 secs Computing kpt #: 182 total cpu time spent up to now is 866.5 secs Computing kpt #: 183 total cpu time spent up to now is 871.7 secs Computing kpt #: 184 total cpu time spent up to now is 876.6 secs Computing kpt #: 185 total cpu time spent up to now is 881.3 secs Computing kpt #: 186 total cpu time spent up to now is 885.9 secs Computing kpt #: 187 total cpu time spent up to now is 890.3 secs Computing kpt #: 188 total cpu time spent up to now is 894.9 secs Computing kpt #: 189 total cpu time spent up to now is 899.7 secs Computing kpt #: 190 total cpu time spent up to now is 904.1 secs Computing kpt #: 191 total cpu time spent up to now is 908.3 secs Computing kpt #: 192 total cpu time spent up to now is 913.2 secs Computing kpt #: 193 total cpu time spent up to now is 917.6 secs Computing kpt #: 194 total cpu time spent up to now is 921.8 secs Computing kpt #: 195 total cpu time spent up to now is 926.1 secs Computing kpt #: 196 total cpu time spent up to now is 930.4 secs Computing kpt #: 197 total cpu time spent up to now is 935.1 secs Computing kpt #: 198 total cpu time spent up to now is 939.9 secs Computing kpt #: 199 total cpu time spent up to now is 945.0 secs Computing kpt #: 200 total cpu time spent up to now is 950.1 secs Computing kpt #: 201 total cpu time spent up to now is 954.8 secs Computing kpt #: 202 total cpu time spent up to now is 959.4 secs Computing kpt #: 203 total cpu time spent up to now is 963.9 secs Computing kpt #: 204 total cpu time spent up to now is 968.5 secs Computing kpt #: 205 total cpu time spent up to now is 973.0 secs Computing kpt #: 206 total cpu time spent up to now is 977.6 secs Computing kpt #: 207 total cpu time spent up to now is 982.2 secs Computing kpt #: 208 total cpu time spent up to now is 986.9 secs Computing kpt #: 209 total cpu time spent up to now is 991.4 secs Computing kpt #: 210 total cpu time spent up to now is 996.0 secs ethr = 1.43E-08, avg # of iterations = 45.0 total cpu time spent up to now is 996.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 21595 PWs) bands (ev): -14.5754 -14.5754 -14.5236 -14.5236 -11.1775 -11.1775 -10.4583 -10.4583 -10.4185 -10.4185 -10.4185 -10.4185 -10.3896 -10.3896 -10.3896 -10.3896 -3.5903 -3.5903 -3.3955 -3.3955 -2.4653 -2.4653 -2.4653 -2.4653 -2.0574 -2.0574 -2.0574 -2.0574 -1.8540 -1.8540 -1.6606 -1.6606 -1.6606 -1.6606 -0.4794 -0.4794 -0.4794 -0.4794 -0.3681 -0.3681 0.1304 0.1304 0.4843 0.4843 0.4843 0.4843 1.9338 1.9338 1.9338 1.9338 1.9925 1.9925 2.2569 2.2569 2.4846 2.4846 2.4846 2.4846 2.6461 2.6461 2.6461 2.6461 2.6697 2.6697 2.7440 2.7440 2.7440 2.7440 2.9710 2.9710 5.6420 5.6420 5.6420 5.6420 8.6014 8.6014 9.1554 9.1554 9.1554 9.1554 9.5376 9.5376 9.9597 9.9597 k = 0.0161-0.0093 0.0132 ( 21595 PWs) bands (ev): -14.5753 -14.5753 -14.5236 -14.5236 -11.1775 -11.1775 -10.4584 -10.4584 -10.4189 -10.4189 -10.4185 -10.4185 -10.3897 -10.3897 -10.3894 -10.3894 -3.5897 -3.5897 -3.3954 -3.3954 -2.4645 -2.4645 -2.4643 -2.4643 -2.0574 -2.0574 -2.0571 -2.0571 -1.8530 -1.8530 -1.6609 -1.6609 -1.6606 -1.6606 -0.4800 -0.4800 -0.4800 -0.4800 -0.3684 -0.3684 0.1306 0.1306 0.4841 0.4841 0.4844 0.4844 1.9333 1.9333 1.9335 1.9335 1.9920 1.9920 2.2558 2.2558 2.4827 2.4827 2.4835 2.4835 2.6454 2.6454 2.6466 2.6466 2.6689 2.6689 2.7430 2.7430 2.7435 2.7435 2.9715 2.9715 5.6402 5.6402 5.6420 5.6420 8.6051 8.6051 9.1581 9.1581 9.1581 9.1581 9.5401 9.5401 9.9628 9.9628 k = 0.0323-0.0186 0.0263 ( 21603 PWs) bands (ev): -14.5751 -14.5751 -14.5237 -14.5237 -11.1773 -11.1773 -10.4586 -10.4586 -10.4201 -10.4201 -10.4185 -10.4185 -10.3898 -10.3898 -10.3889 -10.3889 -3.5882 -3.5882 -3.3951 -3.3951 -2.4621 -2.4621 -2.4614 -2.4614 -2.0575 -2.0575 -2.0564 -2.0564 -1.8500 -1.8500 -1.6618 -1.6618 -1.6607 -1.6607 -0.4819 -0.4819 -0.4818 -0.4818 -0.3691 -0.3691 0.1312 0.1312 0.4836 0.4836 0.4847 0.4847 1.9318 1.9318 1.9327 1.9327 1.9907 1.9907 2.2527 2.2527 2.4770 2.4770 2.4801 2.4801 2.6433 2.6433 2.6480 2.6480 2.6665 2.6665 2.7401 2.7401 2.7422 2.7422 2.9729 2.9729 5.6347 5.6347 5.6419 5.6419 8.6160 8.6160 9.1663 9.1663 9.1664 9.1664 9.5476 9.5476 9.9722 9.9722 k = 0.0484-0.0279 0.0395 ( 21643 PWs) bands (ev): -14.5748 -14.5748 -14.5238 -14.5238 -11.1771 -11.1771 -10.4591 -10.4591 -10.4219 -10.4219 -10.4184 -10.4184 -10.3901 -10.3901 -10.3881 -10.3881 -3.5855 -3.5855 -3.3945 -3.3945 -2.4581 -2.4581 -2.4564 -2.4564 -2.0577 -2.0577 -2.0551 -2.0551 -1.8449 -1.8449 -1.6632 -1.6632 -1.6608 -1.6608 -0.4851 -0.4851 -0.4847 -0.4847 -0.3703 -0.3703 0.1321 0.1321 0.4826 0.4826 0.4851 0.4851 1.9294 1.9294 1.9313 1.9313 1.9884 1.9884 2.2475 2.2475 2.4677 2.4677 2.4747 2.4747 2.6397 2.6397 2.6503 2.6503 2.6625 2.6625 2.7353 2.7353 2.7403 2.7403 2.9752 2.9752 5.6256 5.6256 5.6418 5.6418 8.6341 8.6341 9.1799 9.1799 9.1801 9.1801 9.5602 9.5602 9.9879 9.9879 k = 0.0645-0.0372 0.0527 ( 21659 PWs) bands (ev): -14.5744 -14.5744 -14.5240 -14.5240 -11.1767 -11.1767 -10.4598 -10.4598 -10.4243 -10.4243 -10.4183 -10.4183 -10.3904 -10.3904 -10.3871 -10.3871 -3.5819 -3.5819 -3.3936 -3.3936 -2.4524 -2.4524 -2.4495 -2.4495 -2.0579 -2.0579 -2.0533 -2.0533 -1.8379 -1.8379 -1.6652 -1.6652 -1.6609 -1.6609 -0.4896 -0.4896 -0.4888 -0.4888 -0.3720 -0.3720 0.1334 0.1334 0.4813 0.4813 0.4857 0.4857 1.9260 1.9260 1.9295 1.9295 1.9853 1.9853 2.2400 2.2400 2.4552 2.4552 2.4674 2.4674 2.6344 2.6344 2.6530 2.6530 2.6568 2.6568 2.7287 2.7287 2.7379 2.7379 2.9785 2.9785 5.6130 5.6130 5.6417 5.6417 8.6593 8.6593 9.1988 9.1988 9.1992 9.1992 9.5779 9.5779 10.0096 10.0096 k = 0.0806-0.0466 0.0658 ( 21659 PWs) bands (ev): -14.5738 -14.5738 -14.5242 -14.5242 -11.1762 -11.1762 -10.4607 -10.4607 -10.4270 -10.4270 -10.4181 -10.4181 -10.3908 -10.3908 -10.3861 -10.3861 -3.5773 -3.5773 -3.3926 -3.3926 -2.4453 -2.4453 -2.4407 -2.4407 -2.0582 -2.0582 -2.0511 -2.0511 -1.8291 -1.8291 -1.6677 -1.6677 -1.6611 -1.6611 -0.4954 -0.4954 -0.4941 -0.4941 -0.3741 -0.3741 0.1351 0.1351 0.4796 0.4796 0.4865 0.4865 1.9218 1.9218 1.9272 1.9272 1.9814 1.9814 2.2303 2.2303 2.4399 2.4399 2.4583 2.4583 2.6274 2.6274 2.6482 2.6482 2.6571 2.6571 2.7202 2.7202 2.7353 2.7353 2.9828 2.9828 5.5969 5.5969 5.6415 5.6415 8.6915 8.6915 9.2230 9.2230 9.2233 9.2233 9.6009 9.6009 10.0373 10.0373 k = 0.0968-0.0559 0.0790 ( 21643 PWs) bands (ev): -14.5731 -14.5731 -14.5245 -14.5245 -11.1756 -11.1756 -10.4618 -10.4618 -10.4299 -10.4299 -10.4180 -10.4180 -10.3913 -10.3913 -10.3851 -10.3851 -3.5717 -3.5717 -3.3913 -3.3913 -2.4366 -2.4366 -2.4299 -2.4299 -2.0586 -2.0586 -2.0485 -2.0485 -1.8184 -1.8184 -1.6707 -1.6707 -1.6613 -1.6613 -0.5025 -0.5025 -0.5004 -0.5004 -0.3765 -0.3765 0.1370 0.1370 0.4775 0.4775 0.4875 0.4875 1.9166 1.9166 1.9246 1.9246 1.9769 1.9769 2.2183 2.2183 2.4224 2.4224 2.4479 2.4479 2.6185 2.6185 2.6382 2.6382 2.6610 2.6610 2.7101 2.7101 2.7328 2.7328 2.9880 2.9880 5.5776 5.5776 5.6413 5.6413 8.7304 8.7304 9.2522 9.2522 9.2524 9.2524 9.6292 9.6292 10.0707 10.0707 k = 0.1129-0.0652 0.0922 ( 21655 PWs) bands (ev): -14.5723 -14.5723 -14.5248 -14.5248 -11.1750 -11.1750 -10.4632 -10.4632 -10.4330 -10.4330 -10.4178 -10.4178 -10.3918 -10.3918 -10.3843 -10.3843 -3.5653 -3.5653 -3.3898 -3.3898 -2.4265 -2.4265 -2.4174 -2.4174 -2.0590 -2.0590 -2.0454 -2.0454 -1.8060 -1.8060 -1.6740 -1.6740 -1.6616 -1.6616 -0.5110 -0.5110 -0.5078 -0.5078 -0.3792 -0.3792 0.1393 0.1393 0.4750 0.4750 0.4887 0.4887 1.9107 1.9107 1.9217 1.9217 1.9720 1.9720 2.2036 2.2036 2.4031 2.4031 2.4362 2.4362 2.6078 2.6078 2.6259 2.6259 2.6652 2.6652 2.6983 2.6983 2.7304 2.7304 2.9941 2.9941 5.5550 5.5550 5.6411 5.6411 8.7757 8.7757 9.2861 9.2861 9.2863 9.2863 9.6630 9.6630 10.1097 10.1097 k = 0.1290-0.0745 0.1054 ( 21647 PWs) bands (ev): -14.5714 -14.5714 -14.5252 -14.5252 -11.1743 -11.1743 -10.4648 -10.4648 -10.4362 -10.4362 -10.4176 -10.4176 -10.3925 -10.3925 -10.3835 -10.3835 -3.5580 -3.5580 -3.3882 -3.3882 -2.4149 -2.4149 -2.4030 -2.4030 -2.0596 -2.0596 -2.0419 -2.0419 -1.7922 -1.7922 -1.6776 -1.6776 -1.6619 -1.6619 -0.5209 -0.5209 -0.5162 -0.5162 -0.3821 -0.3821 0.1417 0.1417 0.4721 0.4721 0.4901 0.4901 1.9040 1.9040 1.9186 1.9186 1.9667 1.9667 2.1863 2.1863 2.3828 2.3828 2.4234 2.4234 2.5952 2.5952 2.6114 2.6114 2.6695 2.6695 2.6849 2.6849 2.7283 2.7283 3.0011 3.0011 5.5295 5.5295 5.6408 5.6408 8.8273 8.8273 9.3242 9.3242 9.3252 9.3252 9.7023 9.7023 10.1539 10.1539 k = 0.1452-0.0838 0.1185 ( 21643 PWs) bands (ev): -14.5705 -14.5705 -14.5256 -14.5256 -11.1734 -11.1734 -10.4668 -10.4668 -10.4393 -10.4393 -10.4173 -10.4173 -10.3932 -10.3932 -10.3829 -10.3829 -3.5499 -3.5499 -3.3863 -3.3863 -2.4021 -2.4021 -2.3869 -2.3869 -2.0602 -2.0602 -2.0381 -2.0381 -1.7769 -1.7769 -1.6814 -1.6814 -1.6623 -1.6623 -0.5321 -0.5321 -0.5256 -0.5256 -0.3852 -0.3852 0.1444 0.1444 0.4688 0.4688 0.4918 0.4918 1.8965 1.8965 1.9154 1.9154 1.9612 1.9612 2.1660 2.1660 2.3621 2.3621 2.4099 2.4099 2.5809 2.5809 2.5951 2.5951 2.6702 2.6702 2.6737 2.6737 2.7266 2.7266 3.0087 3.0087 5.5013 5.5013 5.6405 5.6405 8.8846 8.8846 9.3664 9.3664 9.3684 9.3684 9.7472 9.7472 10.2030 10.2030 k = 0.1613-0.0931 0.1317 ( 21603 PWs) bands (ev): -14.5694 -14.5694 -14.5260 -14.5260 -11.1726 -11.1726 -10.4691 -10.4691 -10.4423 -10.4423 -10.4171 -10.4171 -10.3939 -10.3939 -10.3824 -10.3824 -3.5411 -3.5411 -3.3843 -3.3843 -2.3880 -2.3880 -2.3692 -2.3692 -2.0610 -2.0610 -2.0339 -2.0339 -1.7607 -1.7607 -1.6851 -1.6851 -1.6628 -1.6628 -0.5447 -0.5447 -0.5358 -0.5358 -0.3885 -0.3885 0.1472 0.1472 0.4651 0.4651 0.4937 0.4937 1.8884 1.8884 1.9122 1.9122 1.9557 1.9557 2.1426 2.1426 2.3416 2.3416 2.3957 2.3957 2.5649 2.5649 2.5769 2.5769 2.6542 2.6542 2.6779 2.6779 2.7252 2.7252 3.0169 3.0169 5.4706 5.4706 5.6402 5.6402 8.9472 8.9472 9.4122 9.4122 9.4159 9.4159 9.7976 9.7976 10.2566 10.2566 k = 0.1774-0.1024 0.1449 ( 21603 PWs) bands (ev): -14.5683 -14.5683 -14.5264 -14.5264 -11.1716 -11.1716 -10.4717 -10.4717 -10.4451 -10.4451 -10.4168 -10.4168 -10.3947 -10.3947 -10.3822 -10.3822 -3.5317 -3.5317 -3.3822 -3.3822 -2.3727 -2.3727 -2.3499 -2.3499 -2.0619 -2.0619 -2.0295 -2.0295 -1.7442 -1.7442 -1.6880 -1.6880 -1.6633 -1.6633 -0.5586 -0.5586 -0.5469 -0.5469 -0.3919 -0.3919 0.1501 0.1501 0.4610 0.4610 0.4958 0.4958 1.8797 1.8797 1.9091 1.9091 1.9503 1.9503 2.1162 2.1162 2.3217 2.3217 2.3811 2.3811 2.5476 2.5476 2.5572 2.5572 2.6370 2.6370 2.6818 2.6818 2.7243 2.7243 3.0256 3.0256 5.4378 5.4378 5.6399 5.6399 9.0146 9.0146 9.4615 9.4615 9.4673 9.4673 9.8536 9.8536 10.3141 10.3141 k = 0.1935-0.1117 0.1580 ( 21599 PWs) bands (ev): -14.5671 -14.5671 -14.5269 -14.5269 -11.1706 -11.1706 -10.4747 -10.4747 -10.4477 -10.4477 -10.4165 -10.4165 -10.3956 -10.3956 -10.3820 -10.3820 -3.5218 -3.5218 -3.3799 -3.3799 -2.3564 -2.3564 -2.3292 -2.3292 -2.0630 -2.0630 -2.0248 -2.0248 -1.7292 -1.7292 -1.6884 -1.6884 -1.6639 -1.6639 -0.5738 -0.5738 -0.5587 -0.5587 -0.3953 -0.3953 0.1530 0.1530 0.4565 0.4565 0.4983 0.4983 1.8705 1.8705 1.9062 1.9062 1.9452 1.9452 2.0869 2.0869 2.3028 2.3028 2.3662 2.3662 2.5290 2.5290 2.5362 2.5362 2.6189 2.6189 2.6852 2.6852 2.7237 2.7237 3.0346 3.0346 5.4032 5.4032 5.6395 5.6395 9.0863 9.0863 9.5138 9.5138 9.5222 9.5222 9.9150 9.9150 10.3748 10.3748 k = 0.2097-0.1211 0.1712 ( 21583 PWs) bands (ev): -14.5659 -14.5659 -14.5274 -14.5274 -11.1696 -11.1696 -10.4779 -10.4779 -10.4500 -10.4500 -10.4162 -10.4162 -10.3965 -10.3965 -10.3820 -10.3820 -3.5114 -3.5114 -3.3775 -3.3775 -2.3391 -2.3391 -2.3071 -2.3071 -2.0642 -2.0642 -2.0199 -2.0199 -1.7200 -1.7200 -1.6823 -1.6823 -1.6646 -1.6646 -0.5902 -0.5902 -0.5711 -0.5711 -0.3988 -0.3988 0.1560 0.1560 0.4517 0.4517 0.5010 0.5010 1.8609 1.8609 1.9036 1.9036 1.9405 1.9405 2.0551 2.0551 2.2850 2.2850 2.3511 2.3511 2.5094 2.5094 2.5141 2.5141 2.6000 2.6000 2.6882 2.6882 2.7237 2.7237 3.0438 3.0438 5.3671 5.3671 5.6392 5.6392 9.1615 9.1615 9.5689 9.5689 9.5802 9.5802 9.9815 9.9815 10.4383 10.4383 k = 0.2258-0.1304 0.1844 ( 21579 PWs) bands (ev): -14.5646 -14.5646 -14.5279 -14.5279 -11.1686 -11.1686 -10.4814 -10.4814 -10.4522 -10.4522 -10.4159 -10.4159 -10.3974 -10.3974 -10.3822 -10.3822 -3.5007 -3.5007 -3.3751 -3.3751 -2.3211 -2.3211 -2.2838 -2.2838 -2.0656 -2.0656 -2.0148 -2.0148 -1.7186 -1.7186 -1.6675 -1.6675 -1.6655 -1.6655 -0.6078 -0.6078 -0.5841 -0.5841 -0.4022 -0.4022 0.1588 0.1588 0.4466 0.4466 0.5040 0.5040 1.8509 1.8509 1.9013 1.9013 1.9363 1.9363 2.0212 2.0212 2.2684 2.2684 2.3360 2.3360 2.4891 2.4891 2.4911 2.4911 2.5805 2.5805 2.6906 2.6906 2.7241 2.7241 3.0530 3.0530 5.3298 5.3298 5.6388 5.6388 9.2395 9.2395 9.6265 9.6265 9.6411 9.6411 10.0529 10.0529 10.5039 10.5039 k = 0.2419-0.1397 0.1975 ( 21563 PWs) bands (ev): -14.5633 -14.5633 -14.5284 -14.5284 -11.1675 -11.1675 -10.4850 -10.4850 -10.4541 -10.4541 -10.4156 -10.4156 -10.3983 -10.3983 -10.3824 -10.3824 -3.4897 -3.4897 -3.3726 -3.3726 -2.3023 -2.3023 -2.2594 -2.2594 -2.0672 -2.0672 -2.0096 -2.0096 -1.7213 -1.7213 -1.6664 -1.6664 -1.6482 -1.6482 -0.6263 -0.6263 -0.5975 -0.5975 -0.4056 -0.4056 0.1615 0.1615 0.4411 0.4411 0.5073 0.5073 1.8407 1.8407 1.8995 1.8995 1.9328 1.9328 1.9857 1.9857 2.2529 2.2529 2.3211 2.3211 2.4674 2.4674 2.4682 2.4682 2.5606 2.5606 2.6924 2.6924 2.7249 2.7249 3.0622 3.0622 5.2919 5.2919 5.6384 5.6384 9.3194 9.3194 9.6864 9.6864 9.7042 9.7042 10.1287 10.1287 10.5715 10.5715 k = 0.2581-0.1490 0.2107 ( 21587 PWs) bands (ev): -14.5620 -14.5620 -14.5289 -14.5289 -11.1664 -11.1664 -10.4887 -10.4887 -10.4559 -10.4559 -10.4153 -10.4153 -10.3992 -10.3992 -10.3828 -10.3828 -3.4786 -3.4786 -3.3701 -3.3701 -2.2830 -2.2830 -2.2341 -2.2341 -2.0690 -2.0690 -2.0043 -2.0043 -1.7254 -1.7254 -1.6676 -1.6676 -1.6270 -1.6270 -0.6458 -0.6458 -0.6113 -0.6113 -0.4089 -0.4089 0.1641 0.1641 0.4354 0.4354 0.5108 0.5108 1.8305 1.8305 1.8982 1.8982 1.9299 1.9299 1.9494 1.9494 2.2384 2.2384 2.3063 2.3063 2.4433 2.4433 2.4471 2.4471 2.5405 2.5405 2.6936 2.6936 2.7261 2.7261 3.0712 3.0712 5.2537 5.2537 5.6380 5.6380 9.4002 9.4002 9.7483 9.7483 9.7691 9.7691 10.2085 10.2085 10.6410 10.6410 k = 0.2742-0.1583 0.2239 ( 21567 PWs) bands (ev): -14.5607 -14.5607 -14.5294 -14.5294 -11.1654 -11.1654 -10.4924 -10.4924 -10.4575 -10.4575 -10.4150 -10.4150 -10.4001 -10.4001 -10.3832 -10.3832 -3.4675 -3.4675 -3.3676 -3.3676 -2.2632 -2.2632 -2.2081 -2.2081 -2.0709 -2.0709 -1.9990 -1.9990 -1.7301 -1.7301 -1.6689 -1.6689 -1.6050 -1.6050 -0.6661 -0.6661 -0.6252 -0.6252 -0.4121 -0.4121 0.1665 0.1665 0.4296 0.4296 0.5146 0.5146 1.8202 1.8202 1.8971 1.8971 1.9128 1.9128 1.9277 1.9277 2.2249 2.2249 2.2920 2.2920 2.4191 2.4191 2.4258 2.4258 2.5204 2.5204 2.6943 2.6943 2.7276 2.7276 3.0799 3.0799 5.2156 5.2156 5.6376 5.6376 9.4809 9.4809 9.8121 9.8121 9.8352 9.8352 10.2916 10.2916 10.7124 10.7124 k = 0.2903-0.1676 0.2370 ( 21587 PWs) bands (ev): -14.5595 -14.5595 -14.5299 -14.5299 -11.1643 -11.1643 -10.4961 -10.4961 -10.4590 -10.4590 -10.4147 -10.4147 -10.4010 -10.4010 -10.3837 -10.3837 -3.4565 -3.4565 -3.3651 -3.3651 -2.2433 -2.2433 -2.1817 -2.1817 -2.0730 -2.0730 -1.9936 -1.9936 -1.7351 -1.7351 -1.6704 -1.6704 -1.5828 -1.5828 -0.6869 -0.6869 -0.6392 -0.6392 -0.4151 -0.4151 0.1686 0.1686 0.4236 0.4236 0.5185 0.5185 1.8101 1.8101 1.8751 1.8751 1.8980 1.8980 1.9263 1.9263 2.2123 2.2123 2.2782 2.2782 2.3948 2.3948 2.4046 2.4046 2.5004 2.5004 2.6946 2.6946 2.7293 2.7293 3.0884 3.0884 5.1779 5.1779 5.6373 5.6373 9.5603 9.5603 9.8774 9.8774 9.9021 9.9021 10.3774 10.3774 10.7532 10.7533 k = 0.3065-0.1769 0.2502 ( 21588 PWs) bands (ev): -14.5582 -14.5582 -14.5304 -14.5304 -11.1633 -11.1633 -10.4998 -10.4998 -10.4604 -10.4604 -10.4144 -10.4144 -10.4019 -10.4019 -10.3843 -10.3843 -3.4457 -3.4457 -3.3626 -3.3626 -2.2233 -2.2233 -2.1550 -2.1550 -2.0751 -2.0751 -1.9881 -1.9881 -1.7401 -1.7401 -1.6721 -1.6721 -1.5606 -1.5606 -0.7081 -0.7081 -0.6531 -0.6531 -0.4180 -0.4180 0.1704 0.1704 0.4175 0.4175 0.5226 0.5226 1.8002 1.8002 1.8391 1.8391 1.8983 1.8983 1.9257 1.9257 2.2006 2.2006 2.2650 2.2650 2.3708 2.3708 2.3837 2.3837 2.4809 2.4809 2.6946 2.6946 2.7310 2.7310 3.0964 3.0964 5.1412 5.1412 5.6369 5.6369 9.6373 9.6373 9.9440 9.9440 9.9689 9.9689 10.4650 10.4650 10.7677 10.7677 k = 0.3226-0.1862 0.2634 ( 21572 PWs) bands (ev): -14.5570 -14.5570 -14.5309 -14.5309 -11.1624 -11.1624 -10.5033 -10.5033 -10.4617 -10.4617 -10.4141 -10.4141 -10.4027 -10.4027 -10.3849 -10.3849 -3.4352 -3.4352 -3.3602 -3.3602 -2.2034 -2.2034 -2.1285 -2.1285 -2.0773 -2.0773 -1.9825 -1.9825 -1.7452 -1.7452 -1.6741 -1.6741 -1.5388 -1.5388 -0.7295 -0.7295 -0.6668 -0.6668 -0.4207 -0.4207 0.1720 0.1720 0.4115 0.4115 0.5269 0.5269 1.7907 1.7907 1.8039 1.8039 1.8995 1.8995 1.9257 1.9257 2.1897 2.1897 2.2526 2.2526 2.3472 2.3472 2.3633 2.3633 2.4620 2.4620 2.6944 2.6944 2.7327 2.7327 3.1040 3.1040 5.1057 5.1057 5.6366 5.6366 9.7109 9.7109 10.0113 10.0113 10.0350 10.0350 10.5534 10.5534 10.7827 10.7827 k = 0.3387-0.1956 0.2766 ( 21592 PWs) bands (ev): -14.5559 -14.5559 -14.5313 -14.5313 -11.1614 -11.1614 -10.5066 -10.5066 -10.4629 -10.4629 -10.4138 -10.4138 -10.4035 -10.4035 -10.3855 -10.3855 -3.4252 -3.4252 -3.3580 -3.3580 -2.1839 -2.1839 -2.1025 -2.1025 -2.0796 -2.0796 -1.9767 -1.9767 -1.7502 -1.7502 -1.6764 -1.6764 -1.5178 -1.5178 -0.7508 -0.7508 -0.6801 -0.6801 -0.4232 -0.4232 0.1733 0.1733 0.4055 0.4055 0.5311 0.5311 1.7701 1.7701 1.7817 1.7817 1.9013 1.9013 1.9265 1.9265 2.1797 2.1797 2.2410 2.2410 2.3243 2.3243 2.3435 2.3435 2.4438 2.4438 2.6941 2.6941 2.7342 2.7342 3.1110 3.1110 5.0719 5.0719 5.6362 5.6362 9.7800 9.7800 10.0785 10.0785 10.0996 10.0996 10.6415 10.6415 10.7983 10.7983 k = 0.3548-0.2049 0.2897 ( 21576 PWs) bands (ev): -14.5548 -14.5548 -14.5318 -14.5318 -11.1606 -11.1606 -10.5097 -10.5097 -10.4639 -10.4639 -10.4136 -10.4136 -10.4042 -10.4042 -10.3862 -10.3862 -3.4157 -3.4157 -3.3558 -3.3558 -2.1651 -2.1651 -2.0818 -2.0818 -2.0776 -2.0776 -1.9705 -1.9705 -1.7552 -1.7552 -1.6791 -1.6791 -1.4977 -1.4977 -0.7717 -0.7717 -0.6929 -0.6929 -0.4254 -0.4254 0.1744 0.1744 0.3998 0.3998 0.5354 0.5354 1.7382 1.7382 1.7732 1.7732 1.9037 1.9037 1.9279 1.9279 2.1706 2.1706 2.2304 2.2304 2.3023 2.3023 2.3245 2.3245 2.4267 2.4267 2.6936 2.6936 2.7357 2.7357 3.1175 3.1175 5.0402 5.0402 5.6359 5.6359 9.8439 9.8439 10.1449 10.1449 10.1619 10.1619 10.7279 10.7279 10.8141 10.8141 k = 0.3710-0.2142 0.3029 ( 21576 PWs) bands (ev): -14.5538 -14.5538 -14.5321 -14.5321 -11.1598 -11.1598 -10.5125 -10.5125 -10.4649 -10.4649 -10.4133 -10.4133 -10.4049 -10.4049 -10.3868 -10.3868 -3.4069 -3.4069 -3.3539 -3.3539 -2.1470 -2.1470 -2.0839 -2.0839 -2.0545 -2.0545 -1.9635 -1.9635 -1.7600 -1.7600 -1.6820 -1.6820 -1.4788 -1.4788 -0.7919 -0.7919 -0.7049 -0.7049 -0.4275 -0.4275 0.1752 0.1752 0.3943 0.3943 0.5394 0.5394 1.7086 1.7086 1.7654 1.7654 1.9066 1.9066 1.9297 1.9297 2.1623 2.1623 2.2209 2.2209 2.2814 2.2814 2.3065 2.3065 2.4108 2.4108 2.6932 2.6932 2.7369 2.7369 3.1234 3.1234 5.0108 5.0108 5.6356 5.6356 9.9020 9.9020 10.2091 10.2091 10.2211 10.2211 10.8111 10.8111 10.8300 10.8300 k = 0.3871-0.2235 0.3161 ( 21564 PWs) bands (ev): -14.5529 -14.5529 -14.5325 -14.5325 -11.1590 -11.1590 -10.5151 -10.5151 -10.4658 -10.4658 -10.4131 -10.4131 -10.4056 -10.4056 -10.3873 -10.3873 -3.3988 -3.3988 -3.3520 -3.3520 -2.1302 -2.1302 -2.0858 -2.0858 -2.0340 -2.0340 -1.9552 -1.9552 -1.7647 -1.7647 -1.6854 -1.6854 -1.4614 -1.4614 -0.8110 -0.8110 -0.7160 -0.7160 -0.4293 -0.4293 0.1759 0.1759 0.3893 0.3893 0.5433 0.5433 1.6815 1.6815 1.7583 1.7583 1.9100 1.9100 1.9320 1.9320 2.1550 2.1550 2.2127 2.2127 2.2619 2.2619 2.2896 2.2896 2.3962 2.3962 2.6927 2.6927 2.7380 2.7380 3.1287 3.1287 4.9840 4.9840 5.6354 5.6354 9.9540 9.9540 10.2700 10.2700 10.2763 10.2763 10.8457 10.8457 10.8894 10.8894 k = 0.4032-0.2328 0.3292 ( 21572 PWs) bands (ev): -14.5521 -14.5521 -14.5328 -14.5328 -11.1584 -11.1584 -10.5174 -10.5174 -10.4665 -10.4665 -10.4129 -10.4129 -10.4061 -10.4061 -10.3879 -10.3879 -3.3916 -3.3916 -3.3504 -3.3504 -2.1150 -2.1150 -2.0873 -2.0873 -2.0171 -2.0171 -1.9453 -1.9453 -1.7691 -1.7691 -1.6890 -1.6890 -1.4458 -1.4458 -0.8286 -0.8286 -0.7260 -0.7260 -0.4309 -0.4309 0.1763 0.1763 0.3847 0.3847 0.5469 0.5469 1.6574 1.6574 1.7520 1.7520 1.9136 1.9136 1.9346 1.9346 2.1485 2.1485 2.2057 2.2057 2.2440 2.2440 2.2740 2.2740 2.3832 2.3832 2.6923 2.6923 2.7389 2.7389 3.1333 3.1333 4.9602 4.9602 5.6352 5.6352 9.9995 9.9995 10.3261 10.3261 10.3265 10.3265 10.8608 10.8608 10.9610 10.9610 k = 0.4194-0.2421 0.3424 ( 21568 PWs) bands (ev): -14.5514 -14.5514 -14.5331 -14.5331 -11.1578 -11.1578 -10.5194 -10.5194 -10.4672 -10.4672 -10.4128 -10.4128 -10.4066 -10.4066 -10.3883 -10.3883 -3.3854 -3.3854 -3.3490 -3.3490 -2.1024 -2.1024 -2.0877 -2.0877 -2.0043 -2.0043 -1.9336 -1.9336 -1.7733 -1.7733 -1.6928 -1.6928 -1.4321 -1.4321 -0.8445 -0.8445 -0.7348 -0.7348 -0.4322 -0.4322 0.1766 0.1766 0.3806 0.3806 0.5501 0.5501 1.6364 1.6364 1.7466 1.7466 1.9173 1.9173 1.9372 1.9372 2.1430 2.1430 2.2002 2.2002 2.2280 2.2280 2.2598 2.2598 2.3720 2.3720 2.6919 2.6919 2.7397 2.7397 3.1373 3.1373 4.9397 4.9397 5.6350 5.6350 10.0383 10.0383 10.3710 10.3710 10.3761 10.3761 10.8751 10.8751 11.0245 11.0245 k = 0.4355-0.2514 0.3556 ( 21560 PWs) bands (ev): -14.5509 -14.5509 -14.5333 -14.5333 -11.1574 -11.1574 -10.5210 -10.5210 -10.4677 -10.4677 -10.4126 -10.4126 -10.4070 -10.4070 -10.3887 -10.3887 -3.3802 -3.3802 -3.3479 -3.3479 -2.0957 -2.0957 -2.0838 -2.0838 -1.9954 -1.9954 -1.9211 -1.9211 -1.7769 -1.7769 -1.6967 -1.6967 -1.4206 -1.4206 -0.8581 -0.8581 -0.7422 -0.7422 -0.4333 -0.4333 0.1768 0.1768 0.3772 0.3772 0.5528 0.5528 1.6189 1.6189 1.7421 1.7421 1.9209 1.9209 1.9397 1.9397 2.1385 2.1385 2.1960 2.1960 2.2143 2.2143 2.2474 2.2474 2.3625 2.3625 2.6915 2.6915 2.7403 2.7403 3.1405 3.1405 4.9225 4.9225 5.6348 5.6348 10.0703 10.0703 10.4087 10.4087 10.4188 10.4188 10.8879 10.8879 11.0784 11.0784 k = 0.4516-0.2607 0.3687 ( 21596 PWs) bands (ev): -14.5504 -14.5504 -14.5335 -14.5335 -11.1570 -11.1570 -10.5223 -10.5223 -10.4681 -10.4681 -10.4125 -10.4125 -10.4073 -10.4073 -10.3890 -10.3890 -3.3761 -3.3761 -3.3470 -3.3470 -2.0949 -2.0949 -2.0760 -2.0760 -1.9894 -1.9894 -1.9093 -1.9093 -1.7800 -1.7800 -1.7004 -1.7004 -1.4115 -1.4115 -0.8691 -0.8691 -0.7482 -0.7482 -0.4341 -0.4341 0.1769 0.1769 0.3744 0.3744 0.5550 0.5550 1.6050 1.6050 1.7385 1.7385 1.9241 1.9241 1.9419 1.9419 2.1350 2.1350 2.1932 2.1932 2.2032 2.2032 2.2370 2.2370 2.3551 2.3551 2.6912 2.6912 2.7407 2.7407 3.1431 3.1431 4.9090 4.9090 5.6347 5.6347 10.0953 10.0953 10.4389 10.4389 10.4532 10.4532 10.8988 10.8988 11.1214 11.1214 k = 0.4677-0.2701 0.3819 ( 21612 PWs) bands (ev): -14.5501 -14.5501 -14.5336 -14.5336 -11.1567 -11.1567 -10.5232 -10.5232 -10.4684 -10.4684 -10.4124 -10.4124 -10.4075 -10.4075 -10.3893 -10.3893 -3.3731 -3.3731 -3.3463 -3.3463 -2.0952 -2.0952 -2.0694 -2.0694 -1.9857 -1.9857 -1.8996 -1.8996 -1.7823 -1.7823 -1.7035 -1.7035 -1.4048 -1.4048 -0.8772 -0.8772 -0.7525 -0.7525 -0.4347 -0.4347 0.1770 0.1770 0.3724 0.3724 0.5567 0.5567 1.5950 1.5950 1.7359 1.7359 1.9266 1.9266 1.9436 1.9436 2.1325 2.1325 2.1917 2.1917 2.1949 2.1949 2.2289 2.2289 2.3497 2.3497 2.6910 2.6910 2.7411 2.7411 3.1449 3.1449 4.8992 4.8992 5.6346 5.6346 10.1132 10.1132 10.4611 10.4611 10.4784 10.4784 10.9073 10.9073 11.1528 11.1528 k = 0.4839-0.2794 0.3951 ( 21608 PWs) bands (ev): -14.5499 -14.5499 -14.5337 -14.5337 -11.1566 -11.1566 -10.5238 -10.5238 -10.4686 -10.4686 -10.4124 -10.4124 -10.4077 -10.4077 -10.3894 -10.3894 -3.3713 -3.3713 -3.3459 -3.3459 -2.0955 -2.0955 -2.0651 -2.0651 -1.9836 -1.9836 -1.8932 -1.8932 -1.7838 -1.7838 -1.7056 -1.7056 -1.4008 -1.4008 -0.8822 -0.8822 -0.7551 -0.7551 -0.4351 -0.4351 0.1770 0.1770 0.3712 0.3712 0.5576 0.5576 1.5890 1.5890 1.7344 1.7344 1.9282 1.9282 1.9447 1.9447 2.1310 2.1310 2.1898 2.1898 2.1911 2.1911 2.2236 2.2236 2.3465 2.3465 2.6909 2.6909 2.7412 2.7412 3.1460 3.1460 4.8933 4.8933 5.6345 5.6345 10.1240 10.1240 10.4746 10.4746 10.4938 10.4938 10.9126 10.9126 11.1719 11.1719 k = 0.5000-0.2887 0.4082 ( 21604 PWs) bands (ev): -14.5498 -14.5498 -14.5337 -14.5337 -11.1565 -11.1565 -10.5240 -10.5240 -10.4686 -10.4686 -10.4124 -10.4124 -10.4077 -10.4077 -10.3895 -10.3895 -3.3707 -3.3707 -3.3458 -3.3458 -2.0956 -2.0956 -2.0637 -2.0637 -1.9830 -1.9830 -1.8910 -1.8910 -1.7843 -1.7843 -1.7063 -1.7063 -1.3994 -1.3994 -0.8839 -0.8839 -0.7560 -0.7560 -0.4352 -0.4352 0.1770 0.1770 0.3708 0.3708 0.5580 0.5580 1.5869 1.5869 1.7339 1.7339 1.9288 1.9288 1.9451 1.9451 2.1304 2.1304 2.1881 2.1881 2.1910 2.1910 2.2218 2.2218 2.3454 2.3454 2.6909 2.6909 2.7413 2.7413 3.1463 3.1463 4.8913 4.8913 5.6345 5.6345 10.1276 10.1276 10.4791 10.4791 10.4990 10.4990 10.9144 10.9144 11.1784 11.1784 k = 0.5000-0.2887 0.4082 ( 21604 PWs) bands (ev): -14.5498 -14.5498 -14.5337 -14.5337 -11.1565 -11.1565 -10.5240 -10.5240 -10.4686 -10.4686 -10.4124 -10.4124 -10.4077 -10.4077 -10.3895 -10.3895 -3.3707 -3.3707 -3.3458 -3.3458 -2.0956 -2.0956 -2.0637 -2.0637 -1.9830 -1.9830 -1.8910 -1.8910 -1.7843 -1.7843 -1.7063 -1.7063 -1.3994 -1.3994 -0.8839 -0.8839 -0.7560 -0.7560 -0.4352 -0.4352 0.1770 0.1770 0.3708 0.3708 0.5580 0.5580 1.5869 1.5869 1.7339 1.7339 1.9288 1.9288 1.9451 1.9451 2.1304 2.1304 2.1881 2.1881 2.1910 2.1910 2.2218 2.2218 2.3454 2.3454 2.6909 2.6909 2.7413 2.7413 3.1463 3.1463 4.8913 4.8913 5.6345 5.6345 10.1276 10.1276 10.4791 10.4791 10.4990 10.4990 10.9144 10.9144 11.1784 11.1784 k = 0.5000-0.2706 0.4210 ( 21608 PWs) bands (ev): -14.5498 -14.5498 -14.5338 -14.5338 -11.1565 -11.1565 -10.5242 -10.5242 -10.4685 -10.4685 -10.4135 -10.4135 -10.4066 -10.4066 -10.3894 -10.3894 -3.3706 -3.3706 -3.3458 -3.3458 -2.0954 -2.0954 -2.0635 -2.0635 -1.9829 -1.9829 -1.8914 -1.8914 -1.7844 -1.7844 -1.7065 -1.7065 -1.3995 -1.3995 -0.8835 -0.8835 -0.7562 -0.7562 -0.4354 -0.4354 0.1773 0.1773 0.3713 0.3713 0.5575 0.5575 1.5879 1.5879 1.7341 1.7341 1.9282 1.9282 1.9445 1.9445 2.1279 2.1279 2.1876 2.1876 2.1889 2.1889 2.2245 2.2245 2.3487 2.3487 2.6901 2.6901 2.7409 2.7409 3.1460 3.1460 4.8928 4.8928 5.6334 5.6334 10.1287 10.1287 10.4806 10.4806 10.5017 10.5017 10.9162 10.9162 11.1793 11.1793 k = 0.5000-0.2526 0.4338 ( 21592 PWs) bands (ev): -14.5497 -14.5497 -14.5339 -14.5339 -11.1564 -11.1564 -10.5248 -10.5248 -10.4680 -10.4680 -10.4156 -10.4156 -10.4046 -10.4046 -10.3893 -10.3893 -3.3705 -3.3705 -3.3459 -3.3459 -2.0946 -2.0946 -2.0628 -2.0628 -1.9828 -1.9828 -1.8924 -1.8924 -1.7848 -1.7848 -1.7071 -1.7071 -1.3996 -1.3996 -0.8825 -0.8825 -0.7569 -0.7569 -0.4362 -0.4362 0.1783 0.1783 0.3729 0.3729 0.5562 0.5562 1.5905 1.5905 1.7347 1.7347 1.9263 1.9263 1.9429 1.9429 2.1202 2.1202 2.1808 2.1808 2.1912 2.1912 2.2306 2.2306 2.3582 2.3582 2.6877 2.6877 2.7398 2.7398 3.1450 3.1450 4.8974 4.8974 5.6300 5.6300 10.1320 10.1320 10.4852 10.4852 10.5099 10.5099 10.9215 10.9215 11.1819 11.1819 k = 0.5000-0.2345 0.4465 ( 21582 PWs) bands (ev): -14.5495 -14.5495 -14.5341 -14.5341 -11.1563 -11.1563 -10.5258 -10.5258 -10.4672 -10.4672 -10.4179 -10.4179 -10.4024 -10.4024 -10.3891 -10.3891 -3.3703 -3.3703 -3.3461 -3.3461 -2.0933 -2.0933 -2.0618 -2.0618 -1.9826 -1.9826 -1.8942 -1.8942 -1.7855 -1.7855 -1.7081 -1.7081 -1.3998 -1.3998 -0.8808 -0.8808 -0.7581 -0.7581 -0.4373 -0.4373 0.1799 0.1799 0.3755 0.3755 0.5540 0.5540 1.5950 1.5950 1.7358 1.7358 1.9233 1.9233 1.9403 1.9403 2.1072 2.1072 2.1742 2.1742 2.1946 2.1946 2.2379 2.2379 2.3723 2.3723 2.6837 2.6837 2.7379 2.7379 3.1433 3.1433 4.9048 4.9048 5.6244 5.6244 10.1375 10.1375 10.4926 10.4926 10.5237 10.5237 10.9303 10.9303 11.1863 11.1863 k = 0.5000-0.2165 0.4593 ( 21578 PWs) bands (ev): -14.5492 -14.5492 -14.5343 -14.5343 -11.1562 -11.1562 -10.5271 -10.5271 -10.4662 -10.4662 -10.4201 -10.4201 -10.4004 -10.4004 -10.3887 -10.3887 -3.3700 -3.3700 -3.3463 -3.3463 -2.0915 -2.0915 -2.0603 -2.0603 -1.9823 -1.9823 -1.8966 -1.8966 -1.7866 -1.7866 -1.7093 -1.7093 -1.4000 -1.4000 -0.8785 -0.8785 -0.7598 -0.7598 -0.4388 -0.4388 0.1821 0.1821 0.3791 0.3791 0.5509 0.5509 1.6012 1.6012 1.7374 1.7374 1.9191 1.9191 1.9367 1.9367 2.0898 2.0898 2.1690 2.1690 2.1985 2.1985 2.2464 2.2464 2.3895 2.3895 2.6783 2.6783 2.7352 2.7352 3.1411 3.1411 4.9150 4.9150 5.6166 5.6166 10.1450 10.1450 10.5028 10.5028 10.5432 10.5432 10.9423 10.9423 11.1923 11.1923 k = 0.5000-0.1985 0.4720 ( 21576 PWs) bands (ev): -14.5489 -14.5489 -14.5347 -14.5347 -11.1560 -11.1560 -10.5286 -10.5286 -10.4650 -10.4650 -10.4224 -10.4224 -10.3986 -10.3986 -10.3880 -10.3880 -3.3696 -3.3696 -3.3466 -3.3466 -2.0895 -2.0895 -2.0583 -2.0583 -1.9819 -1.9819 -1.8995 -1.8995 -1.7881 -1.7881 -1.7106 -1.7106 -1.4003 -1.4003 -0.8755 -0.8755 -0.7619 -0.7619 -0.4407 -0.4407 0.1848 0.1848 0.3836 0.3836 0.5471 0.5471 1.6091 1.6091 1.7397 1.7397 1.9137 1.9137 1.9322 1.9322 2.0695 2.0695 2.1649 2.1649 2.2025 2.2025 2.2566 2.2566 2.4084 2.4084 2.6714 2.6714 2.7319 2.7319 3.1384 3.1384 4.9277 4.9277 5.6069 5.6069 10.1544 10.1544 10.5157 10.5157 10.5683 10.5683 10.9575 10.9575 11.1855 11.1855 k = 0.5000-0.1804 0.4848 ( 21556 PWs) bands (ev): -14.5485 -14.5485 -14.5351 -14.5351 -11.1558 -11.1558 -10.5303 -10.5303 -10.4636 -10.4636 -10.4246 -10.4246 -10.3973 -10.3973 -10.3871 -10.3871 -3.3692 -3.3692 -3.3469 -3.3469 -2.0872 -2.0872 -2.0558 -2.0558 -1.9813 -1.9813 -1.9030 -1.9030 -1.7901 -1.7901 -1.7121 -1.7121 -1.4006 -1.4006 -0.8720 -0.8720 -0.7644 -0.7644 -0.4429 -0.4429 0.1879 0.1879 0.3888 0.3888 0.5425 0.5425 1.6185 1.6185 1.7428 1.7428 1.9073 1.9073 1.9272 1.9272 2.0473 2.0473 2.1615 2.1615 2.2062 2.2062 2.2688 2.2688 2.4281 2.4281 2.6631 2.6631 2.7278 2.7278 3.1352 3.1352 4.9426 4.9426 5.5954 5.5954 10.1654 10.1654 10.5312 10.5312 10.5990 10.5990 10.9755 10.9755 11.1603 11.1603 k = 0.5000-0.1624 0.4976 ( 21560 PWs) bands (ev): -14.5480 -14.5480 -14.5356 -14.5356 -11.1555 -11.1555 -10.5321 -10.5321 -10.4621 -10.4621 -10.4267 -10.4267 -10.3963 -10.3963 -10.3859 -10.3859 -3.3687 -3.3687 -3.3473 -3.3473 -2.0848 -2.0848 -2.0529 -2.0529 -1.9806 -1.9806 -1.9068 -1.9068 -1.7926 -1.7926 -1.7135 -1.7135 -1.4010 -1.4010 -0.8679 -0.8679 -0.7674 -0.7674 -0.4452 -0.4452 0.1912 0.1912 0.3947 0.3947 0.5373 0.5373 1.6295 1.6295 1.7467 1.7467 1.8997 1.8997 1.9216 1.9216 2.0242 2.0242 2.1585 2.1585 2.2095 2.2095 2.2829 2.2829 2.4478 2.4478 2.6537 2.6537 2.7230 2.7230 3.1317 3.1317 4.9594 4.9594 5.5822 5.5822 10.1778 10.1778 10.5494 10.5494 10.6352 10.6352 10.9958 10.9958 11.1319 11.1319 k = 0.5000-0.1443 0.5103 ( 21564 PWs) bands (ev): -14.5475 -14.5475 -14.5361 -14.5361 -11.1553 -11.1553 -10.5339 -10.5339 -10.4605 -10.4605 -10.4287 -10.4287 -10.3957 -10.3957 -10.3844 -10.3844 -3.3682 -3.3682 -3.3478 -3.3478 -2.0825 -2.0825 -2.0497 -2.0497 -1.9796 -1.9796 -1.9110 -1.9110 -1.7955 -1.7955 -1.7148 -1.7148 -1.4013 -1.4013 -0.8633 -0.8633 -0.7708 -0.7708 -0.4477 -0.4477 0.1947 0.1947 0.4012 0.4012 0.5316 0.5316 1.6418 1.6418 1.7515 1.7515 1.8912 1.8912 1.9159 1.9159 2.0005 2.0005 2.1558 2.1558 2.2123 2.2123 2.2988 2.2988 2.4670 2.4670 2.6434 2.6434 2.7174 2.7174 3.1281 3.1281 4.9776 4.9776 5.5678 5.5678 10.1912 10.1912 10.5700 10.5700 10.6768 10.6768 11.0181 11.0181 11.1010 11.1010 k = 0.5000-0.1263 0.5231 ( 21556 PWs) bands (ev): -14.5469 -14.5469 -14.5367 -14.5367 -11.1551 -11.1551 -10.5357 -10.5357 -10.4589 -10.4589 -10.4307 -10.4307 -10.3953 -10.3953 -10.3829 -10.3829 -3.3676 -3.3676 -3.3482 -3.3482 -2.0802 -2.0802 -2.0461 -2.0461 -1.9784 -1.9784 -1.9155 -1.9155 -1.7988 -1.7988 -1.7159 -1.7159 -1.4017 -1.4017 -0.8584 -0.8584 -0.7746 -0.7746 -0.4501 -0.4501 0.1982 0.1982 0.4080 0.4080 0.5255 0.5255 1.6555 1.6555 1.7573 1.7573 1.8816 1.8816 1.9101 1.9101 1.9768 1.9768 2.1534 2.1534 2.2146 2.2146 2.3162 2.3162 2.4849 2.4849 2.6328 2.6328 2.7110 2.7110 3.1243 3.1243 4.9967 4.9967 5.5524 5.5524 10.2052 10.2052 10.5930 10.5930 10.7237 10.7237 11.0406 11.0406 11.0690 11.0690 k = 0.5000-0.1083 0.5358 ( 21572 PWs) bands (ev): -14.5463 -14.5463 -14.5373 -14.5373 -11.1548 -11.1548 -10.5373 -10.5373 -10.4572 -10.4572 -10.4326 -10.4326 -10.3952 -10.3952 -10.3814 -10.3814 -3.3671 -3.3671 -3.3487 -3.3487 -2.0782 -2.0782 -2.0423 -2.0423 -1.9769 -1.9769 -1.9201 -1.9201 -1.8023 -1.8023 -1.7168 -1.7168 -1.4020 -1.4020 -0.8531 -0.8531 -0.7787 -0.7787 -0.4525 -0.4525 0.2016 0.2016 0.4152 0.4152 0.5190 0.5190 1.6702 1.6702 1.7641 1.7641 1.8711 1.8711 1.9045 1.9045 1.9534 1.9534 2.1512 2.1512 2.2166 2.2166 2.3345 2.3345 2.5006 2.5006 2.6227 2.6227 2.7039 2.7039 3.1207 3.1207 5.0162 5.0162 5.5366 5.5366 10.2193 10.2193 10.6184 10.6184 10.7759 10.7759 11.0305 11.0305 11.0686 11.0686 k = 0.5000-0.0902 0.5486 ( 21588 PWs) bands (ev): -14.5456 -14.5456 -14.5380 -14.5380 -11.1546 -11.1546 -10.5388 -10.5388 -10.4556 -10.4556 -10.4343 -10.4343 -10.3951 -10.3951 -10.3801 -10.3801 -3.3665 -3.3665 -3.3492 -3.3492 -2.0764 -2.0764 -2.0386 -2.0386 -1.9751 -1.9751 -1.9247 -1.9247 -1.8059 -1.8059 -1.7175 -1.7175 -1.4023 -1.4023 -0.8476 -0.8476 -0.7830 -0.7830 -0.4547 -0.4547 0.2047 0.2047 0.4224 0.4224 0.5124 0.5124 1.6859 1.6859 1.7720 1.7720 1.8596 1.8596 1.8994 1.8994 1.9306 1.9306 2.1494 2.1494 2.2183 2.2183 2.3534 2.3534 2.5125 2.5125 2.6147 2.6147 2.6960 2.6960 3.1173 3.1173 5.0352 5.0352 5.5210 5.5210 10.2329 10.2329 10.6459 10.6459 10.8331 10.8331 10.9952 10.9952 11.0921 11.0921 k = 0.5000-0.0722 0.5613 ( 21590 PWs) bands (ev): -14.5449 -14.5449 -14.5387 -14.5387 -11.1544 -11.1544 -10.5400 -10.5400 -10.4540 -10.4540 -10.4360 -10.4360 -10.3951 -10.3951 -10.3789 -10.3789 -3.3660 -3.3660 -3.3496 -3.3496 -2.0749 -2.0749 -2.0351 -2.0351 -1.9730 -1.9730 -1.9293 -1.9293 -1.8093 -1.8093 -1.7181 -1.7181 -1.4026 -1.4026 -0.8420 -0.8420 -0.7876 -0.7876 -0.4566 -0.4566 0.2075 0.2075 0.4295 0.4295 0.5058 0.5058 1.7023 1.7023 1.7808 1.7808 1.8473 1.8473 1.8948 1.8948 1.9089 1.9089 2.1478 2.1478 2.2196 2.2196 2.3724 2.3724 2.5188 2.5188 2.6108 2.6108 2.6874 2.6874 3.1143 3.1143 5.0529 5.0529 5.5062 5.5062 10.2453 10.2453 10.6754 10.6754 10.8953 10.8953 10.9583 10.9583 11.1148 11.1148 k = 0.5000-0.0541 0.5741 ( 21572 PWs) bands (ev): -14.5441 -14.5441 -14.5395 -14.5395 -11.1543 -11.1543 -10.5411 -10.5411 -10.4526 -10.4526 -10.4375 -10.4375 -10.3951 -10.3951 -10.3779 -10.3779 -3.3656 -3.3656 -3.3500 -3.3500 -2.0737 -2.0737 -2.0321 -2.0321 -1.9708 -1.9708 -1.9336 -1.9336 -1.8122 -1.8122 -1.7184 -1.7184 -1.4028 -1.4028 -0.8365 -0.8365 -0.7923 -0.7923 -0.4582 -0.4582 0.2098 0.2098 0.4362 0.4362 0.4995 0.4995 1.7190 1.7190 1.7905 1.7905 1.8343 1.8343 1.8872 1.8872 1.8923 1.8923 2.1465 2.1465 2.2206 2.2206 2.3908 2.3908 2.5181 2.5181 2.6125 2.6125 2.6781 2.6781 3.1118 3.1118 5.0683 5.0683 5.4931 5.4931 10.2559 10.2559 10.7067 10.7067 10.9209 10.9209 10.9624 10.9624 11.1349 11.1349 k = 0.5000-0.0361 0.5869 ( 21592 PWs) bands (ev): -14.5434 -14.5434 -14.5402 -14.5402 -11.1542 -11.1542 -10.5418 -10.5418 -10.4513 -10.4513 -10.4388 -10.4388 -10.3951 -10.3951 -10.3772 -10.3772 -3.3653 -3.3653 -3.3503 -3.3503 -2.0729 -2.0729 -2.0297 -2.0297 -1.9685 -1.9685 -1.9373 -1.9373 -1.8145 -1.8145 -1.7187 -1.7187 -1.4030 -1.4030 -0.8315 -0.8315 -0.7967 -0.7967 -0.4594 -0.4594 0.2115 0.2115 0.4421 0.4421 0.4939 0.4939 1.7351 1.7351 1.8008 1.8008 1.8212 1.8212 1.8695 1.8695 1.8889 1.8889 2.1456 2.1456 2.2214 2.2214 2.4073 2.4073 2.5123 2.5123 2.6190 2.6190 2.6685 2.6685 3.1099 3.1099 5.0804 5.0804 5.4828 5.4828 10.2640 10.2640 10.7397 10.7397 10.8835 10.8835 11.0338 11.0338 11.1510 11.1510 k = 0.5000-0.0180 0.5996 ( 21584 PWs) bands (ev): -14.5426 -14.5426 -14.5410 -14.5410 -11.1541 -11.1541 -10.5423 -10.5423 -10.4504 -10.4504 -10.4397 -10.4397 -10.3951 -10.3951 -10.3768 -10.3768 -3.3651 -3.3651 -3.3504 -3.3504 -2.0723 -2.0723 -2.0283 -2.0283 -1.9668 -1.9668 -1.9400 -1.9400 -1.8159 -1.8159 -1.7188 -1.7188 -1.4030 -1.4030 -0.8276 -0.8276 -0.8002 -0.8002 -0.4601 -0.4601 0.2126 0.2126 0.4464 0.4464 0.4897 0.4897 1.7489 1.7489 1.8076 1.8076 1.8126 1.8126 1.8546 1.8546 1.8872 1.8872 2.1450 2.1450 2.2218 2.2218 2.4197 2.4197 2.5053 2.5053 2.6271 2.6271 2.6595 2.6595 3.1087 3.1087 5.0881 5.0881 5.4761 5.4761 10.2691 10.2691 10.7739 10.7739 10.8465 10.8465 11.1077 11.1077 11.1627 11.1627 k = 0.5000-0.0000 0.6124 ( 21628 PWs) bands (ev): -14.5418 -14.5418 -14.5418 -14.5418 -11.1541 -11.1541 -10.5424 -10.5424 -10.4501 -10.4501 -10.4401 -10.4401 -10.3951 -10.3951 -10.3767 -10.3767 -3.3650 -3.3650 -3.3505 -3.3505 -2.0722 -2.0722 -2.0278 -2.0278 -1.9661 -1.9661 -1.9410 -1.9410 -1.8164 -1.8164 -1.7189 -1.7189 -1.4031 -1.4031 -0.8261 -0.8261 -0.8016 -0.8016 -0.4603 -0.4603 0.2129 0.2129 0.4480 0.4480 0.4881 0.4881 1.7552 1.7552 1.8029 1.8029 1.8169 1.8169 1.8475 1.8475 1.8866 1.8866 2.1448 2.1448 2.2220 2.2220 2.4247 2.4247 2.5021 2.5021 2.6316 2.6316 2.6548 2.6548 3.1083 3.1083 5.0908 5.0908 5.4738 5.4738 10.2708 10.2708 10.8055 10.8055 10.8140 10.8140 11.1525 11.1525 11.1874 11.1874 k = 0.5000-0.0000 0.6124 ( 21628 PWs) bands (ev): -14.5418 -14.5418 -14.5418 -14.5418 -11.1541 -11.1541 -10.5424 -10.5424 -10.4501 -10.4501 -10.4401 -10.4401 -10.3951 -10.3951 -10.3767 -10.3767 -3.3650 -3.3650 -3.3505 -3.3505 -2.0722 -2.0722 -2.0278 -2.0278 -1.9661 -1.9661 -1.9410 -1.9410 -1.8164 -1.8164 -1.7189 -1.7189 -1.4031 -1.4031 -0.8261 -0.8261 -0.8016 -0.8016 -0.4603 -0.4603 0.2129 0.2129 0.4480 0.4480 0.4881 0.4881 1.7552 1.7552 1.8029 1.8029 1.8169 1.8169 1.8475 1.8475 1.8866 1.8866 2.1448 2.1448 2.2220 2.2220 2.4247 2.4247 2.5021 2.5021 2.6316 2.6316 2.6548 2.6548 3.1083 3.1083 5.0908 5.0908 5.4738 5.4738 10.2708 10.2708 10.8055 10.8055 10.8140 10.8140 11.1525 11.1525 11.1874 11.1874 k = 0.4886 0.0197 0.6124 ( 21588 PWs) bands (ev): -14.5423 -14.5423 -14.5412 -14.5412 -11.1541 -11.1541 -10.5423 -10.5423 -10.4503 -10.4503 -10.4399 -10.4399 -10.3951 -10.3951 -10.3767 -10.3767 -3.3651 -3.3651 -3.3506 -3.3506 -2.0724 -2.0724 -2.0284 -2.0284 -1.9668 -1.9668 -1.9404 -1.9404 -1.8159 -1.8159 -1.7190 -1.7190 -1.4034 -1.4034 -0.8275 -0.8275 -0.7997 -0.7997 -0.4601 -0.4601 0.2122 0.2122 0.4461 0.4461 0.4906 0.4906 1.7519 1.7519 1.8052 1.8052 1.8139 1.8139 1.8513 1.8513 1.8878 1.8878 2.1456 2.1456 2.2227 2.2227 2.4221 2.4221 2.5038 2.5038 2.6286 2.6286 2.6577 2.6577 3.1084 3.1084 5.0901 5.0901 5.4749 5.4749 10.2692 10.2692 10.7840 10.7840 10.8337 10.8337 11.1105 11.1105 11.1822 11.1822 k = 0.4773 0.0394 0.6124 ( 21583 PWs) bands (ev): -14.5429 -14.5429 -14.5407 -14.5407 -11.1542 -11.1542 -10.5419 -10.5419 -10.4510 -10.4510 -10.4393 -10.4393 -10.3951 -10.3951 -10.3768 -10.3768 -3.3654 -3.3654 -3.3508 -3.3508 -2.0732 -2.0732 -2.0302 -2.0302 -1.9685 -1.9685 -1.9387 -1.9387 -1.8142 -1.8142 -1.7192 -1.7192 -1.4042 -1.4042 -0.8309 -0.8309 -0.7952 -0.7952 -0.4595 -0.4595 0.2100 0.2100 0.4422 0.4422 0.4963 0.4963 1.7445 1.7445 1.8054 1.8054 1.8114 1.8114 1.8597 1.8597 1.8916 1.8916 2.1481 2.1481 2.2247 2.2247 2.4152 2.4152 2.5081 2.5081 2.6223 2.6223 2.6640 2.6640 3.1085 3.1085 5.0882 5.0882 5.4779 5.4779 10.2648 10.2648 10.7606 10.7606 10.8516 10.8516 11.0429 11.0429 11.1908 11.1908 k = 0.4659 0.0590 0.6124 ( 21589 PWs) bands (ev): -14.5433 -14.5433 -14.5403 -14.5403 -11.1543 -11.1543 -10.5413 -10.5413 -10.4520 -10.4520 -10.4385 -10.4385 -10.3950 -10.3950 -10.3769 -10.3769 -3.3658 -3.3658 -3.3511 -3.3511 -2.0745 -2.0745 -2.0327 -2.0327 -1.9708 -1.9708 -1.9365 -1.9365 -1.8116 -1.8116 -1.7197 -1.7197 -1.4055 -1.4055 -0.8346 -0.8346 -0.7897 -0.7897 -0.4587 -0.4587 0.2064 0.2064 0.4381 0.4381 0.5033 0.5033 1.7358 1.7358 1.7982 1.7982 1.8147 1.8147 1.8696 1.8696 1.8977 1.8977 2.1523 2.1523 2.2280 2.2280 2.4053 2.4053 2.5130 2.5130 2.6153 2.6153 2.6712 2.6712 3.1088 3.1088 5.0851 5.0851 5.4825 5.4825 10.2581 10.2581 10.7392 10.7392 10.8642 10.8642 10.9771 10.9771 11.1978 11.1978 k = 0.4545 0.0787 0.6124 ( 21586 PWs) bands (ev): -14.5438 -14.5438 -14.5399 -14.5399 -11.1544 -11.1544 -10.5406 -10.5406 -10.4532 -10.4532 -10.4376 -10.4376 -10.3949 -10.3949 -10.3771 -10.3771 -3.3663 -3.3663 -3.3515 -3.3515 -2.0762 -2.0762 -2.0355 -2.0355 -1.9733 -1.9733 -1.9341 -1.9341 -1.8082 -1.8082 -1.7205 -1.7205 -1.4070 -1.4070 -0.8383 -0.8383 -0.7841 -0.7841 -0.4576 -0.4576 0.2019 0.2019 0.4347 0.4347 0.5105 0.5105 1.7272 1.7272 1.7905 1.7905 1.8169 1.8169 1.8798 1.8798 1.9052 1.9052 2.1582 2.1582 2.2325 2.2325 2.3939 2.3939 2.5171 2.5171 2.6091 2.6091 2.6783 2.6783 3.1091 3.1091 5.0812 5.0812 5.4882 5.4882 10.2500 10.2500 10.7201 10.7201 10.8718 10.8718 10.9161 10.9161 11.1999 11.1999 k = 0.4432 0.0984 0.6124 ( 21588 PWs) bands (ev): -14.5442 -14.5442 -14.5396 -14.5396 -11.1545 -11.1545 -10.5397 -10.5397 -10.4545 -10.4545 -10.4367 -10.4367 -10.3948 -10.3948 -10.3773 -10.3773 -3.3668 -3.3668 -3.3520 -3.3520 -2.0781 -2.0781 -2.0384 -2.0384 -1.9757 -1.9757 -1.9318 -1.9318 -1.8043 -1.8043 -1.7215 -1.7215 -1.4086 -1.4086 -0.8414 -0.8414 -0.7788 -0.7788 -0.4564 -0.4564 0.1968 0.1968 0.4321 0.4321 0.5173 0.5173 1.7195 1.7195 1.7831 1.7831 1.8179 1.8179 1.8892 1.8892 1.9134 1.9134 2.1655 2.1655 2.2382 2.2382 2.3815 2.3815 2.5192 2.5192 2.6044 2.6044 2.6848 2.6848 3.1095 3.1095 5.0769 5.0769 5.4945 5.4945 10.2412 10.2412 10.7035 10.7035 10.8603 10.8603 10.8764 10.8764 11.1977 11.1977 k = 0.4318 0.1181 0.6124 ( 21581 PWs) bands (ev): -14.5445 -14.5445 -14.5393 -14.5393 -11.1546 -11.1546 -10.5388 -10.5388 -10.4557 -10.4557 -10.4358 -10.4358 -10.3946 -10.3946 -10.3775 -10.3775 -3.3673 -3.3673 -3.3524 -3.3524 -2.0802 -2.0802 -2.0410 -2.0410 -1.9780 -1.9780 -1.9297 -1.9297 -1.8003 -1.8003 -1.7227 -1.7227 -1.4102 -1.4102 -0.8441 -0.8441 -0.7740 -0.7740 -0.4551 -0.4551 0.1916 0.1916 0.4304 0.4304 0.5234 0.5234 1.7127 1.7127 1.7764 1.7764 1.8181 1.8181 1.8974 1.8974 1.9215 1.9215 2.1738 2.1738 2.2449 2.2449 2.3688 2.3688 2.5189 2.5189 2.6016 2.6016 2.6905 2.6905 3.1099 3.1099 5.0724 5.0724 5.5008 5.5008 10.2323 10.2323 10.6896 10.6896 10.8126 10.8126 10.8766 10.8766 11.1939 11.1939 k = 0.4205 0.1378 0.6124 ( 21577 PWs) bands (ev): -14.5448 -14.5448 -14.5391 -14.5391 -11.1547 -11.1547 -10.5380 -10.5380 -10.4569 -10.4569 -10.4350 -10.4350 -10.3945 -10.3945 -10.3777 -10.3777 -3.3677 -3.3677 -3.3529 -3.3529 -2.0823 -2.0823 -2.0432 -2.0432 -1.9799 -1.9799 -1.9280 -1.9280 -1.7963 -1.7963 -1.7240 -1.7240 -1.4117 -1.4117 -0.8463 -0.8463 -0.7700 -0.7700 -0.4539 -0.4539 0.1866 0.1866 0.4294 0.4294 0.5286 0.5286 1.7071 1.7071 1.7707 1.7707 1.8179 1.8179 1.9040 1.9040 1.9288 1.9288 2.1823 2.1823 2.2524 2.2524 2.3562 2.3562 2.5164 2.5164 2.6007 2.6007 2.6954 2.6954 3.1104 3.1104 5.0683 5.0683 5.5068 5.5068 10.2240 10.2240 10.6786 10.6786 10.7721 10.7721 10.8752 10.8752 11.1897 11.1897 k = 0.4091 0.1575 0.6124 ( 21590 PWs) bands (ev): -14.5450 -14.5450 -14.5389 -14.5389 -11.1548 -11.1548 -10.5373 -10.5373 -10.4579 -10.4579 -10.4344 -10.4344 -10.3944 -10.3944 -10.3778 -10.3778 -3.3680 -3.3680 -3.3533 -3.3533 -2.0841 -2.0841 -2.0450 -2.0450 -1.9815 -1.9815 -1.9266 -1.9266 -1.7928 -1.7928 -1.7253 -1.7253 -1.4129 -1.4129 -0.8479 -0.8479 -0.7669 -0.7669 -0.4529 -0.4529 0.1823 0.1823 0.4288 0.4288 0.5327 0.5327 1.7028 1.7028 1.7660 1.7660 1.8175 1.8175 1.9090 1.9090 1.9350 1.9350 2.1904 2.1904 2.2604 2.2604 2.3441 2.3441 2.5127 2.5127 2.6009 2.6009 2.6993 2.6993 3.1107 3.1107 5.0647 5.0647 5.5119 5.5119 10.2169 10.2169 10.6705 10.6705 10.7395 10.7395 10.8729 10.8729 11.1860 11.1860 k = 0.3977 0.1771 0.6124 ( 21580 PWs) bands (ev): -14.5451 -14.5451 -14.5388 -14.5388 -11.1549 -11.1549 -10.5367 -10.5367 -10.4586 -10.4586 -10.4339 -10.4339 -10.3943 -10.3943 -10.3780 -10.3780 -3.3683 -3.3683 -3.3536 -3.3536 -2.0855 -2.0855 -2.0463 -2.0463 -1.9826 -1.9826 -1.9255 -1.9255 -1.7899 -1.7899 -1.7265 -1.7265 -1.4139 -1.4139 -0.8491 -0.8491 -0.7645 -0.7645 -0.4521 -0.4521 0.1790 0.1790 0.4286 0.4286 0.5358 0.5358 1.6997 1.6997 1.7625 1.7625 1.8171 1.8171 1.9125 1.9125 1.9397 1.9397 2.1970 2.1970 2.2683 2.2683 2.3332 2.3332 2.5090 2.5090 2.6016 2.6016 2.7021 2.7021 3.1110 3.1110 5.0620 5.0620 5.5158 5.5158 10.2115 10.2115 10.6655 10.6655 10.7152 10.7152 10.8705 10.8705 11.1833 11.1833 k = 0.3864 0.1968 0.6124 ( 21576 PWs) bands (ev): -14.5452 -14.5452 -14.5387 -14.5387 -11.1549 -11.1549 -10.5363 -10.5363 -10.4591 -10.4591 -10.4336 -10.4336 -10.3942 -10.3942 -10.3781 -10.3781 -3.3685 -3.3685 -3.3538 -3.3538 -2.0865 -2.0865 -2.0470 -2.0470 -1.9833 -1.9833 -1.9249 -1.9249 -1.7881 -1.7881 -1.7273 -1.7273 -1.4145 -1.4145 -0.8498 -0.8498 -0.7631 -0.7631 -0.4516 -0.4516 0.1769 0.1769 0.4285 0.4285 0.5376 0.5376 1.6979 1.6979 1.7604 1.7604 1.8169 1.8169 1.9146 1.9146 1.9425 1.9425 2.2013 2.2013 2.2749 2.2749 2.3248 2.3248 2.5063 2.5063 2.6023 2.6023 2.7038 2.7038 3.1112 3.1112 5.0603 5.0603 5.5182 5.5182 10.2081 10.2081 10.6633 10.6633 10.6997 10.6997 10.8688 10.8688 11.1816 11.1816 k = 0.3750 0.2165 0.6124 ( 21570 PWs) bands (ev): -14.5452 -14.5452 -14.5387 -14.5387 -11.1550 -11.1550 -10.5362 -10.5362 -10.4592 -10.4592 -10.4335 -10.4335 -10.3942 -10.3942 -10.3781 -10.3781 -3.3685 -3.3685 -3.3539 -3.3539 -2.0868 -2.0868 -2.0473 -2.0473 -1.9836 -1.9836 -1.9247 -1.9247 -1.7874 -1.7874 -1.7275 -1.7275 -1.4147 -1.4147 -0.8500 -0.8500 -0.7627 -0.7627 -0.4514 -0.4514 0.1762 0.1762 0.4285 0.4285 0.5382 0.5382 1.6972 1.6972 1.7596 1.7596 1.8168 1.8168 1.9153 1.9153 1.9435 1.9435 2.2029 2.2029 2.2776 2.2776 2.3214 2.3214 2.5053 2.5053 2.6025 2.6025 2.7043 2.7043 3.1113 3.1113 5.0597 5.0597 5.5190 5.5190 10.2069 10.2069 10.6628 10.6628 10.6942 10.6942 10.8682 10.8682 11.1810 11.1810 k = 0.3750 0.2165 0.6124 ( 21570 PWs) bands (ev): -14.5452 -14.5452 -14.5387 -14.5387 -11.1550 -11.1550 -10.5362 -10.5362 -10.4592 -10.4592 -10.4335 -10.4335 -10.3942 -10.3942 -10.3781 -10.3781 -3.3685 -3.3685 -3.3539 -3.3539 -2.0868 -2.0868 -2.0473 -2.0473 -1.9836 -1.9836 -1.9247 -1.9247 -1.7874 -1.7874 -1.7275 -1.7275 -1.4147 -1.4147 -0.8500 -0.8500 -0.7627 -0.7627 -0.4514 -0.4514 0.1762 0.1762 0.4285 0.4285 0.5382 0.5382 1.6972 1.6972 1.7596 1.7596 1.8168 1.8168 1.9153 1.9153 1.9435 1.9435 2.2029 2.2029 2.2776 2.2776 2.3214 2.3214 2.5053 2.5053 2.6025 2.6025 2.7043 2.7043 3.1113 3.1113 5.0597 5.0597 5.5190 5.5190 10.2069 10.2069 10.6628 10.6628 10.6942 10.6942 10.8682 10.8682 11.1810 11.1810 k = 0.3636 0.2099 0.5938 ( 21588 PWs) bands (ev): -14.5445 -14.5445 -14.5396 -14.5396 -11.1549 -11.1549 -10.5365 -10.5365 -10.4587 -10.4587 -10.4348 -10.4348 -10.3941 -10.3941 -10.3763 -10.3763 -3.3693 -3.3693 -3.3556 -3.3556 -2.0895 -2.0895 -2.0485 -2.0485 -1.9839 -1.9839 -1.9281 -1.9281 -1.7860 -1.7860 -1.7303 -1.7303 -1.4195 -1.4195 -0.8465 -0.8465 -0.7581 -0.7581 -0.4521 -0.4521 0.1714 0.1714 0.4305 0.4305 0.5450 0.5450 1.7163 1.7163 1.7645 1.7645 1.8010 1.8010 1.8966 1.8966 1.9453 1.9453 2.2096 2.2096 2.2921 2.2921 2.3357 2.3357 2.5158 2.5158 2.5909 2.5909 2.6996 2.6996 3.1061 3.1061 5.0866 5.0866 5.5030 5.5030 10.2078 10.2078 10.6824 10.6824 10.7222 10.7222 10.8071 10.8071 11.1418 11.1418 k = 0.3523 0.2034 0.5753 ( 21592 PWs) bands (ev): -14.5436 -14.5436 -14.5406 -14.5406 -11.1550 -11.1550 -10.5365 -10.5365 -10.4583 -10.4583 -10.4358 -10.4358 -10.3941 -10.3941 -10.3745 -10.3745 -3.3709 -3.3709 -3.3571 -3.3571 -2.0939 -2.0939 -2.0508 -2.0508 -1.9846 -1.9846 -1.9310 -1.9310 -1.7840 -1.7840 -1.7327 -1.7327 -1.4254 -1.4254 -0.8433 -0.8433 -0.7516 -0.7516 -0.4523 -0.4523 0.1659 0.1659 0.4298 0.4298 0.5547 0.5547 1.7354 1.7354 1.7696 1.7696 1.7872 1.7872 1.8803 1.8803 1.9477 1.9477 2.2169 2.2169 2.3069 2.3069 2.3506 2.3506 2.5223 2.5223 2.5820 2.5820 2.6951 2.6951 3.1009 3.1009 5.1145 5.1145 5.4873 5.4873 10.2037 10.2037 10.6939 10.6939 10.7424 10.7424 10.7585 10.7585 11.0948 11.0948 k = 0.3409 0.1968 0.5567 ( 21562 PWs) bands (ev): -14.5428 -14.5428 -14.5417 -14.5417 -11.1551 -11.1551 -10.5360 -10.5360 -10.4581 -10.4581 -10.4366 -10.4366 -10.3941 -10.3941 -10.3729 -10.3729 -3.3734 -3.3734 -3.3584 -3.3584 -2.1004 -2.1004 -2.0538 -2.0538 -1.9860 -1.9860 -1.9336 -1.9336 -1.7814 -1.7814 -1.7347 -1.7347 -1.4323 -1.4323 -0.8401 -0.8401 -0.7433 -0.7433 -0.4519 -0.4519 0.1597 0.1597 0.4271 0.4271 0.5665 0.5665 1.7500 1.7500 1.7746 1.7746 1.7801 1.7801 1.8670 1.8670 1.9506 1.9506 2.2245 2.2245 2.3220 2.3220 2.3661 2.3661 2.5225 2.5225 2.5782 2.5782 2.6911 2.6911 3.0958 3.0958 5.1429 5.1429 5.4723 5.4723 10.1939 10.1939 10.6750 10.6750 10.7015 10.7015 10.7984 10.7984 11.0422 11.0422 k = 0.3295 0.1903 0.5381 ( 21562 PWs) bands (ev): -14.5428 -14.5428 -14.5419 -14.5419 -11.1553 -11.1553 -10.5350 -10.5350 -10.4579 -10.4579 -10.4373 -10.4373 -10.3942 -10.3942 -10.3714 -10.3714 -3.3770 -3.3770 -3.3592 -3.3592 -2.1089 -2.1089 -2.0571 -2.0571 -1.9886 -1.9886 -1.9359 -1.9359 -1.7782 -1.7782 -1.7361 -1.7361 -1.4403 -1.4403 -0.8365 -0.8365 -0.7334 -0.7334 -0.4510 -0.4510 0.1531 0.1531 0.4230 0.4230 0.5794 0.5794 1.7494 1.7494 1.7801 1.7801 1.7891 1.7891 1.8580 1.8580 1.9541 1.9541 2.2325 2.2325 2.3372 2.3372 2.3820 2.3820 2.5167 2.5167 2.5798 2.5798 2.6876 2.6876 3.0907 3.0907 5.1716 5.1716 5.4583 5.4583 10.1773 10.1773 10.6062 10.6062 10.7042 10.7042 10.8420 10.8420 10.9850 10.9850 k = 0.3182 0.1837 0.5196 ( 21570 PWs) bands (ev): -14.5440 -14.5440 -14.5409 -14.5409 -11.1556 -11.1556 -10.5336 -10.5336 -10.4578 -10.4578 -10.4378 -10.4378 -10.3943 -10.3943 -10.3701 -10.3701 -3.3816 -3.3816 -3.3599 -3.3599 -2.1196 -2.1196 -2.0606 -2.0606 -1.9926 -1.9926 -1.9383 -1.9383 -1.7743 -1.7743 -1.7367 -1.7367 -1.4495 -1.4495 -0.8321 -0.8321 -0.7224 -0.7224 -0.4496 -0.4496 0.1464 0.1464 0.4181 0.4181 0.5924 0.5924 1.7416 1.7416 1.7860 1.7860 1.8037 1.8037 1.8561 1.8561 1.9581 1.9581 2.2409 2.2409 2.3524 2.3524 2.3984 2.3984 2.5073 2.5073 2.5844 2.5844 2.6849 2.6849 3.0857 3.0857 5.2006 5.2006 5.4456 5.4456 10.1534 10.1534 10.5352 10.5352 10.7040 10.7040 10.8879 10.8879 10.9239 10.9239 k = 0.3068 0.1771 0.5010 ( 21588 PWs) bands (ev): -14.5453 -14.5453 -14.5400 -14.5400 -11.1561 -11.1561 -10.5318 -10.5318 -10.4578 -10.4578 -10.4382 -10.4382 -10.3944 -10.3944 -10.3689 -10.3689 -3.3870 -3.3870 -3.3605 -3.3605 -2.1320 -2.1320 -2.0641 -2.0641 -1.9982 -1.9982 -1.9410 -1.9410 -1.7698 -1.7698 -1.7366 -1.7366 -1.4599 -1.4599 -0.8264 -0.8264 -0.7104 -0.7104 -0.4476 -0.4476 0.1398 0.1398 0.4131 0.4131 0.6048 0.6048 1.7343 1.7343 1.7916 1.7916 1.8131 1.8131 1.8656 1.8656 1.9625 1.9625 2.2495 2.2495 2.3673 2.3673 2.4150 2.4150 2.4971 2.4971 2.5899 2.5899 2.6830 2.6830 3.0808 3.0808 5.2294 5.2294 5.4342 5.4342 10.1216 10.1216 10.4632 10.4632 10.7008 10.7008 10.8579 10.8579 10.9357 10.9357 k = 0.2955 0.1706 0.4825 ( 21577 PWs) bands (ev): -14.5466 -14.5466 -14.5391 -14.5391 -11.1566 -11.1566 -10.5294 -10.5294 -10.4577 -10.4577 -10.4384 -10.4384 -10.3946 -10.3946 -10.3680 -10.3680 -3.3932 -3.3932 -3.3611 -3.3611 -2.1460 -2.1460 -2.0680 -2.0680 -2.0055 -2.0055 -1.9443 -1.9443 -1.7645 -1.7645 -1.7357 -1.7357 -1.4716 -1.4716 -0.8193 -0.8193 -0.6979 -0.6979 -0.4452 -0.4452 0.1335 0.1335 0.4081 0.4081 0.6159 0.6159 1.7289 1.7289 1.7967 1.7967 1.8172 1.8172 1.8854 1.8854 1.9672 1.9672 2.2585 2.2585 2.3818 2.3818 2.4319 2.4319 2.4875 2.4875 2.5954 2.5954 2.6818 2.6818 3.0761 3.0761 5.2580 5.2580 5.4246 5.4246 10.0817 10.0817 10.3907 10.3907 10.6945 10.6945 10.7892 10.7892 10.8281 10.8281 k = 0.2841 0.1640 0.4639 ( 21585 PWs) bands (ev): -14.5479 -14.5479 -14.5381 -14.5381 -11.1572 -11.1572 -10.5267 -10.5267 -10.4577 -10.4577 -10.4385 -10.4385 -10.3948 -10.3948 -10.3672 -10.3672 -3.4000 -3.4000 -3.3617 -3.3617 -2.1612 -2.1612 -2.0725 -2.0725 -2.0143 -2.0143 -1.9481 -1.9481 -1.7585 -1.7585 -1.7341 -1.7341 -1.4845 -1.4845 -0.8106 -0.8106 -0.6849 -0.6849 -0.4424 -0.4424 0.1277 0.1277 0.4035 0.4035 0.6254 0.6254 1.7260 1.7260 1.8013 1.8013 1.8209 1.8209 1.9101 1.9101 1.9719 1.9719 2.2678 2.2678 2.3957 2.3957 2.4487 2.4487 2.4796 2.4796 2.6005 2.6005 2.6815 2.6815 3.0715 3.0715 5.2862 5.2862 5.4168 5.4168 10.0339 10.0339 10.3187 10.3187 10.6833 10.6833 10.7113 10.7113 10.7237 10.7237 k = 0.2727 0.1575 0.4454 ( 21589 PWs) bands (ev): -14.5493 -14.5493 -14.5371 -14.5371 -11.1579 -11.1579 -10.5235 -10.5235 -10.4575 -10.4575 -10.4384 -10.4384 -10.3950 -10.3950 -10.3665 -10.3665 -3.4075 -3.4075 -3.3625 -3.3625 -2.1773 -2.1773 -2.0783 -2.0783 -2.0241 -2.0241 -1.9524 -1.9524 -1.7520 -1.7520 -1.7319 -1.7319 -1.4985 -1.4985 -0.8001 -0.8001 -0.6717 -0.6717 -0.4393 -0.4393 0.1227 0.1227 0.3993 0.3993 0.6328 0.6328 1.7254 1.7254 1.8061 1.8061 1.8262 1.8262 1.9371 1.9371 1.9766 1.9766 2.2774 2.2774 2.4087 2.4087 2.4645 2.4645 2.4750 2.4750 2.6052 2.6052 2.6818 2.6818 3.0670 3.0670 5.3138 5.3138 5.4110 5.4110 9.9784 9.9784 10.2477 10.2477 10.5991 10.5991 10.6473 10.6473 10.6769 10.6769 k = 0.2614 0.1509 0.4268 ( 21593 PWs) bands (ev): -14.5508 -14.5508 -14.5362 -14.5362 -11.1587 -11.1587 -10.5200 -10.5200 -10.4573 -10.4573 -10.4382 -10.4382 -10.3952 -10.3952 -10.3661 -10.3661 -3.4156 -3.4156 -3.3634 -3.3634 -2.1940 -2.1940 -2.0861 -2.0861 -2.0341 -2.0341 -1.9570 -1.9570 -1.7450 -1.7450 -1.7291 -1.7291 -1.5138 -1.5138 -0.7879 -0.7879 -0.6584 -0.6584 -0.4359 -0.4359 0.1185 0.1185 0.3959 0.3959 0.6381 0.6381 1.7271 1.7271 1.8122 1.8122 1.8331 1.8331 1.9654 1.9654 1.9811 1.9811 2.2874 2.2874 2.4203 2.4203 2.4695 2.4695 2.4843 2.4843 2.6095 2.6095 2.6826 2.6826 3.0627 3.0627 5.3407 5.3407 5.4073 5.4073 9.9159 9.9159 10.1781 10.1781 10.4914 10.4914 10.5745 10.5745 10.6619 10.6619 k = 0.2500 0.1443 0.4082 ( 21613 PWs) bands (ev): -14.5523 -14.5523 -14.5352 -14.5352 -11.1596 -11.1596 -10.5161 -10.5161 -10.4570 -10.4570 -10.4378 -10.4378 -10.3955 -10.3955 -10.3659 -10.3659 -3.4243 -3.4243 -3.3644 -3.3644 -2.2112 -2.2112 -2.0971 -2.0971 -2.0429 -2.0429 -1.9620 -1.9620 -1.7380 -1.7380 -1.7259 -1.7259 -1.5301 -1.5301 -0.7741 -0.7741 -0.6452 -0.6452 -0.4323 -0.4323 0.1154 0.1154 0.3932 0.3932 0.6409 0.6409 1.7309 1.7309 1.8203 1.8203 1.8412 1.8412 1.9846 1.9846 1.9948 1.9948 2.2978 2.2978 2.4303 2.4303 2.4711 2.4711 2.5005 2.5005 2.6136 2.6136 2.6838 2.6838 3.0584 3.0584 5.3665 5.3665 5.4059 5.4059 9.8474 9.8474 10.1101 10.1101 10.3863 10.3863 10.5016 10.5016 10.6450 10.6450 k = 0.2386 0.1378 0.3897 ( 21589 PWs) bands (ev): -14.5538 -14.5538 -14.5343 -14.5343 -11.1606 -11.1606 -10.5120 -10.5120 -10.4566 -10.4566 -10.4373 -10.4373 -10.3957 -10.3957 -10.3658 -10.3658 -3.4334 -3.4334 -3.3656 -3.3656 -2.2287 -2.2287 -2.1118 -2.1118 -2.0499 -2.0499 -1.9671 -1.9671 -1.7311 -1.7311 -1.7221 -1.7221 -1.5474 -1.5474 -0.7588 -0.7588 -0.6322 -0.6322 -0.4286 -0.4286 0.1134 0.1134 0.3914 0.3914 0.6414 0.6414 1.7364 1.7364 1.8303 1.8303 1.8508 1.8508 1.9879 1.9879 2.0241 2.0241 2.3085 2.3085 2.4385 2.4385 2.4764 2.4764 2.5168 2.5168 2.6177 2.6177 2.6853 2.6853 3.0542 3.0542 5.3906 5.3906 5.4076 5.4076 9.7741 9.7741 10.0435 10.0435 10.2843 10.2843 10.4295 10.4295 10.6256 10.6256 k = 0.2273 0.1312 0.3711 ( 21589 PWs) bands (ev): -14.5553 -14.5553 -14.5334 -14.5334 -11.1616 -11.1616 -10.5076 -10.5076 -10.4561 -10.4561 -10.4367 -10.4367 -10.3959 -10.3959 -10.3659 -10.3659 -3.4429 -3.4429 -3.3669 -3.3669 -2.2463 -2.2463 -2.1299 -2.1299 -2.0549 -2.0549 -1.9724 -1.9724 -1.7249 -1.7249 -1.7175 -1.7175 -1.5656 -1.5656 -0.7422 -0.7422 -0.6194 -0.6194 -0.4248 -0.4248 0.1125 0.1125 0.3904 0.3904 0.6395 0.6395 1.7435 1.7435 1.8413 1.8413 1.8630 1.8630 1.9903 1.9903 2.0538 2.0538 2.3196 2.3196 2.4459 2.4459 2.4847 2.4847 2.5328 2.5328 2.6218 2.6218 2.6868 2.6868 3.0500 3.0500 5.4059 5.4059 5.4193 5.4193 9.6973 9.6973 9.9782 9.9782 10.1857 10.1857 10.3586 10.3586 10.6037 10.6037 k = 0.2159 0.1247 0.3526 ( 21581 PWs) bands (ev): -14.5568 -14.5568 -14.5325 -14.5325 -11.1627 -11.1627 -10.5031 -10.5031 -10.4554 -10.4554 -10.4360 -10.4360 -10.3961 -10.3961 -10.3662 -10.3662 -3.4527 -3.4527 -3.3684 -3.3684 -2.2639 -2.2639 -2.1505 -2.1505 -2.0584 -2.0584 -1.9779 -1.9779 -1.7196 -1.7196 -1.7121 -1.7121 -1.5844 -1.5844 -0.7246 -0.7246 -0.6070 -0.6070 -0.4210 -0.4210 0.1126 0.1126 0.3904 0.3904 0.6354 0.6354 1.7519 1.7519 1.8519 1.8519 1.8791 1.8791 1.9918 1.9918 2.0834 2.0834 2.3308 2.3308 2.4541 2.4541 2.4948 2.4948 2.5484 2.5484 2.6263 2.6263 2.6884 2.6884 3.0459 3.0459 5.4124 5.4124 5.4408 5.4408 9.6180 9.6180 9.9140 9.9140 10.0908 10.0908 10.2894 10.2894 10.5792 10.5792 k = 0.2045 0.1181 0.3340 ( 21575 PWs) bands (ev): -14.5583 -14.5583 -14.5317 -14.5317 -11.1638 -11.1638 -10.4985 -10.4985 -10.4546 -10.4546 -10.4351 -10.4351 -10.3963 -10.3963 -10.3667 -10.3667 -3.4628 -3.4628 -3.3700 -3.3700 -2.2814 -2.2814 -2.1730 -2.1730 -2.0609 -2.0609 -1.9834 -1.9834 -1.7151 -1.7151 -1.7063 -1.7063 -1.6037 -1.6037 -0.7062 -0.7062 -0.5950 -0.5950 -0.4171 -0.4171 0.1138 0.1138 0.3913 0.3913 0.6293 0.6293 1.7615 1.7615 1.8613 1.8613 1.8993 1.8993 1.9926 1.9926 2.1128 2.1128 2.3421 2.3421 2.4637 2.4637 2.5059 2.5059 2.5633 2.5633 2.6310 2.6310 2.6899 2.6899 3.0417 3.0417 5.4198 5.4198 5.4624 5.4624 9.5375 9.5375 9.8508 9.8508 9.9997 9.9997 10.2220 10.2220 10.5519 10.5519 k = 0.1932 0.1115 0.3155 ( 21587 PWs) bands (ev): -14.5598 -14.5598 -14.5308 -14.5308 -11.1649 -11.1649 -10.4939 -10.4939 -10.4535 -10.4535 -10.4341 -10.4341 -10.3965 -10.3965 -10.3673 -10.3673 -3.4730 -3.4730 -3.3717 -3.3717 -2.2985 -2.2985 -2.1965 -2.1965 -2.0627 -2.0627 -1.9891 -1.9891 -1.7111 -1.7111 -1.7005 -1.7005 -1.6232 -1.6232 -0.6872 -0.6872 -0.5834 -0.5834 -0.4133 -0.4133 0.1157 0.1157 0.3932 0.3932 0.6214 0.6214 1.7720 1.7720 1.8699 1.8699 1.9228 1.9228 1.9929 1.9929 2.1417 2.1417 2.3534 2.3534 2.4753 2.4753 2.5173 2.5173 2.5776 2.5776 2.6361 2.6361 2.6914 2.6914 3.0374 3.0374 5.4290 5.4290 5.4829 5.4829 9.4566 9.4566 9.7887 9.7887 9.9126 9.9126 10.1568 10.1568 10.5217 10.5217 k = 0.1818 0.1050 0.2969 ( 21603 PWs) bands (ev): -14.5613 -14.5613 -14.5300 -14.5300 -11.1661 -11.1661 -10.4894 -10.4894 -10.4523 -10.4523 -10.4330 -10.4330 -10.3965 -10.3965 -10.3681 -10.3681 -3.4834 -3.4834 -3.3735 -3.3735 -2.3153 -2.3153 -2.2207 -2.2207 -2.0638 -2.0638 -1.9949 -1.9949 -1.7074 -1.7074 -1.6952 -1.6952 -1.6426 -1.6426 -0.6679 -0.6679 -0.5724 -0.5724 -0.4095 -0.4095 0.1183 0.1183 0.3962 0.3962 0.6120 0.6120 1.7834 1.7834 1.8779 1.8779 1.9481 1.9481 1.9935 1.9935 2.1701 2.1701 2.3644 2.3644 2.4887 2.4887 2.5290 2.5290 2.5910 2.5910 2.6415 2.6415 2.6928 2.6928 3.0331 3.0331 5.4400 5.4400 5.5023 5.5023 9.3761 9.3761 9.7279 9.7279 9.8296 9.8296 10.0938 10.0938 10.4883 10.4883 k = 0.1705 0.0984 0.2784 ( 21601 PWs) bands (ev): -14.5628 -14.5628 -14.5293 -14.5293 -11.1672 -11.1672 -10.4851 -10.4851 -10.4507 -10.4507 -10.4318 -10.4318 -10.3966 -10.3966 -10.3691 -10.3691 -3.4938 -3.4938 -3.3754 -3.3754 -2.3316 -2.3316 -2.2450 -2.2450 -2.0645 -2.0645 -2.0007 -2.0007 -1.7044 -1.7044 -1.6907 -1.6907 -1.6611 -1.6611 -0.6486 -0.6486 -0.5618 -0.5618 -0.4057 -0.4057 0.1213 0.1213 0.4000 0.4000 0.6015 0.6015 1.7955 1.7955 1.8855 1.8855 1.9712 1.9712 1.9979 1.9979 2.1977 2.1977 2.3753 2.3753 2.5037 2.5037 2.5406 2.5406 2.6034 2.6034 2.6473 2.6473 2.6943 2.6943 3.0286 3.0286 5.4526 5.4526 5.5204 5.5204 9.2967 9.2967 9.6687 9.6687 9.7508 9.7508 10.0334 10.0334 10.4511 10.4511 k = 0.1591 0.0919 0.2598 ( 21593 PWs) bands (ev): -14.5642 -14.5642 -14.5286 -14.5286 -11.1683 -11.1683 -10.4810 -10.4810 -10.4490 -10.4490 -10.4305 -10.4305 -10.3965 -10.3965 -10.3702 -10.3702 -3.5040 -3.5040 -3.3773 -3.3773 -2.3473 -2.3473 -2.2692 -2.2692 -2.0648 -2.0648 -2.0065 -2.0065 -1.7040 -1.7040 -1.6882 -1.6882 -1.6753 -1.6753 -0.6296 -0.6296 -0.5518 -0.5518 -0.4020 -0.4020 0.1244 0.1244 0.4049 0.4049 0.5901 0.5901 1.8082 1.8082 1.8926 1.8926 1.9808 1.9808 2.0168 2.0168 2.2245 2.2245 2.3860 2.3860 2.5200 2.5200 2.5523 2.5523 2.6147 2.6147 2.6536 2.6536 2.6960 2.6960 3.0241 3.0241 5.4668 5.4668 5.5372 5.5372 9.2191 9.2191 9.6111 9.6111 9.6764 9.6764 9.9755 9.9755 10.4101 10.4101 k = 0.1477 0.0853 0.2412 ( 21605 PWs) bands (ev): -14.5656 -14.5656 -14.5279 -14.5279 -11.1694 -11.1694 -10.4773 -10.4773 -10.4469 -10.4469 -10.4292 -10.4292 -10.3963 -10.3963 -10.3715 -10.3715 -3.5141 -3.5141 -3.3793 -3.3793 -2.3623 -2.3623 -2.2929 -2.2929 -2.0648 -2.0648 -2.0123 -2.0123 -1.7124 -1.7124 -1.6887 -1.6887 -1.6780 -1.6780 -0.6109 -0.6109 -0.5423 -0.5423 -0.3984 -0.3984 0.1275 0.1275 0.4106 0.4106 0.5782 0.5782 1.8214 1.8214 1.8994 1.8994 1.9817 1.9817 2.0450 2.0450 2.2504 2.2504 2.3965 2.3965 2.5370 2.5370 2.5637 2.5637 2.6247 2.6247 2.6603 2.6603 2.6980 2.6980 3.0194 3.0194 5.4821 5.4821 5.5527 5.5527 9.1439 9.1439 9.5557 9.5557 9.6065 9.6065 9.9202 9.9202 10.3657 10.3657 k = 0.1364 0.0787 0.2227 ( 21597 PWs) bands (ev): -14.5669 -14.5669 -14.5273 -14.5273 -11.1705 -11.1705 -10.4739 -10.4739 -10.4446 -10.4446 -10.4279 -10.4279 -10.3961 -10.3961 -10.3729 -10.3729 -3.5239 -3.5239 -3.3812 -3.3812 -2.3765 -2.3765 -2.3158 -2.3158 -2.0646 -2.0646 -2.0180 -2.0180 -1.7281 -1.7281 -1.6869 -1.6869 -1.6756 -1.6756 -0.5930 -0.5930 -0.5334 -0.5334 -0.3948 -0.3948 0.1302 0.1302 0.4170 0.4170 0.5662 0.5662 1.8348 1.8348 1.9056 1.9056 1.9809 1.9809 2.0747 2.0747 2.2754 2.2754 2.4069 2.4069 2.5542 2.5542 2.5750 2.5750 2.6331 2.6331 2.6675 2.6675 2.7003 2.7003 3.0146 3.0146 5.4983 5.4983 5.5668 5.5668 9.0717 9.0717 9.5025 9.5025 9.5413 9.5413 9.8679 9.8679 10.3193 10.3193 k = 0.1250 0.0722 0.2041 ( 21609 PWs) bands (ev): -14.5682 -14.5682 -14.5267 -14.5267 -11.1715 -11.1715 -10.4710 -10.4710 -10.4420 -10.4420 -10.4266 -10.4266 -10.3957 -10.3957 -10.3744 -10.3744 -3.5334 -3.5334 -3.3831 -3.3831 -2.3900 -2.3900 -2.3377 -2.3377 -2.0641 -2.0641 -2.0235 -2.0235 -1.7453 -1.7453 -1.6839 -1.6839 -1.6729 -1.6729 -0.5759 -0.5759 -0.5251 -0.5251 -0.3914 -0.3914 0.1325 0.1325 0.4241 0.4241 0.5543 0.5543 1.8483 1.8483 1.9113 1.9113 1.9799 1.9799 2.1040 2.1040 2.2997 2.2997 2.4172 2.4172 2.5711 2.5711 2.5859 2.5859 2.6398 2.6398 2.6753 2.6753 2.7033 2.7033 3.0097 3.0097 5.5152 5.5152 5.5796 5.5796 9.0029 9.0029 9.4521 9.4521 9.4809 9.4809 9.8186 9.8186 10.2724 10.2724 k = 0.1136 0.0656 0.1856 ( 21621 PWs) bands (ev): -14.5693 -14.5693 -14.5262 -14.5262 -11.1725 -11.1725 -10.4685 -10.4685 -10.4392 -10.4392 -10.4253 -10.4253 -10.3952 -10.3952 -10.3760 -10.3760 -3.5423 -3.5423 -3.3850 -3.3850 -2.4024 -2.4024 -2.3584 -2.3584 -2.0635 -2.0635 -2.0288 -2.0288 -1.7621 -1.7621 -1.6806 -1.6806 -1.6705 -1.6705 -0.5599 -0.5599 -0.5175 -0.5175 -0.3880 -0.3880 0.1342 0.1342 0.4316 0.4316 0.5429 0.5429 1.8615 1.8615 1.9164 1.9164 1.9792 1.9792 2.1317 2.1317 2.3233 2.3233 2.4272 2.4272 2.5871 2.5871 2.5965 2.5965 2.6448 2.6448 2.6835 2.6835 2.7070 2.7070 3.0047 3.0047 5.5324 5.5324 5.5911 5.5911 8.9382 8.9382 9.4046 9.4046 9.4253 9.4253 9.7725 9.7725 10.2264 10.2264 k = 0.1023 0.0590 0.1670 ( 21639 PWs) bands (ev): -14.5704 -14.5704 -14.5257 -14.5257 -11.1734 -11.1734 -10.4663 -10.4663 -10.4363 -10.4363 -10.4241 -10.4241 -10.3947 -10.3947 -10.3777 -10.3777 -3.5508 -3.5508 -3.3868 -3.3868 -2.4140 -2.4140 -2.3776 -2.3776 -2.0627 -2.0627 -2.0338 -2.0338 -1.7782 -1.7782 -1.6773 -1.6773 -1.6683 -1.6683 -0.5451 -0.5451 -0.5105 -0.5105 -0.3848 -0.3848 0.1352 0.1352 0.4394 0.4394 0.5321 0.5321 1.8743 1.8743 1.9208 1.9208 1.9788 1.9788 2.1572 2.1572 2.3464 2.3464 2.4368 2.4368 2.6015 2.6015 2.6070 2.6070 2.6482 2.6482 2.6920 2.6920 2.7113 2.7113 2.9997 2.9997 5.5495 5.5495 5.6013 5.6013 8.8779 8.8779 9.3603 9.3603 9.3747 9.3747 9.7298 9.7298 10.1820 10.1820 k = 0.0909 0.0525 0.1485 ( 21659 PWs) bands (ev): -14.5714 -14.5714 -14.5252 -14.5252 -11.1742 -11.1742 -10.4645 -10.4645 -10.4335 -10.4335 -10.4229 -10.4229 -10.3940 -10.3940 -10.3794 -10.3794 -3.5586 -3.5586 -3.3885 -3.3885 -2.4244 -2.4244 -2.3953 -2.3953 -2.0619 -2.0619 -2.0385 -2.0385 -1.7931 -1.7931 -1.6742 -1.6742 -1.6665 -1.6665 -0.5316 -0.5316 -0.5041 -0.5041 -0.3818 -0.3818 0.1356 0.1356 0.4471 0.4471 0.5223 0.5223 1.8864 1.8864 1.9245 1.9245 1.9791 1.9791 2.1799 2.1799 2.3691 2.3691 2.4459 2.4459 2.6126 2.6126 2.6186 2.6186 2.6503 2.6503 2.7006 2.7006 2.7161 2.7161 2.9948 2.9948 5.5661 5.5661 5.6102 5.6102 8.8225 8.8225 9.3196 9.3196 9.3291 9.3291 9.6909 9.6909 10.1400 10.1400 k = 0.0795 0.0459 0.1299 ( 21669 PWs) bands (ev): -14.5723 -14.5723 -14.5248 -14.5248 -11.1750 -11.1750 -10.4629 -10.4629 -10.4306 -10.4306 -10.4219 -10.4219 -10.3933 -10.3933 -10.3812 -10.3812 -3.5657 -3.5657 -3.3900 -3.3900 -2.4338 -2.4338 -2.4112 -2.4112 -2.0610 -2.0610 -2.0427 -2.0427 -1.8067 -1.8067 -1.6712 -1.6712 -1.6649 -1.6649 -0.5195 -0.5195 -0.4984 -0.4984 -0.3789 -0.3789 0.1355 0.1355 0.4547 0.4547 0.5134 0.5134 1.8974 1.8974 1.9275 1.9275 1.9801 1.9801 2.1995 2.1995 2.3911 2.3911 2.4544 2.4544 2.6210 2.6210 2.6303 2.6303 2.6512 2.6512 2.7090 2.7090 2.7212 2.7212 2.9901 2.9901 5.5820 5.5820 5.6180 5.6180 8.7725 8.7725 9.2828 9.2828 9.2887 9.2887 9.6560 9.6560 10.1011 10.1011 k = 0.0682 0.0394 0.1113 ( 21677 PWs) bands (ev): -14.5731 -14.5731 -14.5245 -14.5245 -11.1757 -11.1757 -10.4617 -10.4617 -10.4279 -10.4279 -10.4210 -10.4210 -10.3925 -10.3925 -10.3829 -10.3829 -3.5720 -3.5720 -3.3914 -3.3914 -2.4421 -2.4421 -2.4252 -2.4252 -2.0602 -2.0602 -2.0465 -2.0465 -1.8189 -1.8189 -1.6686 -1.6686 -1.6637 -1.6637 -0.5089 -0.5089 -0.4934 -0.4934 -0.3763 -0.3763 0.1349 0.1349 0.4618 0.4618 0.5057 0.5057 1.9071 1.9071 1.9297 1.9297 1.9818 1.9818 2.2159 2.2159 2.4123 2.4123 2.4621 2.4621 2.6279 2.6279 2.6407 2.6407 2.6514 2.6514 2.7172 2.7172 2.7263 2.7263 2.9856 2.9856 5.5966 5.5966 5.6245 5.6245 8.7283 8.7283 9.2501 9.2501 9.2536 9.2536 9.6252 9.6252 10.0657 10.0657 k = 0.0568 0.0328 0.0928 ( 21657 PWs) bands (ev): -14.5738 -14.5738 -14.5242 -14.5242 -11.1762 -11.1762 -10.4606 -10.4606 -10.4254 -10.4254 -10.4202 -10.4202 -10.3918 -10.3918 -10.3846 -10.3846 -3.5775 -3.5775 -3.3926 -3.3926 -2.4491 -2.4491 -2.4373 -2.4373 -2.0594 -2.0594 -2.0497 -2.0497 -1.8293 -1.8293 -1.6662 -1.6662 -1.6627 -1.6627 -0.4999 -0.4999 -0.4892 -0.4892 -0.3739 -0.3739 0.1340 0.1340 0.4682 0.4682 0.4991 0.4991 1.9154 1.9154 1.9313 1.9313 1.9839 1.9839 2.2292 2.2292 2.4319 2.4319 2.4687 2.4687 2.6336 2.6336 2.6487 2.6487 2.6516 2.6516 2.7246 2.7246 2.7311 2.7311 2.9815 2.9815 5.6097 5.6097 5.6300 5.6300 8.6903 8.6903 9.2218 9.2218 9.2237 9.2237 9.5988 9.5988 10.0347 10.0347 k = 0.0455 0.0262 0.0742 ( 21657 PWs) bands (ev): -14.5744 -14.5744 -14.5240 -14.5240 -11.1767 -11.1767 -10.4597 -10.4597 -10.4232 -10.4232 -10.4196 -10.4196 -10.3911 -10.3911 -10.3862 -10.3862 -3.5820 -3.5820 -3.3937 -3.3937 -2.4549 -2.4549 -2.4473 -2.4473 -2.0587 -2.0587 -2.0525 -2.0525 -1.8381 -1.8381 -1.6642 -1.6642 -1.6619 -1.6619 -0.4925 -0.4925 -0.4857 -0.4857 -0.3719 -0.3719 0.1330 0.1330 0.4738 0.4738 0.4937 0.4937 1.9222 1.9222 1.9324 1.9324 1.9864 1.9864 2.2396 2.2396 2.4494 2.4494 2.4744 2.4744 2.6382 2.6382 2.6493 2.6493 2.6573 2.6573 2.7312 2.7312 2.7354 2.7354 2.9780 2.9780 5.6209 5.6209 5.6344 5.6344 8.6587 8.6587 9.1983 9.1983 9.1992 9.1992 9.5769 9.5769 10.0084 10.0084 k = 0.0341 0.0197 0.0557 ( 21639 PWs) bands (ev): -14.5748 -14.5748 -14.5238 -14.5238 -11.1771 -11.1771 -10.4591 -10.4591 -10.4213 -10.4213 -10.4191 -10.4191 -10.3905 -10.3905 -10.3876 -10.3876 -3.5856 -3.5856 -3.3945 -3.3945 -2.4595 -2.4595 -2.4552 -2.4552 -2.0582 -2.0582 -2.0546 -2.0546 -1.8450 -1.8450 -1.6627 -1.6627 -1.6613 -1.6613 -0.4868 -0.4868 -0.4829 -0.4829 -0.3703 -0.3703 0.1320 0.1320 0.4783 0.4783 0.4896 0.4896 1.9273 1.9273 1.9331 1.9331 1.9887 1.9887 2.2473 2.2473 2.4641 2.4641 2.4788 2.4788 2.6417 2.6417 2.6483 2.6483 2.6627 2.6627 2.7366 2.7366 2.7390 2.7390 2.9750 2.9750 5.6300 5.6300 5.6378 5.6378 8.6338 8.6338 9.1797 9.1797 9.1800 9.1800 9.5598 9.5598 9.9874 9.9874 k = 0.0227 0.0131 0.0371 ( 21603 PWs) bands (ev): -14.5751 -14.5751 -14.5237 -14.5237 -11.1773 -11.1773 -10.4586 -10.4586 -10.4198 -10.4198 -10.4188 -10.4188 -10.3900 -10.3900 -10.3887 -10.3887 -3.5882 -3.5882 -3.3951 -3.3951 -2.4627 -2.4627 -2.4608 -2.4608 -2.0577 -2.0577 -2.0561 -2.0561 -1.8500 -1.8500 -1.6615 -1.6615 -1.6609 -1.6609 -0.4827 -0.4827 -0.4810 -0.4810 -0.3691 -0.3691 0.1311 0.1311 0.4816 0.4816 0.4867 0.4867 1.9309 1.9309 1.9335 1.9335 1.9907 1.9907 2.2527 2.2527 2.4753 2.4753 2.4820 2.4820 2.6441 2.6441 2.6472 2.6472 2.6666 2.6666 2.7406 2.7406 2.7417 2.7417 2.9728 2.9728 5.6366 5.6366 5.6401 5.6401 8.6159 8.6159 9.1662 9.1662 9.1663 9.1663 9.5475 9.5475 9.9721 9.9721 k = 0.0114 0.0066 0.0186 ( 21595 PWs) bands (ev): -14.5753 -14.5753 -14.5236 -14.5236 -11.1775 -11.1775 -10.4584 -10.4584 -10.4189 -10.4189 -10.4186 -10.4186 -10.3897 -10.3897 -10.3894 -10.3894 -3.5898 -3.5898 -3.3954 -3.3954 -2.4647 -2.4647 -2.4642 -2.4642 -2.0575 -2.0575 -2.0571 -2.0571 -1.8530 -1.8530 -1.6608 -1.6608 -1.6607 -1.6607 -0.4802 -0.4802 -0.4798 -0.4798 -0.3684 -0.3684 0.1306 0.1306 0.4836 0.4836 0.4849 0.4849 1.9331 1.9331 1.9337 1.9337 1.9921 1.9921 2.2559 2.2559 2.4822 2.4822 2.4840 2.4840 2.6456 2.6456 2.6464 2.6464 2.6689 2.6689 2.7431 2.7431 2.7434 2.7434 2.9715 2.9715 5.6407 5.6407 5.6416 5.6416 8.6051 8.6051 9.1581 9.1581 9.1581 9.1581 9.5401 9.5401 9.9628 9.9628 k = 0.0000 0.0000 0.0000 ( 21595 PWs) bands (ev): -14.5754 -14.5754 -14.5236 -14.5236 -11.1775 -11.1775 -10.4583 -10.4583 -10.4185 -10.4185 -10.4185 -10.4185 -10.3896 -10.3896 -10.3896 -10.3896 -3.5903 -3.5903 -3.3955 -3.3955 -2.4653 -2.4653 -2.4653 -2.4653 -2.0574 -2.0574 -2.0574 -2.0574 -1.8540 -1.8540 -1.6606 -1.6606 -1.6606 -1.6606 -0.4794 -0.4794 -0.4794 -0.4794 -0.3681 -0.3681 0.1304 0.1304 0.4843 0.4843 0.4843 0.4843 1.9338 1.9338 1.9338 1.9338 1.9925 1.9925 2.2569 2.2569 2.4846 2.4846 2.4846 2.4846 2.6461 2.6461 2.6461 2.6461 2.6697 2.6697 2.7440 2.7440 2.7440 2.7440 2.9710 2.9710 5.6420 5.6420 5.6420 5.6420 8.6014 8.6014 9.1554 9.1554 9.1554 9.1554 9.5376 9.5376 9.9597 9.9597 k = 0.0000 0.0000 0.0000 ( 21595 PWs) bands (ev): -14.5754 -14.5754 -14.5236 -14.5236 -11.1775 -11.1775 -10.4583 -10.4583 -10.4185 -10.4185 -10.4185 -10.4185 -10.3896 -10.3896 -10.3896 -10.3896 -3.5903 -3.5903 -3.3955 -3.3955 -2.4653 -2.4653 -2.4653 -2.4653 -2.0574 -2.0574 -2.0574 -2.0574 -1.8540 -1.8540 -1.6606 -1.6606 -1.6606 -1.6606 -0.4794 -0.4794 -0.4794 -0.4794 -0.3681 -0.3681 0.1304 0.1304 0.4843 0.4843 0.4843 0.4843 1.9338 1.9338 1.9338 1.9338 1.9925 1.9925 2.2569 2.2569 2.4846 2.4846 2.4846 2.4846 2.6461 2.6461 2.6461 2.6461 2.6697 2.6697 2.7440 2.7440 2.7440 2.7440 2.9710 2.9710 5.6420 5.6420 5.6420 5.6420 8.6014 8.6014 9.1554 9.1554 9.1554 9.1554 9.5376 9.5376 9.9597 9.9597 k = 0.0185 0.0107 0.0076 ( 21595 PWs) bands (ev): -14.5753 -14.5753 -14.5236 -14.5236 -11.1775 -11.1775 -10.4584 -10.4584 -10.4188 -10.4188 -10.4186 -10.4186 -10.3898 -10.3898 -10.3894 -10.3894 -3.5898 -3.5898 -3.3954 -3.3954 -2.4647 -2.4647 -2.4642 -2.4642 -2.0575 -2.0575 -2.0570 -2.0570 -1.8530 -1.8530 -1.6608 -1.6608 -1.6607 -1.6607 -0.4802 -0.4802 -0.4797 -0.4797 -0.3684 -0.3684 0.1306 0.1306 0.4835 0.4835 0.4850 0.4850 1.9330 1.9330 1.9337 1.9337 1.9921 1.9921 2.2559 2.2559 2.4821 2.4821 2.4841 2.4841 2.6457 2.6457 2.6463 2.6463 2.6689 2.6689 2.7432 2.7432 2.7433 2.7433 2.9715 2.9715 5.6411 5.6411 5.6411 5.6411 8.6050 8.6050 9.1581 9.1581 9.1581 9.1581 9.5401 9.5401 9.9628 9.9628 k = 0.0370 0.0214 0.0151 ( 21601 PWs) bands (ev): -14.5751 -14.5751 -14.5237 -14.5237 -11.1773 -11.1773 -10.4586 -10.4586 -10.4196 -10.4196 -10.4190 -10.4190 -10.3901 -10.3901 -10.3886 -10.3886 -3.5882 -3.5882 -3.3951 -3.3951 -2.4629 -2.4629 -2.4607 -2.4607 -2.0578 -2.0578 -2.0561 -2.0561 -1.8500 -1.8500 -1.6614 -1.6614 -1.6610 -1.6610 -0.4828 -0.4828 -0.4808 -0.4808 -0.3691 -0.3691 0.1311 0.1311 0.4813 0.4813 0.4870 0.4870 1.9308 1.9308 1.9336 1.9336 1.9908 1.9908 2.2527 2.2527 2.4749 2.4749 2.4825 2.4825 2.6445 2.6445 2.6468 2.6468 2.6666 2.6666 2.7410 2.7410 2.7414 2.7414 2.9728 2.9728 5.6383 5.6383 5.6385 5.6385 8.6158 8.6158 9.1662 9.1662 9.1663 9.1663 9.5474 9.5474 9.9720 9.9720 k = 0.0556 0.0321 0.0227 ( 21649 PWs) bands (ev): -14.5748 -14.5748 -14.5238 -14.5238 -11.1771 -11.1771 -10.4591 -10.4591 -10.4208 -10.4208 -10.4196 -10.4196 -10.3906 -10.3906 -10.3875 -10.3875 -3.5856 -3.5856 -3.3945 -3.3945 -2.4598 -2.4598 -2.4549 -2.4549 -2.0583 -2.0583 -2.0544 -2.0544 -1.8451 -1.8451 -1.6623 -1.6623 -1.6616 -1.6616 -0.4871 -0.4871 -0.4826 -0.4826 -0.3703 -0.3703 0.1319 0.1319 0.4776 0.4776 0.4903 0.4903 1.9272 1.9272 1.9331 1.9331 1.9889 1.9889 2.2473 2.2473 2.4633 2.4633 2.4799 2.4799 2.6424 2.6424 2.6475 2.6475 2.6628 2.6628 2.7376 2.7376 2.7381 2.7381 2.9750 2.9750 5.6337 5.6337 5.6341 5.6341 8.6336 8.6336 9.1797 9.1797 9.1798 9.1798 9.5596 9.5596 9.9872 9.9872 k = 0.0741 0.0428 0.0302 ( 21664 PWs) bands (ev): -14.5744 -14.5744 -14.5240 -14.5240 -11.1767 -11.1767 -10.4597 -10.4597 -10.4224 -10.4224 -10.4204 -10.4204 -10.3912 -10.3912 -10.3860 -10.3860 -3.5820 -3.5820 -3.3937 -3.3937 -2.4555 -2.4555 -2.4469 -2.4469 -2.0590 -2.0590 -2.0522 -2.0522 -1.8382 -1.8382 -1.6637 -1.6637 -1.6625 -1.6625 -0.4930 -0.4930 -0.4851 -0.4851 -0.3719 -0.3719 0.1328 0.1328 0.4728 0.4728 0.4950 0.4950 1.9222 1.9222 1.9318 1.9318 1.9870 1.9870 2.2393 2.2393 2.4481 2.4481 2.4765 2.4765 2.6393 2.6393 2.6480 2.6480 2.6575 2.6575 2.7331 2.7331 2.7337 2.7337 2.9778 2.9778 5.6274 5.6274 5.6282 5.6282 8.6584 8.6584 9.1984 9.1984 9.1987 9.1987 9.5766 9.5766 10.0078 10.0078 k = 0.0926 0.0535 0.0378 ( 21658 PWs) bands (ev): -14.5738 -14.5738 -14.5242 -14.5242 -11.1762 -11.1762 -10.4606 -10.4606 -10.4243 -10.4243 -10.4216 -10.4216 -10.3919 -10.3919 -10.3843 -10.3843 -3.5775 -3.5775 -3.3927 -3.3927 -2.4500 -2.4500 -2.4366 -2.4366 -2.0599 -2.0599 -2.0492 -2.0492 -1.8295 -1.8295 -1.6653 -1.6653 -1.6636 -1.6636 -0.5008 -0.5008 -0.4882 -0.4882 -0.3739 -0.3739 0.1335 0.1335 0.4670 0.4670 0.5008 0.5008 1.9160 1.9160 1.9293 1.9293 1.9855 1.9855 2.2285 2.2285 2.4303 2.4303 2.4723 2.4723 2.6351 2.6351 2.6478 2.6478 2.6506 2.6506 2.7280 2.7280 2.7281 2.7281 2.9812 2.9812 5.6195 5.6195 5.6207 5.6207 8.6897 8.6897 9.2222 9.2222 9.2227 9.2227 9.5980 9.5980 10.0332 10.0332 k = 0.1111 0.0642 0.0454 ( 21664 PWs) bands (ev): -14.5731 -14.5731 -14.5245 -14.5245 -11.1757 -11.1757 -10.4616 -10.4616 -10.4263 -10.4263 -10.4230 -10.4230 -10.3926 -10.3926 -10.3824 -10.3824 -3.5721 -3.5721 -3.3915 -3.3915 -2.4434 -2.4434 -2.4242 -2.4242 -2.0610 -2.0610 -2.0457 -2.0457 -1.8191 -1.8191 -1.6673 -1.6673 -1.6650 -1.6650 -0.5102 -0.5102 -0.4919 -0.4919 -0.3762 -0.3762 0.1338 0.1338 0.4608 0.4608 0.5078 0.5078 1.9087 1.9087 1.9251 1.9251 1.9852 1.9852 2.2141 2.2141 2.4110 2.4110 2.4675 2.4675 2.6298 2.6298 2.6424 2.6424 2.6462 2.6462 2.7214 2.7214 2.7229 2.7229 2.9849 2.9849 5.6101 5.6101 5.6119 5.6119 8.7274 8.7274 9.2510 9.2510 9.2518 9.2518 9.6238 9.6238 10.0625 10.0625 k = 0.1296 0.0748 0.0529 ( 21652 PWs) bands (ev): -14.5723 -14.5723 -14.5249 -14.5249 -11.1750 -11.1750 -10.4628 -10.4628 -10.4284 -10.4284 -10.4248 -10.4248 -10.3933 -10.3933 -10.3805 -10.3805 -3.5659 -3.5659 -3.3901 -3.3901 -2.4358 -2.4358 -2.4098 -2.4098 -2.0621 -2.0621 -2.0415 -2.0415 -1.8071 -1.8071 -1.6696 -1.6696 -1.6667 -1.6667 -0.5213 -0.5213 -0.4962 -0.4962 -0.3787 -0.3787 0.1333 0.1333 0.4545 0.4545 0.5159 0.5159 1.9003 1.9003 1.9188 1.9188 1.9864 1.9864 2.1958 2.1958 2.3914 2.3914 2.4623 2.4623 2.6232 2.6232 2.6329 2.6329 2.6427 2.6427 2.7137 2.7137 2.7185 2.7185 2.9890 2.9890 5.5995 5.5995 5.6020 5.6020 8.7711 8.7711 9.2845 9.2845 9.2856 9.2856 9.6537 9.6537 10.0944 10.0944 k = 0.1481 0.0855 0.0605 ( 21634 PWs) bands (ev): -14.5714 -14.5714 -14.5253 -14.5253 -11.1742 -11.1742 -10.4643 -10.4643 -10.4305 -10.4305 -10.4270 -10.4270 -10.3939 -10.3939 -10.3785 -10.3785 -3.5589 -3.5589 -3.3886 -3.3886 -2.4271 -2.4271 -2.3935 -2.3935 -2.0634 -2.0634 -2.0367 -2.0367 -1.7936 -1.7936 -1.6720 -1.6720 -1.6688 -1.6688 -0.5340 -0.5340 -0.5010 -0.5010 -0.3815 -0.3815 0.1315 0.1315 0.4486 0.4486 0.5250 0.5250 1.8912 1.8912 1.9106 1.9106 1.9892 1.9892 2.1729 2.1729 2.3726 2.3726 2.4567 2.4567 2.6149 2.6149 2.6226 2.6226 2.6365 2.6365 2.7051 2.7051 2.7153 2.7153 2.9932 2.9932 5.5877 5.5877 5.5910 5.5910 8.8204 8.8204 9.3225 9.3225 9.3241 9.3241 9.6875 9.6875 10.1273 10.1273 k = 0.1667 0.0962 0.0680 ( 21640 PWs) bands (ev): -14.5704 -14.5704 -14.5257 -14.5257 -11.1734 -11.1734 -10.4659 -10.4659 -10.4327 -10.4327 -10.4293 -10.4293 -10.3943 -10.3943 -10.3765 -10.3765 -3.5512 -3.5512 -3.3870 -3.3870 -2.4175 -2.4175 -2.3753 -2.3753 -2.0648 -2.0648 -2.0313 -2.0313 -1.7789 -1.7789 -1.6746 -1.6746 -1.6712 -1.6712 -0.5484 -0.5484 -0.5062 -0.5062 -0.3844 -0.3844 0.1283 0.1283 0.4436 0.4436 0.5350 0.5350 1.8814 1.8814 1.9009 1.9009 1.9934 1.9934 2.1454 2.1454 2.3555 2.3555 2.4509 2.4509 2.6045 2.6045 2.6122 2.6122 2.6276 2.6276 2.6957 2.6957 2.7137 2.7137 2.9975 2.9975 5.5751 5.5751 5.5792 5.5792 8.8748 8.8748 9.3648 9.3648 9.3669 9.3669 9.7248 9.7248 10.1598 10.1598 k = 0.1852 0.1069 0.0756 ( 21605 PWs) bands (ev): -14.5693 -14.5693 -14.5262 -14.5262 -11.1725 -11.1725 -10.4679 -10.4679 -10.4349 -10.4349 -10.4319 -10.4319 -10.3947 -10.3947 -10.3745 -10.3745 -3.5429 -3.5429 -3.3854 -3.3854 -2.4070 -2.4070 -2.3555 -2.3555 -2.0662 -2.0662 -2.0255 -2.0255 -1.7630 -1.7630 -1.6773 -1.6773 -1.6740 -1.6740 -0.5642 -0.5642 -0.5118 -0.5118 -0.3873 -0.3873 0.1231 0.1231 0.4399 0.4399 0.5457 0.5457 1.8711 1.8711 1.8899 1.8899 1.9987 1.9987 2.1134 2.1134 2.3403 2.3403 2.4449 2.4449 2.5919 2.5919 2.6021 2.6021 2.6161 2.6161 2.6856 2.6856 2.7134 2.7134 3.0017 3.0017 5.5618 5.5618 5.5669 5.5669 8.9339 8.9339 9.4110 9.4110 9.4139 9.4139 9.7653 9.7653 10.1909 10.1909 k = 0.2037 0.1176 0.0832 ( 21617 PWs) bands (ev): -14.5681 -14.5681 -14.5268 -14.5268 -11.1716 -11.1716 -10.4701 -10.4701 -10.4370 -10.4370 -10.4346 -10.4346 -10.3949 -10.3949 -10.3726 -10.3726 -3.5342 -3.5342 -3.3836 -3.3836 -2.3958 -2.3958 -2.3342 -2.3342 -2.0676 -2.0676 -2.0191 -2.0191 -1.7463 -1.7463 -1.6800 -1.6800 -1.6773 -1.6773 -0.5815 -0.5815 -0.5177 -0.5177 -0.3904 -0.3904 0.1158 0.1158 0.4380 0.4380 0.5571 0.5571 1.8604 1.8604 1.8780 1.8780 2.0050 2.0050 2.0778 2.0778 2.3271 2.3271 2.4389 2.4389 2.5776 2.5776 2.5918 2.5918 2.6024 2.6024 2.6750 2.6750 2.7142 2.7142 3.0058 3.0058 5.5480 5.5480 5.5541 5.5541 8.9972 8.9972 9.4609 9.4609 9.4646 9.4646 9.8088 9.8088 10.2198 10.2198 k = 0.2222 0.1283 0.0907 ( 21632 PWs) bands (ev): -14.5669 -14.5669 -14.5274 -14.5274 -11.1705 -11.1705 -10.4725 -10.4725 -10.4391 -10.4391 -10.4373 -10.4373 -10.3950 -10.3950 -10.3707 -10.3707 -3.5250 -3.5250 -3.3819 -3.3819 -2.3840 -2.3840 -2.3116 -2.3116 -2.0689 -2.0689 -2.0124 -2.0124 -1.7292 -1.7292 -1.6824 -1.6824 -1.6810 -1.6810 -0.6000 -0.6000 -0.5238 -0.5238 -0.3934 -0.3934 0.1062 0.1062 0.4379 0.4379 0.5690 0.5690 1.8496 1.8496 1.8656 1.8656 2.0121 2.0121 2.0392 2.0392 2.3157 2.3157 2.4329 2.4329 2.5622 2.5622 2.5812 2.5812 2.5872 2.5872 2.6638 2.6638 2.7155 2.7155 3.0098 3.0098 5.5339 5.5339 5.5412 5.5412 9.0641 9.0641 9.5142 9.5142 9.5188 9.5188 9.8549 9.8549 10.2459 10.2459 k = 0.2407 0.1390 0.0983 ( 21608 PWs) bands (ev): -14.5655 -14.5655 -14.5281 -14.5281 -11.1695 -11.1695 -10.4753 -10.4753 -10.4411 -10.4411 -10.4400 -10.4400 -10.3951 -10.3951 -10.3689 -10.3689 -3.5155 -3.5155 -3.3803 -3.3803 -2.3716 -2.3716 -2.2879 -2.2879 -2.0702 -2.0702 -2.0054 -2.0054 -1.7126 -1.7126 -1.6851 -1.6851 -1.6838 -1.6838 -0.6195 -0.6195 -0.5301 -0.5301 -0.3963 -0.3963 0.0946 0.0946 0.4398 0.4398 0.5813 0.5813 1.8388 1.8388 1.8530 1.8530 1.9986 1.9986 2.0199 2.0199 2.3056 2.3056 2.4271 2.4271 2.5461 2.5461 2.5702 2.5702 2.5709 2.5709 2.6523 2.6523 2.7172 2.7172 3.0135 3.0135 5.5198 5.5198 5.5282 5.5282 9.1342 9.1342 9.5704 9.5704 9.5761 9.5761 9.9031 9.9031 10.2690 10.2690 k = 0.2593 0.1497 0.1058 ( 21605 PWs) bands (ev): -14.5641 -14.5641 -14.5288 -14.5288 -11.1684 -11.1684 -10.4783 -10.4783 -10.4431 -10.4431 -10.4425 -10.4425 -10.3950 -10.3950 -10.3672 -10.3672 -3.5059 -3.5059 -3.3787 -3.3787 -2.3589 -2.3589 -2.2634 -2.2634 -2.0714 -2.0714 -1.9982 -1.9982 -1.7002 -1.7002 -1.6897 -1.6897 -1.6806 -1.6806 -0.6400 -0.6400 -0.5364 -0.5364 -0.3991 -0.3991 0.0810 0.0810 0.4435 0.4435 0.5938 0.5938 1.8281 1.8281 1.8403 1.8403 1.9569 1.9569 2.0281 2.0281 2.2968 2.2968 2.4214 2.4214 2.5296 2.5296 2.5540 2.5540 2.5591 2.5591 2.6406 2.6406 2.7190 2.7190 3.0171 3.0171 5.5058 5.5058 5.5154 5.5154 9.2067 9.2067 9.6292 9.6292 9.6363 9.6363 9.9532 9.9532 10.2892 10.2892 k = 0.2778 0.1604 0.1134 ( 21569 PWs) bands (ev): -14.5627 -14.5627 -14.5296 -14.5296 -11.1673 -11.1673 -10.4816 -10.4816 -10.4449 -10.4449 -10.4448 -10.4448 -10.3949 -10.3949 -10.3656 -10.3656 -3.4961 -3.4961 -3.3773 -3.3773 -2.3460 -2.3460 -2.2384 -2.2384 -2.0724 -2.0724 -1.9908 -1.9908 -1.6974 -1.6974 -1.6946 -1.6946 -1.6676 -1.6676 -0.6611 -0.6611 -0.5426 -0.5426 -0.4019 -0.4019 0.0661 0.0661 0.4488 0.4488 0.6063 0.6063 1.8178 1.8178 1.8278 1.8278 1.9149 1.9149 2.0368 2.0368 2.2890 2.2890 2.4159 2.4159 2.5128 2.5128 2.5367 2.5367 2.5480 2.5480 2.6287 2.6287 2.7208 2.7208 3.0203 3.0203 5.4921 5.4921 5.5029 5.5029 9.2813 9.2813 9.6904 9.6904 9.6989 9.6989 10.0047 10.0047 10.3063 10.3063 k = 0.2963 0.1711 0.1210 ( 21572 PWs) bands (ev): -14.5612 -14.5612 -14.5305 -14.5305 -11.1662 -11.1662 -10.4850 -10.4850 -10.4469 -10.4469 -10.4467 -10.4467 -10.3948 -10.3948 -10.3641 -10.3641 -3.4864 -3.4864 -3.3760 -3.3760 -2.3330 -2.3330 -2.2130 -2.2130 -2.0732 -2.0732 -1.9835 -1.9835 -1.7000 -1.7000 -1.6986 -1.6986 -1.6506 -1.6506 -0.6826 -0.6826 -0.5487 -0.5487 -0.4044 -0.4044 0.0501 0.0501 0.4552 0.4552 0.6187 0.6187 1.8078 1.8078 1.8156 1.8156 1.8734 1.8734 2.0456 2.0456 2.2820 2.2820 2.4106 2.4106 2.4961 2.4961 2.5194 2.5194 2.5369 2.5369 2.6169 2.6169 2.7224 2.7224 3.0233 3.0233 5.4788 5.4788 5.4910 5.4910 9.3571 9.3571 9.7534 9.7534 9.7636 9.7636 10.0568 10.0568 10.3206 10.3206 k = 0.3148 0.1818 0.1285 ( 21602 PWs) bands (ev): -14.5596 -14.5596 -14.5314 -14.5314 -11.1651 -11.1651 -10.4885 -10.4885 -10.4487 -10.4487 -10.4483 -10.4483 -10.3947 -10.3947 -10.3627 -10.3627 -3.4769 -3.4769 -3.3750 -3.3750 -2.3203 -2.3203 -2.1878 -2.1878 -2.0738 -2.0738 -1.9761 -1.9761 -1.7056 -1.7056 -1.7007 -1.7007 -1.6331 -1.6331 -0.7042 -0.7042 -0.5546 -0.5546 -0.4067 -0.4067 0.0335 0.0335 0.4625 0.4625 0.6308 0.6308 1.7983 1.7983 1.8038 1.8038 1.8331 1.8331 2.0546 2.0546 2.2757 2.2757 2.4057 2.4057 2.4798 2.4798 2.5024 2.5024 2.5261 2.5261 2.6051 2.6051 2.7239 2.7239 3.0259 3.0259 5.4662 5.4662 5.4796 5.4796 9.4337 9.4337 9.8180 9.8180 9.8300 9.8300 10.1090 10.1090 10.3324 10.3324 k = 0.3333 0.1925 0.1361 ( 21593 PWs) bands (ev): -14.5580 -14.5580 -14.5324 -14.5324 -11.1641 -11.1641 -10.4920 -10.4920 -10.4503 -10.4503 -10.4498 -10.4498 -10.3945 -10.3945 -10.3614 -10.3614 -3.4675 -3.4675 -3.3742 -3.3742 -2.3079 -2.3079 -2.1631 -2.1631 -2.0741 -2.0741 -1.9690 -1.9690 -1.7115 -1.7115 -1.7029 -1.7029 -1.6160 -1.6160 -0.7255 -0.7255 -0.5602 -0.5602 -0.4088 -0.4088 0.0169 0.0169 0.4704 0.4704 0.6424 0.6424 1.7895 1.7895 1.7896 1.7896 1.7977 1.7977 2.0636 2.0636 2.2702 2.2702 2.4011 2.4011 2.4640 2.4640 2.4861 2.4861 2.5158 2.5158 2.5937 2.5937 2.7252 2.7252 3.0283 3.0283 5.4544 5.4544 5.4690 5.4690 9.5103 9.5103 9.8837 9.8837 9.8977 9.8977 10.1601 10.1601 10.3419 10.3419 k = 0.3519 0.2031 0.1436 ( 21590 PWs) bands (ev): -14.5564 -14.5564 -14.5334 -14.5334 -11.1631 -11.1631 -10.4954 -10.4954 -10.4517 -10.4517 -10.4511 -10.4511 -10.3943 -10.3943 -10.3603 -10.3603 -3.4585 -3.4585 -3.3737 -3.3737 -2.2960 -2.2960 -2.1392 -2.1392 -2.0741 -2.0741 -1.9621 -1.9621 -1.7175 -1.7175 -1.7050 -1.7050 -1.5997 -1.5997 -0.7462 -0.7462 -0.5654 -0.5654 -0.4107 -0.4107 0.0006 0.0006 0.4783 0.4783 0.6534 0.6534 1.7566 1.7566 1.7814 1.7814 1.7842 1.7842 2.0723 2.0723 2.2652 2.2652 2.3970 2.3970 2.4490 2.4490 2.4706 2.4706 2.5061 2.5061 2.5827 2.5827 2.7264 2.7264 3.0304 3.0304 5.4434 5.4434 5.4592 5.4592 9.5863 9.5863 9.9502 9.9502 9.9663 9.9663 10.2084 10.2084 10.3502 10.3502 k = 0.3704 0.2138 0.1512 ( 21560 PWs) bands (ev): -14.5548 -14.5548 -14.5345 -14.5345 -11.1622 -11.1622 -10.4986 -10.4986 -10.4529 -10.4529 -10.4523 -10.4523 -10.3942 -10.3942 -10.3592 -10.3592 -3.4500 -3.4500 -3.3735 -3.3735 -2.2850 -2.2850 -2.1167 -2.1167 -2.0738 -2.0738 -1.9555 -1.9555 -1.7235 -1.7235 -1.7070 -1.7070 -1.5847 -1.5847 -0.7658 -0.7658 -0.5702 -0.5702 -0.4123 -0.4123 -0.0148 -0.0148 0.4862 0.4862 0.6636 0.6636 1.7233 1.7233 1.7741 1.7741 1.7749 1.7749 2.0807 2.0807 2.2608 2.2608 2.3932 2.3932 2.4351 2.4351 2.4562 2.4562 2.4971 2.4971 2.5723 2.5723 2.7273 2.7273 3.0322 3.0322 5.4335 5.4335 5.4504 5.4504 9.6608 9.6608 10.0168 10.0168 10.0353 10.0353 10.2508 10.2508 10.3593 10.3593 k = 0.3889 0.2245 0.1588 ( 21569 PWs) bands (ev): -14.5532 -14.5532 -14.5357 -14.5357 -11.1614 -11.1614 -10.5016 -10.5016 -10.4539 -10.4539 -10.4534 -10.4534 -10.3940 -10.3940 -10.3583 -10.3583 -3.4421 -3.4421 -3.3736 -3.3736 -2.2750 -2.2750 -2.0960 -2.0960 -2.0732 -2.0732 -1.9494 -1.9494 -1.7293 -1.7293 -1.7087 -1.7087 -1.5711 -1.5711 -0.7841 -0.7841 -0.5745 -0.5745 -0.4137 -0.4137 -0.0290 -0.0290 0.4935 0.4935 0.6728 0.6728 1.6931 1.6931 1.7668 1.7668 1.7677 1.7677 2.0886 2.0886 2.2571 2.2571 2.3899 2.3899 2.4226 2.4226 2.4432 2.4432 2.4890 2.4890 2.5628 2.5628 2.7280 2.7280 3.0337 3.0337 5.4248 5.4248 5.4426 5.4426 9.7328 9.7328 10.0830 10.0830 10.1041 10.1041 10.2811 10.2811 10.3740 10.3740 k = 0.4074 0.2352 0.1663 ( 21584 PWs) bands (ev): -14.5516 -14.5516 -14.5369 -14.5369 -11.1606 -11.1606 -10.5042 -10.5042 -10.4548 -10.4548 -10.4543 -10.4543 -10.3939 -10.3939 -10.3576 -10.3576 -3.4348 -3.4348 -3.3740 -3.3740 -2.2663 -2.2663 -2.0776 -2.0776 -2.0725 -2.0725 -1.9438 -1.9438 -1.7347 -1.7347 -1.7102 -1.7102 -1.5593 -1.5593 -0.8004 -0.8004 -0.5782 -0.5782 -0.4148 -0.4148 -0.0417 -0.0417 0.5002 0.5002 0.6808 0.6808 1.6667 1.6667 1.7598 1.7598 1.7622 1.7622 2.0957 2.0957 2.2539 2.2539 2.3871 2.3871 2.4115 2.4115 2.4317 2.4317 2.4820 2.4820 2.5543 2.5543 2.7286 2.7286 3.0349 3.0349 5.4172 5.4172 5.4359 5.4359 9.8015 9.8015 10.1481 10.1481 10.1719 10.1719 10.2941 10.2941 10.3984 10.3984 k = 0.4259 0.2459 0.1739 ( 21587 PWs) bands (ev): -14.5500 -14.5500 -14.5382 -14.5382 -11.1600 -11.1600 -10.5064 -10.5064 -10.4554 -10.4554 -10.4551 -10.4551 -10.3938 -10.3938 -10.3569 -10.3569 -3.4284 -3.4284 -3.3747 -3.3747 -2.2588 -2.2588 -2.0716 -2.0716 -2.0619 -2.0619 -1.9388 -1.9388 -1.7396 -1.7396 -1.7115 -1.7115 -1.5494 -1.5494 -0.8145 -0.8145 -0.5814 -0.5814 -0.4156 -0.4156 -0.0525 -0.0525 0.5060 0.5060 0.6877 0.6877 1.6446 1.6446 1.7541 1.7541 1.7576 1.7576 2.1019 2.1019 2.2513 2.2513 2.3848 2.3848 2.4022 2.4022 2.4221 2.4221 2.4760 2.4760 2.5470 2.5470 2.7291 2.7291 3.0359 3.0359 5.4109 5.4109 5.4303 5.4303 9.8652 9.8652 10.2110 10.2110 10.2377 10.2377 10.2931 10.2931 10.4278 10.4278 k = 0.4444 0.2566 0.1814 ( 21593 PWs) bands (ev): -14.5484 -14.5484 -14.5395 -14.5395 -11.1595 -11.1595 -10.5082 -10.5082 -10.4560 -10.4560 -10.4556 -10.4556 -10.3937 -10.3937 -10.3564 -10.3564 -3.4230 -3.4230 -3.3756 -3.3756 -2.2530 -2.2530 -2.0707 -2.0707 -2.0494 -2.0494 -1.9347 -1.9347 -1.7436 -1.7436 -1.7125 -1.7125 -1.5415 -1.5415 -0.8259 -0.8259 -0.5838 -0.5838 -0.4163 -0.4163 -0.0612 -0.0612 0.5106 0.5106 0.6931 0.6931 1.6269 1.6269 1.7495 1.7495 1.7540 1.7540 2.1069 2.1069 2.2493 2.2493 2.3830 2.3830 2.3948 2.3948 2.4144 2.4144 2.4712 2.4712 2.5411 2.5411 2.7294 2.7294 3.0367 3.0367 5.4060 5.4060 5.4260 5.4260 9.9220 9.9220 10.2701 10.2701 10.2841 10.2841 10.2998 10.2998 10.4556 10.4556 k = 0.4630 0.2673 0.1890 ( 21584 PWs) bands (ev): -14.5469 -14.5469 -14.5409 -14.5409 -11.1591 -11.1591 -10.5096 -10.5096 -10.4563 -10.4563 -10.4561 -10.4561 -10.3936 -10.3936 -10.3561 -10.3561 -3.4188 -3.4188 -3.3765 -3.3765 -2.2487 -2.2487 -2.0700 -2.0700 -2.0402 -2.0402 -1.9316 -1.9316 -1.7466 -1.7466 -1.7132 -1.7132 -1.5358 -1.5358 -0.8343 -0.8343 -0.5856 -0.5856 -0.4168 -0.4168 -0.0675 -0.0675 0.5140 0.5140 0.6971 0.6971 1.6141 1.6141 1.7463 1.7463 1.7514 1.7514 2.1107 2.1107 2.2478 2.2478 2.3817 2.3817 2.3893 2.3893 2.4087 2.4087 2.4678 2.4678 2.5368 2.5368 2.7296 2.7296 3.0373 3.0373 5.4024 5.4024 5.4228 5.4228 9.9688 9.9688 10.2715 10.2715 10.3223 10.3223 10.3549 10.3549 10.4776 10.4776 k = 0.4815 0.2780 0.1966 ( 21554 PWs) bands (ev): -14.5453 -14.5453 -14.5423 -14.5423 -11.1589 -11.1589 -10.5104 -10.5104 -10.4565 -10.4565 -10.4563 -10.4563 -10.3936 -10.3936 -10.3559 -10.3559 -3.4162 -3.4162 -3.3772 -3.3772 -2.2461 -2.2461 -2.0695 -2.0695 -2.0347 -2.0347 -1.9296 -1.9296 -1.7485 -1.7485 -1.7136 -1.7136 -1.5324 -1.5324 -0.8394 -0.8394 -0.5867 -0.5867 -0.4170 -0.4170 -0.0714 -0.0714 0.5161 0.5161 0.6995 0.6995 1.6064 1.6064 1.7443 1.7443 1.7499 1.7499 2.1130 2.1130 2.2469 2.2469 2.3810 2.3810 2.3860 2.3860 2.4053 2.4053 2.4657 2.4657 2.5341 2.5341 2.7297 2.7297 3.0376 3.0376 5.4002 5.4002 5.4209 5.4209 10.0011 10.0011 10.2601 10.2601 10.3614 10.3614 10.3966 10.3966 10.4917 10.4917 k = 0.5000 0.2887 0.2041 ( 21542 PWs) bands (ev): -14.5442 -14.5442 -14.5434 -14.5434 -11.1588 -11.1588 -10.5106 -10.5106 -10.4566 -10.4566 -10.4564 -10.4564 -10.3936 -10.3936 -10.3558 -10.3558 -3.4152 -3.4152 -3.3774 -3.3774 -2.2452 -2.2452 -2.0693 -2.0693 -2.0328 -2.0328 -1.9289 -1.9289 -1.7492 -1.7492 -1.7138 -1.7138 -1.5312 -1.5312 -0.8411 -0.8411 -0.5870 -0.5870 -0.4171 -0.4171 -0.0727 -0.0727 0.5169 0.5169 0.7003 0.7003 1.6038 1.6038 1.7437 1.7437 1.7493 1.7493 2.1137 2.1137 2.2466 2.2466 2.3807 2.3807 2.3849 2.3849 2.4042 2.4042 2.4650 2.4650 2.5332 2.5332 2.7298 2.7298 3.0377 3.0377 5.3995 5.3995 5.4203 5.4203 10.0129 10.0129 10.2552 10.2552 10.3767 10.3767 10.4132 10.4132 10.4965 10.4965 k = 0.5000 0.2887 0.2041 ( 21542 PWs) bands (ev): -14.5442 -14.5442 -14.5434 -14.5434 -11.1588 -11.1588 -10.5106 -10.5106 -10.4566 -10.4566 -10.4564 -10.4564 -10.3936 -10.3936 -10.3558 -10.3558 -3.4152 -3.4152 -3.3774 -3.3774 -2.2452 -2.2452 -2.0693 -2.0693 -2.0328 -2.0328 -1.9289 -1.9289 -1.7492 -1.7492 -1.7138 -1.7138 -1.5312 -1.5312 -0.8411 -0.8411 -0.5870 -0.5870 -0.4171 -0.4171 -0.0727 -0.0727 0.5169 0.5169 0.7003 0.7003 1.6038 1.6038 1.7437 1.7437 1.7493 1.7493 2.1137 2.1137 2.2466 2.2466 2.3807 2.3807 2.3849 2.3849 2.4042 2.4042 2.4650 2.4650 2.5332 2.5332 2.7298 2.7298 3.0377 3.0377 5.3995 5.3995 5.4203 5.4203 10.0129 10.0129 10.2552 10.2552 10.3767 10.3767 10.4132 10.4132 10.4965 10.4965 k = 0.5066 0.2697 0.2149 ( 21557 PWs) bands (ev): -14.5442 -14.5442 -14.5434 -14.5434 -11.1588 -11.1588 -10.5109 -10.5109 -10.4565 -10.4565 -10.4563 -10.4563 -10.3936 -10.3936 -10.3559 -10.3559 -3.4149 -3.4149 -3.3773 -3.3773 -2.2444 -2.2444 -2.0693 -2.0693 -2.0323 -2.0323 -1.9291 -1.9291 -1.7493 -1.7493 -1.7140 -1.7140 -1.5306 -1.5306 -0.8412 -0.8412 -0.5879 -0.5879 -0.4174 -0.4174 -0.0712 -0.0712 0.5163 0.5163 0.6995 0.6995 1.6045 1.6045 1.7438 1.7438 1.7494 1.7494 2.1124 2.1124 2.2442 2.2442 2.3749 2.3749 2.3870 2.3870 2.4044 2.4044 2.4678 2.4678 2.5334 2.5334 2.7294 2.7294 3.0381 3.0381 5.3988 5.3988 5.4196 5.4196 10.0142 10.0142 10.2588 10.2588 10.3788 10.3788 10.4150 10.4150 10.4997 10.4997 k = 0.5132 0.2507 0.2256 ( 21561 PWs) bands (ev): -14.5441 -14.5441 -14.5433 -14.5433 -11.1587 -11.1587 -10.5116 -10.5116 -10.4565 -10.4565 -10.4557 -10.4557 -10.3936 -10.3936 -10.3562 -10.3562 -3.4141 -3.4141 -3.3770 -3.3770 -2.2419 -2.2419 -2.0693 -2.0693 -2.0308 -2.0308 -1.9295 -1.9295 -1.7495 -1.7495 -1.7149 -1.7149 -1.5288 -1.5288 -0.8415 -0.8415 -0.5904 -0.5904 -0.4183 -0.4183 -0.0666 -0.0666 0.5147 0.5147 0.6972 0.6972 1.6067 1.6067 1.7443 1.7443 1.7498 1.7498 2.1086 2.1086 2.2370 2.2370 2.3639 2.3639 2.3884 2.3884 2.4053 2.4053 2.4750 2.4750 2.5340 2.5340 2.7282 2.7282 3.0392 3.0392 5.3960 5.3960 5.4182 5.4182 10.0181 10.0181 10.2695 10.2695 10.3849 10.3849 10.4205 10.4205 10.5091 10.5091 k = 0.5197 0.2317 0.2364 ( 21549 PWs) bands (ev): -14.5441 -14.5441 -14.5433 -14.5433 -11.1586 -11.1586 -10.5127 -10.5127 -10.4566 -10.4566 -10.4548 -10.4548 -10.3936 -10.3936 -10.3567 -10.3567 -3.4127 -3.4127 -3.3764 -3.3764 -2.2377 -2.2377 -2.0691 -2.0691 -2.0283 -2.0283 -1.9303 -1.9303 -1.7500 -1.7500 -1.7162 -1.7162 -1.5259 -1.5259 -0.8420 -0.8420 -0.5945 -0.5945 -0.4197 -0.4197 -0.0592 -0.0592 0.5120 0.5120 0.6933 0.6933 1.6103 1.6103 1.7450 1.7450 1.7503 1.7503 2.1023 2.1023 2.2249 2.2249 2.3505 2.3505 2.3887 2.3887 2.4068 2.4068 2.4834 2.4834 2.5355 2.5355 2.7263 2.7263 3.0410 3.0410 5.3898 5.3898 5.4175 5.4175 10.0244 10.0244 10.2869 10.2869 10.3947 10.3947 10.4300 10.4300 10.5248 10.5248 k = 0.5263 0.2127 0.2471 ( 21546 PWs) bands (ev): -14.5440 -14.5440 -14.5432 -14.5432 -11.1584 -11.1584 -10.5142 -10.5142 -10.4566 -10.4566 -10.4537 -10.4537 -10.3936 -10.3936 -10.3574 -10.3574 -3.4108 -3.4108 -3.3756 -3.3756 -2.2320 -2.2320 -2.0689 -2.0689 -2.0252 -2.0252 -1.9314 -1.9314 -1.7507 -1.7507 -1.7180 -1.7180 -1.5218 -1.5218 -0.8426 -0.8426 -0.6002 -0.6002 -0.4216 -0.4216 -0.0490 -0.0490 0.5083 0.5083 0.6880 0.6880 1.6153 1.6153 1.7460 1.7460 1.7511 1.7511 2.0939 2.0939 2.2082 2.2082 2.3366 2.3366 2.3878 2.3878 2.4088 2.4088 2.4908 2.4908 2.5385 2.5385 2.7236 2.7236 3.0436 3.0436 5.3797 5.3797 5.4183 5.4183 10.0329 10.0329 10.3106 10.3106 10.4079 10.4079 10.4438 10.4438 10.5468 10.5468 k = 0.5329 0.1937 0.2578 ( 21560 PWs) bands (ev): -14.5439 -14.5439 -14.5432 -14.5432 -11.1582 -11.1582 -10.5159 -10.5159 -10.4567 -10.4567 -10.4523 -10.4523 -10.3937 -10.3937 -10.3583 -10.3583 -3.4085 -3.4085 -3.3747 -3.3747 -2.2247 -2.2247 -2.0684 -2.0684 -2.0214 -2.0214 -1.9327 -1.9327 -1.7518 -1.7518 -1.7199 -1.7199 -1.5167 -1.5167 -0.8433 -0.8433 -0.6075 -0.6075 -0.4240 -0.4240 -0.0363 -0.0363 0.5037 0.5037 0.6813 0.6813 1.6216 1.6216 1.7474 1.7474 1.7522 1.7522 2.0835 2.0835 2.1873 2.1873 2.3230 2.3230 2.3859 2.3859 2.4109 2.4109 2.4962 2.4962 2.5432 2.5432 2.7202 2.7202 3.0468 3.0468 5.3658 5.3658 5.4205 5.4205 10.0435 10.0435 10.3395 10.3395 10.4243 10.4243 10.4623 10.4623 10.5746 10.5746 k = 0.5395 0.1747 0.2686 ( 21552 PWs) bands (ev): -14.5438 -14.5438 -14.5431 -14.5431 -11.1580 -11.1580 -10.5179 -10.5179 -10.4568 -10.4568 -10.4507 -10.4507 -10.3937 -10.3937 -10.3593 -10.3593 -3.4057 -3.4057 -3.3735 -3.3735 -2.2160 -2.2160 -2.0677 -2.0677 -2.0171 -2.0171 -1.9341 -1.9341 -1.7533 -1.7533 -1.7220 -1.7220 -1.5106 -1.5106 -0.8440 -0.8440 -0.6162 -0.6162 -0.4266 -0.4266 -0.0213 -0.0213 0.4981 0.4981 0.6733 0.6733 1.6292 1.6292 1.7491 1.7491 1.7536 1.7536 2.0717 2.0717 2.1627 2.1627 2.3101 2.3101 2.3829 2.3829 2.4126 2.4126 2.4997 2.4997 2.5493 2.5493 2.7162 2.7162 3.0506 3.0506 5.3489 5.3489 5.4237 5.4237 10.0558 10.0558 10.3722 10.3722 10.4447 10.4447 10.4851 10.4851 10.6075 10.6075 k = 0.5461 0.1557 0.2793 ( 21562 PWs) bands (ev): -14.5437 -14.5437 -14.5430 -14.5430 -11.1577 -11.1577 -10.5200 -10.5200 -10.4569 -10.4569 -10.4490 -10.4490 -10.3938 -10.3938 -10.3605 -10.3605 -3.4026 -3.4026 -3.3722 -3.3722 -2.2061 -2.2061 -2.0668 -2.0668 -2.0126 -2.0126 -1.9356 -1.9356 -1.7553 -1.7553 -1.7239 -1.7239 -1.5036 -1.5036 -0.8447 -0.8447 -0.6262 -0.6262 -0.4295 -0.4295 -0.0045 -0.0045 0.4918 0.4918 0.6641 0.6641 1.6379 1.6379 1.7511 1.7511 1.7553 1.7553 2.0586 2.0586 2.1354 2.1354 2.2981 2.2981 2.3789 2.3789 2.4131 2.4131 2.5022 2.5022 2.5559 2.5559 2.7119 2.7119 3.0550 3.0550 5.3295 5.3295 5.4278 5.4278 10.0694 10.0694 10.4062 10.4062 10.4709 10.4709 10.5115 10.5115 10.6441 10.6441 k = 0.5526 0.1367 0.2901 ( 21568 PWs) bands (ev): -14.5436 -14.5436 -14.5428 -14.5428 -11.1574 -11.1574 -10.5222 -10.5222 -10.4570 -10.4570 -10.4473 -10.4473 -10.3939 -10.3939 -10.3619 -10.3619 -3.3992 -3.3992 -3.3707 -3.3707 -2.1950 -2.1950 -2.0656 -2.0656 -2.0079 -2.0079 -1.9371 -1.9371 -1.7578 -1.7578 -1.7257 -1.7257 -1.4959 -1.4959 -0.8454 -0.8454 -0.6375 -0.6375 -0.4325 -0.4325 0.0139 0.0139 0.4848 0.4848 0.6538 0.6538 1.6477 1.6477 1.7536 1.7536 1.7572 1.7572 2.0447 2.0447 2.1061 2.1061 2.2867 2.2867 2.3739 2.3739 2.4119 2.4119 2.5048 2.5048 2.5620 2.5620 2.7074 2.7074 3.0597 3.0597 5.3081 5.3081 5.4327 5.4327 10.0841 10.0841 10.4391 10.4391 10.5041 10.5041 10.5405 10.5405 10.6828 10.6828 k = 0.5592 0.1177 0.3008 ( 21582 PWs) bands (ev): -14.5435 -14.5435 -14.5426 -14.5426 -11.1571 -11.1571 -10.5244 -10.5244 -10.4571 -10.4571 -10.4456 -10.4456 -10.3939 -10.3939 -10.3633 -10.3633 -3.3956 -3.3956 -3.3692 -3.3692 -2.1830 -2.1830 -2.0643 -2.0643 -2.0032 -2.0032 -1.9385 -1.9385 -1.7607 -1.7607 -1.7271 -1.7271 -1.4876 -1.4876 -0.8459 -0.8459 -0.6498 -0.6498 -0.4356 -0.4356 0.0333 0.0333 0.4774 0.4774 0.6427 0.6427 1.6583 1.6583 1.7563 1.7563 1.7595 1.7595 2.0302 2.0302 2.0758 2.0758 2.2761 2.2761 2.3680 2.3680 2.4087 2.4087 2.5080 2.5080 2.5672 2.5672 2.7031 2.7031 3.0648 3.0648 5.2850 5.2850 5.4382 5.4382 10.0995 10.0995 10.4699 10.4699 10.5434 10.5434 10.5713 10.5713 10.7220 10.7220 k = 0.5658 0.0988 0.3116 ( 21577 PWs) bands (ev): -14.5435 -14.5435 -14.5424 -14.5424 -11.1568 -11.1568 -10.5265 -10.5265 -10.4573 -10.4573 -10.4440 -10.4440 -10.3940 -10.3940 -10.3648 -10.3648 -3.3918 -3.3918 -3.3675 -3.3675 -2.1703 -2.1703 -2.0628 -2.0628 -1.9988 -1.9988 -1.9395 -1.9395 -1.7640 -1.7640 -1.7283 -1.7283 -1.4789 -1.4789 -0.8462 -0.8462 -0.6631 -0.6631 -0.4386 -0.4386 0.0534 0.0534 0.4697 0.4697 0.6309 0.6309 1.6696 1.6696 1.7591 1.7591 1.7622 1.7622 2.0152 2.0152 2.0455 2.0455 2.2660 2.2660 2.3612 2.3612 2.4035 2.4035 2.5121 2.5121 2.5710 2.5710 2.6993 2.6993 3.0701 3.0701 5.2608 5.2608 5.4444 5.4444 10.1152 10.1152 10.5000 10.5000 10.5845 10.5845 10.6032 10.6032 10.7614 10.7614 k = 0.5724 0.0798 0.3223 ( 21565 PWs) bands (ev): -14.5435 -14.5435 -14.5421 -14.5421 -11.1564 -11.1564 -10.5285 -10.5285 -10.4574 -10.4574 -10.4424 -10.4424 -10.3940 -10.3940 -10.3664 -10.3664 -3.3881 -3.3881 -3.3658 -3.3658 -2.1571 -2.1571 -2.0613 -2.0613 -1.9947 -1.9947 -1.9401 -1.9401 -1.7675 -1.7675 -1.7292 -1.7292 -1.4699 -1.4699 -0.8464 -0.8464 -0.6770 -0.6770 -0.4414 -0.4414 0.0737 0.0737 0.4619 0.4619 0.6186 0.6186 1.6811 1.6811 1.7616 1.7616 1.7656 1.7656 1.9992 1.9992 2.0171 2.0171 2.2565 2.2565 2.3534 2.3534 2.3966 2.3966 2.5166 2.5166 2.5734 2.5734 2.6963 2.6963 3.0754 3.0754 5.2359 5.2359 5.4511 5.4511 10.1309 10.1309 10.5302 10.5302 10.6216 10.6216 10.6366 10.6366 10.8029 10.8029 k = 0.5789 0.0608 0.3330 ( 21578 PWs) bands (ev): -14.5435 -14.5435 -14.5417 -14.5417 -11.1561 -11.1561 -10.5304 -10.5304 -10.4576 -10.4576 -10.4409 -10.4409 -10.3941 -10.3941 -10.3680 -10.3680 -3.3844 -3.3844 -3.3641 -3.3641 -2.1439 -2.1439 -2.0598 -2.0598 -1.9913 -1.9913 -1.9400 -1.9400 -1.7711 -1.7711 -1.7298 -1.7298 -1.4609 -1.4609 -0.8464 -0.8464 -0.6912 -0.6912 -0.4440 -0.4440 0.0935 0.0935 0.4545 0.4545 0.6060 0.6060 1.6927 1.6927 1.7637 1.7637 1.7697 1.7697 1.9784 1.9784 1.9954 1.9954 2.2475 2.2475 2.3449 2.3449 2.3884 2.3884 2.5212 2.5212 2.5746 2.5746 2.6944 2.6944 3.0808 3.0808 5.2107 5.2107 5.4584 5.4584 10.1461 10.1461 10.5607 10.5607 10.6515 10.6515 10.6701 10.6701 10.8485 10.8485 k = 0.5855 0.0418 0.3438 ( 21573 PWs) bands (ev): -14.5436 -14.5436 -14.5414 -14.5414 -11.1558 -11.1558 -10.5320 -10.5320 -10.4577 -10.4577 -10.4395 -10.4395 -10.3941 -10.3941 -10.3696 -10.3696 -3.3809 -3.3809 -3.3624 -3.3624 -2.1309 -2.1309 -2.0582 -2.0582 -1.9886 -1.9886 -1.9392 -1.9392 -1.7746 -1.7746 -1.7303 -1.7303 -1.4520 -1.4520 -0.8462 -0.8462 -0.7054 -0.7054 -0.4464 -0.4464 0.1123 0.1123 0.4477 0.4477 0.5934 0.5934 1.7034 1.7034 1.7652 1.7652 1.7744 1.7744 1.9541 1.9541 1.9810 1.9810 2.2391 2.2391 2.3358 2.3358 2.3792 2.3792 2.5249 2.5249 2.5753 2.5753 2.6936 2.6936 3.0860 3.0860 5.1857 5.1857 5.4661 5.4661 10.1607 10.1607 10.5909 10.5909 10.6758 10.6758 10.6998 10.6998 10.8987 10.8987 k = 0.5921 0.0228 0.3545 ( 21586 PWs) bands (ev): -14.5438 -14.5438 -14.5410 -14.5410 -11.1556 -11.1556 -10.5335 -10.5335 -10.4579 -10.4579 -10.4382 -10.4382 -10.3941 -10.3941 -10.3712 -10.3712 -3.3777 -3.3777 -3.3607 -3.3607 -2.1188 -2.1188 -2.0565 -2.0565 -1.9866 -1.9866 -1.9376 -1.9376 -1.7778 -1.7778 -1.7305 -1.7305 -1.4436 -1.4436 -0.8460 -0.8460 -0.7192 -0.7192 -0.4483 -0.4483 0.1295 0.1295 0.4419 0.4419 0.5810 0.5810 1.7125 1.7125 1.7662 1.7662 1.7795 1.7795 1.9320 1.9320 1.9697 1.9697 2.2313 2.2313 2.3260 2.3260 2.3694 2.3694 2.5269 2.5269 2.5765 2.5765 2.6938 2.6938 3.0911 3.0911 5.1613 5.1613 5.4742 5.4742 10.1740 10.1740 10.6194 10.6194 10.6946 10.6946 10.7253 10.7253 10.9521 10.9521 k = 0.5987 0.0038 0.3653 ( 21573 PWs) bands (ev): -14.5440 -14.5440 -14.5406 -14.5406 -11.1553 -11.1553 -10.5347 -10.5347 -10.4581 -10.4581 -10.4371 -10.4371 -10.3941 -10.3941 -10.3728 -10.3728 -3.3748 -3.3748 -3.3591 -3.3591 -2.1081 -2.1081 -2.0546 -2.0546 -1.9853 -1.9853 -1.9354 -1.9354 -1.7807 -1.7807 -1.7306 -1.7306 -1.4357 -1.4357 -0.8459 -0.8459 -0.7321 -0.7321 -0.4499 -0.4499 0.1444 0.1444 0.4373 0.4373 0.5693 0.5693 1.7184 1.7184 1.7663 1.7663 1.7851 1.7851 1.9149 1.9149 1.9605 1.9605 2.2242 2.2242 2.3160 2.3160 2.3593 2.3593 2.5264 2.5264 2.5790 2.5790 2.6949 2.6949 3.0959 3.0959 5.1377 5.1377 5.4827 5.4827 10.1858 10.1858 10.6440 10.6440 10.7073 10.7073 10.7491 10.7491 11.0065 11.0065 k = 0.6053-0.0152 0.3760 ( 21570 PWs) bands (ev): -14.5442 -14.5442 -14.5401 -14.5401 -11.1552 -11.1552 -10.5355 -10.5355 -10.4583 -10.4583 -10.4361 -10.4361 -10.3941 -10.3941 -10.3743 -10.3743 -3.3724 -3.3724 -3.3576 -3.3576 -2.0993 -2.0993 -2.0525 -2.0525 -1.9846 -1.9846 -1.9327 -1.9327 -1.7831 -1.7831 -1.7304 -1.7304 -1.4287 -1.4287 -0.8460 -0.8460 -0.7434 -0.7434 -0.4510 -0.4510 0.1567 0.1567 0.4340 0.4340 0.5587 0.5587 1.7198 1.7198 1.7657 1.7657 1.7915 1.7915 1.9047 1.9047 1.9534 1.9534 2.2177 2.2177 2.3058 2.3058 2.3492 2.3492 2.5233 2.5233 2.5833 2.5833 2.6967 2.6967 3.1003 3.1003 5.1155 5.1155 5.4915 5.4915 10.1955 10.1955 10.6621 10.6621 10.7133 10.7133 10.7743 10.7743 11.0591 11.0591 k = 0.6118-0.0342 0.3868 ( 21593 PWs) bands (ev): -14.5445 -14.5445 -14.5397 -14.5397 -11.1550 -11.1550 -10.5361 -10.5361 -10.4586 -10.4586 -10.4352 -10.4352 -10.3941 -10.3941 -10.3757 -10.3757 -3.3705 -3.3705 -3.3562 -3.3562 -2.0928 -2.0928 -2.0503 -2.0503 -1.9841 -1.9841 -1.9299 -1.9299 -1.7851 -1.7851 -1.7298 -1.7298 -1.4227 -1.4227 -0.8467 -0.8467 -0.7526 -0.7526 -0.4516 -0.4516 0.1661 0.1661 0.4318 0.4318 0.5496 0.5496 1.7159 1.7159 1.7643 1.7643 1.7990 1.7990 1.9019 1.9019 1.9483 1.9483 2.2120 2.2120 2.2959 2.2959 2.3393 2.3393 2.5183 2.5183 2.5889 2.5889 2.6990 2.6990 3.1044 3.1044 5.0949 5.0949 5.5005 5.5005 10.2026 10.2026 10.6717 10.6717 10.7125 10.7125 10.8028 10.8028 11.1077 11.1077 k = 0.6184-0.0532 0.3975 ( 21575 PWs) bands (ev): -14.5448 -14.5448 -14.5392 -14.5392 -11.1550 -11.1550 -10.5363 -10.5363 -10.4589 -10.4589 -10.4343 -10.4343 -10.3941 -10.3941 -10.3770 -10.3770 -3.3692 -3.3692 -3.3550 -3.3550 -2.0888 -2.0888 -2.0483 -2.0483 -1.9838 -1.9838 -1.9271 -1.9271 -1.7865 -1.7865 -1.7289 -1.7289 -1.4180 -1.4180 -0.8481 -0.8481 -0.7591 -0.7591 -0.4517 -0.4517 0.1725 0.1725 0.4302 0.4302 0.5426 0.5426 1.7077 1.7077 1.7622 1.7622 1.8076 1.8076 1.9060 1.9060 1.9450 1.9450 2.2071 2.2071 2.2863 2.2863 2.3300 2.3300 2.5121 2.5121 2.5955 2.5955 2.7016 2.7016 3.1081 3.1081 5.0762 5.0762 5.5097 5.5097 10.2066 10.2066 10.6720 10.6720 10.7058 10.7058 10.8344 10.8344 11.1499 11.1499 k = 0.6250-0.0722 0.4082 ( 21570 PWs) bands (ev): -14.5452 -14.5452 -14.5387 -14.5387 -11.1550 -11.1550 -10.5362 -10.5362 -10.4592 -10.4592 -10.4335 -10.4335 -10.3942 -10.3942 -10.3781 -10.3781 -3.3685 -3.3685 -3.3539 -3.3539 -2.0868 -2.0868 -2.0473 -2.0473 -1.9836 -1.9836 -1.9247 -1.9247 -1.7874 -1.7874 -1.7275 -1.7275 -1.4147 -1.4147 -0.8500 -0.8500 -0.7627 -0.7627 -0.4514 -0.4514 0.1762 0.1762 0.4285 0.4285 0.5382 0.5382 1.6972 1.6972 1.7596 1.7596 1.8168 1.8168 1.9153 1.9153 1.9435 1.9435 2.2029 2.2029 2.2776 2.2776 2.3214 2.3214 2.5053 2.5053 2.6025 2.6025 2.7043 2.7043 3.1113 3.1113 5.0597 5.0597 5.5190 5.5190 10.2069 10.2069 10.6628 10.6628 10.6942 10.6942 10.8682 10.8682 11.1810 11.1810 k = 0.6250-0.0722 0.4082 ( 21570 PWs) bands (ev): -14.5452 -14.5452 -14.5387 -14.5387 -11.1550 -11.1550 -10.5362 -10.5362 -10.4592 -10.4592 -10.4335 -10.4335 -10.3942 -10.3942 -10.3781 -10.3781 -3.3685 -3.3685 -3.3539 -3.3539 -2.0868 -2.0868 -2.0473 -2.0473 -1.9836 -1.9836 -1.9247 -1.9247 -1.7874 -1.7874 -1.7275 -1.7275 -1.4147 -1.4147 -0.8500 -0.8500 -0.7627 -0.7627 -0.4514 -0.4514 0.1762 0.1762 0.4285 0.4285 0.5382 0.5382 1.6972 1.6972 1.7596 1.7596 1.8168 1.8168 1.9153 1.9153 1.9435 1.9435 2.2029 2.2029 2.2776 2.2776 2.3214 2.3214 2.5053 2.5053 2.6025 2.6025 2.7043 2.7043 3.1113 3.1113 5.0597 5.0597 5.5190 5.5190 10.2069 10.2069 10.6628 10.6628 10.6942 10.6942 10.8682 10.8682 11.1810 11.1810 k = 0.6136-0.0656 0.4268 ( 21576 PWs) bands (ev): -14.5452 -14.5452 -14.5387 -14.5387 -11.1549 -11.1549 -10.5363 -10.5363 -10.4591 -10.4591 -10.4336 -10.4336 -10.3942 -10.3942 -10.3781 -10.3781 -3.3685 -3.3685 -3.3538 -3.3538 -2.0865 -2.0865 -2.0470 -2.0470 -1.9833 -1.9833 -1.9249 -1.9249 -1.7881 -1.7881 -1.7273 -1.7273 -1.4145 -1.4145 -0.8498 -0.8498 -0.7631 -0.7631 -0.4516 -0.4516 0.1769 0.1769 0.4285 0.4285 0.5376 0.5376 1.6979 1.6979 1.7604 1.7604 1.8169 1.8169 1.9146 1.9146 1.9425 1.9425 2.2013 2.2013 2.2749 2.2749 2.3248 2.3248 2.5063 2.5063 2.6023 2.6023 2.7038 2.7038 3.1112 3.1112 5.0603 5.0603 5.5182 5.5182 10.2081 10.2081 10.6633 10.6633 10.6997 10.6997 10.8688 10.8688 11.1816 11.1816 k = 0.6023-0.0590 0.4454 ( 21580 PWs) bands (ev): -14.5451 -14.5451 -14.5388 -14.5388 -11.1549 -11.1549 -10.5367 -10.5367 -10.4586 -10.4586 -10.4339 -10.4339 -10.3943 -10.3943 -10.3780 -10.3780 -3.3683 -3.3683 -3.3536 -3.3536 -2.0855 -2.0855 -2.0463 -2.0463 -1.9826 -1.9826 -1.9255 -1.9255 -1.7899 -1.7899 -1.7265 -1.7265 -1.4139 -1.4139 -0.8491 -0.8491 -0.7645 -0.7645 -0.4521 -0.4521 0.1789 0.1789 0.4286 0.4286 0.5358 0.5358 1.6997 1.6997 1.7625 1.7625 1.8171 1.8171 1.9125 1.9125 1.9397 1.9397 2.1970 2.1970 2.2683 2.2683 2.3332 2.3332 2.5090 2.5090 2.6016 2.6016 2.7021 2.7021 3.1110 3.1110 5.0620 5.0620 5.5157 5.5157 10.2115 10.2115 10.6655 10.6655 10.7152 10.7152 10.8706 10.8706 11.1833 11.1833 k = 0.5909-0.0525 0.4639 ( 21590 PWs) bands (ev): -14.5450 -14.5450 -14.5389 -14.5389 -11.1548 -11.1548 -10.5373 -10.5373 -10.4579 -10.4579 -10.4344 -10.4344 -10.3944 -10.3944 -10.3778 -10.3778 -3.3680 -3.3680 -3.3533 -3.3533 -2.0841 -2.0841 -2.0450 -2.0450 -1.9815 -1.9815 -1.9266 -1.9266 -1.7928 -1.7928 -1.7253 -1.7253 -1.4129 -1.4129 -0.8479 -0.8479 -0.7669 -0.7669 -0.4529 -0.4529 0.1823 0.1823 0.4288 0.4288 0.5327 0.5327 1.7028 1.7028 1.7660 1.7660 1.8175 1.8175 1.9090 1.9090 1.9350 1.9350 2.1904 2.1904 2.2604 2.2604 2.3441 2.3441 2.5127 2.5127 2.6009 2.6009 2.6993 2.6993 3.1107 3.1107 5.0647 5.0647 5.5119 5.5119 10.2169 10.2169 10.6705 10.6705 10.7395 10.7395 10.8729 10.8729 11.1860 11.1860 k = 0.5795-0.0459 0.4825 ( 21577 PWs) bands (ev): -14.5448 -14.5448 -14.5391 -14.5391 -11.1547 -11.1547 -10.5380 -10.5380 -10.4569 -10.4569 -10.4350 -10.4350 -10.3945 -10.3945 -10.3777 -10.3777 -3.3677 -3.3677 -3.3529 -3.3529 -2.0823 -2.0823 -2.0432 -2.0432 -1.9799 -1.9799 -1.9280 -1.9280 -1.7963 -1.7963 -1.7240 -1.7240 -1.4117 -1.4117 -0.8463 -0.8463 -0.7700 -0.7700 -0.4539 -0.4539 0.1866 0.1866 0.4294 0.4294 0.5286 0.5286 1.7071 1.7071 1.7707 1.7707 1.8178 1.8178 1.9040 1.9040 1.9288 1.9288 2.1823 2.1823 2.2524 2.2524 2.3562 2.3562 2.5164 2.5164 2.6007 2.6007 2.6954 2.6954 3.1104 3.1104 5.0683 5.0683 5.5068 5.5068 10.2240 10.2240 10.6786 10.6786 10.7721 10.7721 10.8752 10.8752 11.1897 11.1897 k = 0.5682-0.0394 0.5010 ( 21581 PWs) bands (ev): -14.5445 -14.5445 -14.5393 -14.5393 -11.1546 -11.1546 -10.5388 -10.5388 -10.4557 -10.4557 -10.4358 -10.4358 -10.3946 -10.3946 -10.3775 -10.3775 -3.3673 -3.3673 -3.3524 -3.3524 -2.0802 -2.0802 -2.0410 -2.0410 -1.9780 -1.9780 -1.9297 -1.9297 -1.8003 -1.8003 -1.7227 -1.7227 -1.4102 -1.4102 -0.8441 -0.8441 -0.7740 -0.7740 -0.4551 -0.4551 0.1915 0.1915 0.4304 0.4304 0.5234 0.5234 1.7127 1.7127 1.7764 1.7764 1.8181 1.8181 1.8974 1.8974 1.9215 1.9215 2.1738 2.1738 2.2449 2.2449 2.3688 2.3688 2.5189 2.5189 2.6016 2.6016 2.6905 2.6905 3.1099 3.1099 5.0724 5.0724 5.5008 5.5008 10.2323 10.2323 10.6897 10.6897 10.8126 10.8126 10.8766 10.8766 11.1939 11.1939 k = 0.5568-0.0328 0.5196 ( 21588 PWs) bands (ev): -14.5442 -14.5442 -14.5396 -14.5396 -11.1545 -11.1545 -10.5397 -10.5397 -10.4545 -10.4545 -10.4367 -10.4367 -10.3948 -10.3948 -10.3773 -10.3773 -3.3668 -3.3668 -3.3520 -3.3520 -2.0781 -2.0781 -2.0384 -2.0384 -1.9757 -1.9757 -1.9318 -1.9318 -1.8043 -1.8043 -1.7215 -1.7215 -1.4086 -1.4086 -0.8414 -0.8414 -0.7788 -0.7788 -0.4564 -0.4564 0.1968 0.1968 0.4321 0.4321 0.5173 0.5173 1.7195 1.7195 1.7831 1.7831 1.8179 1.8179 1.8892 1.8892 1.9134 1.9134 2.1655 2.1655 2.2382 2.2382 2.3815 2.3815 2.5192 2.5192 2.6044 2.6044 2.6848 2.6848 3.1095 3.1095 5.0769 5.0769 5.4945 5.4945 10.2412 10.2412 10.7035 10.7035 10.8603 10.8603 10.8764 10.8764 11.1977 11.1977 k = 0.5455-0.0262 0.5381 ( 21586 PWs) bands (ev): -14.5438 -14.5438 -14.5399 -14.5399 -11.1544 -11.1544 -10.5406 -10.5406 -10.4532 -10.4532 -10.4376 -10.4376 -10.3949 -10.3949 -10.3771 -10.3771 -3.3663 -3.3663 -3.3515 -3.3515 -2.0762 -2.0762 -2.0355 -2.0355 -1.9733 -1.9733 -1.9341 -1.9341 -1.8082 -1.8082 -1.7205 -1.7205 -1.4070 -1.4070 -0.8383 -0.8383 -0.7841 -0.7841 -0.4576 -0.4576 0.2019 0.2019 0.4347 0.4347 0.5105 0.5105 1.7272 1.7272 1.7905 1.7905 1.8169 1.8169 1.8798 1.8798 1.9052 1.9052 2.1582 2.1582 2.2325 2.2325 2.3939 2.3939 2.5171 2.5171 2.6091 2.6091 2.6783 2.6783 3.1091 3.1091 5.0812 5.0812 5.4882 5.4882 10.2500 10.2500 10.7201 10.7201 10.8718 10.8718 10.9161 10.9161 11.1999 11.1999 k = 0.5341-0.0197 0.5567 ( 21589 PWs) bands (ev): -14.5433 -14.5433 -14.5403 -14.5403 -11.1543 -11.1543 -10.5413 -10.5413 -10.4520 -10.4520 -10.4385 -10.4385 -10.3950 -10.3950 -10.3769 -10.3769 -3.3658 -3.3658 -3.3511 -3.3511 -2.0745 -2.0745 -2.0327 -2.0327 -1.9708 -1.9708 -1.9365 -1.9365 -1.8116 -1.8116 -1.7197 -1.7197 -1.4055 -1.4055 -0.8346 -0.8346 -0.7897 -0.7897 -0.4587 -0.4587 0.2064 0.2064 0.4381 0.4381 0.5033 0.5033 1.7358 1.7358 1.7982 1.7982 1.8147 1.8147 1.8696 1.8696 1.8977 1.8977 2.1523 2.1523 2.2280 2.2280 2.4053 2.4053 2.5130 2.5130 2.6153 2.6153 2.6712 2.6712 3.1088 3.1088 5.0851 5.0851 5.4825 5.4825 10.2581 10.2581 10.7392 10.7392 10.8642 10.8642 10.9771 10.9771 11.1978 11.1978 k = 0.5227-0.0131 0.5753 ( 21583 PWs) bands (ev): -14.5429 -14.5429 -14.5407 -14.5407 -11.1542 -11.1542 -10.5419 -10.5419 -10.4510 -10.4510 -10.4393 -10.4393 -10.3951 -10.3951 -10.3768 -10.3768 -3.3654 -3.3654 -3.3508 -3.3508 -2.0732 -2.0732 -2.0302 -2.0302 -1.9685 -1.9685 -1.9387 -1.9387 -1.8142 -1.8142 -1.7192 -1.7192 -1.4042 -1.4042 -0.8309 -0.8309 -0.7952 -0.7952 -0.4595 -0.4595 0.2100 0.2100 0.4422 0.4422 0.4963 0.4963 1.7445 1.7445 1.8054 1.8054 1.8114 1.8114 1.8597 1.8597 1.8916 1.8916 2.1481 2.1481 2.2247 2.2247 2.4152 2.4152 2.5081 2.5081 2.6223 2.6223 2.6640 2.6640 3.1085 3.1085 5.0882 5.0882 5.4779 5.4779 10.2648 10.2648 10.7606 10.7606 10.8516 10.8516 11.0429 11.0429 11.1908 11.1908 k = 0.5114-0.0066 0.5938 ( 21588 PWs) bands (ev): -14.5423 -14.5423 -14.5412 -14.5412 -11.1541 -11.1541 -10.5423 -10.5423 -10.4503 -10.4503 -10.4399 -10.4399 -10.3951 -10.3951 -10.3767 -10.3767 -3.3651 -3.3651 -3.3506 -3.3506 -2.0724 -2.0724 -2.0284 -2.0284 -1.9668 -1.9668 -1.9404 -1.9404 -1.8159 -1.8159 -1.7190 -1.7190 -1.4034 -1.4034 -0.8275 -0.8275 -0.7997 -0.7997 -0.4601 -0.4601 0.2122 0.2122 0.4461 0.4461 0.4906 0.4906 1.7519 1.7519 1.8052 1.8052 1.8139 1.8139 1.8513 1.8513 1.8878 1.8878 2.1456 2.1456 2.2227 2.2227 2.4221 2.4221 2.5038 2.5038 2.6286 2.6286 2.6577 2.6577 3.1084 3.1084 5.0901 5.0901 5.4749 5.4749 10.2692 10.2692 10.7840 10.7840 10.8337 10.8337 11.1105 11.1105 11.1822 11.1822 k = 0.5000-0.0000 0.6124 ( 21628 PWs) bands (ev): -14.5418 -14.5418 -14.5418 -14.5418 -11.1541 -11.1541 -10.5424 -10.5424 -10.4501 -10.4501 -10.4401 -10.4401 -10.3951 -10.3951 -10.3767 -10.3767 -3.3650 -3.3650 -3.3505 -3.3505 -2.0722 -2.0722 -2.0278 -2.0278 -1.9661 -1.9661 -1.9410 -1.9410 -1.8164 -1.8164 -1.7189 -1.7189 -1.4031 -1.4031 -0.8261 -0.8261 -0.8016 -0.8016 -0.4603 -0.4603 0.2129 0.2129 0.4480 0.4480 0.4881 0.4881 1.7552 1.7552 1.8029 1.8029 1.8169 1.8169 1.8475 1.8475 1.8866 1.8866 2.1448 2.1448 2.2220 2.2220 2.4247 2.4247 2.5021 2.5021 2.6316 2.6316 2.6548 2.6548 3.1083 3.1083 5.0908 5.0908 5.4738 5.4738 10.2708 10.2708 10.8055 10.8055 10.8140 10.8140 11.1525 11.1525 11.1874 11.1874 k = 0.5000-0.0000 0.6124 ( 21628 PWs) bands (ev): -14.5418 -14.5418 -14.5418 -14.5418 -11.1541 -11.1541 -10.5424 -10.5424 -10.4501 -10.4501 -10.4401 -10.4401 -10.3951 -10.3951 -10.3767 -10.3767 -3.3650 -3.3650 -3.3505 -3.3505 -2.0722 -2.0722 -2.0278 -2.0278 -1.9661 -1.9661 -1.9410 -1.9410 -1.8164 -1.8164 -1.7189 -1.7189 -1.4031 -1.4031 -0.8261 -0.8261 -0.8016 -0.8016 -0.4603 -0.4603 0.2129 0.2129 0.4480 0.4480 0.4881 0.4881 1.7552 1.7552 1.8029 1.8029 1.8169 1.8169 1.8475 1.8475 1.8866 1.8866 2.1448 2.1448 2.2220 2.2220 2.4247 2.4247 2.5021 2.5021 2.6316 2.6316 2.6548 2.6548 3.1083 3.1083 5.0908 5.0908 5.4738 5.4738 10.2708 10.2708 10.8055 10.8055 10.8140 10.8140 11.1525 11.1525 11.1874 11.1874 k = 0.5000 0.0131 0.5938 ( 21590 PWs) bands (ev): -14.5418 -14.5418 -14.5418 -14.5418 -11.1541 -11.1541 -10.5423 -10.5423 -10.4502 -10.4502 -10.4400 -10.4400 -10.3951 -10.3951 -10.3766 -10.3766 -3.3652 -3.3652 -3.3507 -3.3507 -2.0726 -2.0726 -2.0286 -2.0286 -1.9667 -1.9667 -1.9408 -1.9408 -1.8158 -1.8158 -1.7190 -1.7190 -1.4038 -1.4038 -0.8274 -0.8274 -0.7991 -0.7991 -0.4602 -0.4602 0.2118 0.2118 0.4457 0.4457 0.4917 0.4917 1.7552 1.7552 1.8021 1.8021 1.8165 1.8165 1.8475 1.8475 1.8883 1.8883 2.1462 2.1462 2.2235 2.2235 2.4249 2.4249 2.5020 2.5020 2.6309 2.6309 2.6554 2.6554 3.1080 3.1080 5.0923 5.0923 5.4735 5.4735 10.2693 10.2693 10.8028 10.8028 10.8119 10.8119 11.1282 11.1282 11.1844 11.1844 k = 0.5000 0.0262 0.5753 ( 21574 PWs) bands (ev): -14.5419 -14.5419 -14.5418 -14.5418 -11.1542 -11.1542 -10.5419 -10.5419 -10.4506 -10.4506 -10.4399 -10.4399 -10.3951 -10.3951 -10.3763 -10.3763 -3.3658 -3.3658 -3.3513 -3.3513 -2.0738 -2.0738 -2.0311 -2.0311 -1.9685 -1.9685 -1.9403 -1.9403 -1.8139 -1.8139 -1.7195 -1.7195 -1.4059 -1.4059 -0.8305 -0.8305 -0.7927 -0.7927 -0.4597 -0.4597 0.2084 0.2084 0.4408 0.4408 0.5004 0.5004 1.7550 1.7550 1.7997 1.7997 1.8153 1.8153 1.8481 1.8481 1.8932 1.8932 2.1500 2.1500 2.2279 2.2279 2.4254 2.4254 2.5019 2.5019 2.6289 2.6289 2.6570 2.6570 3.1070 3.1070 5.0968 5.0968 5.4726 5.4726 10.2647 10.2647 10.7935 10.7935 10.8070 10.8070 11.0880 11.0880 11.1630 11.1630 k = 0.5000 0.0394 0.5567 ( 21584 PWs) bands (ev): -14.5419 -14.5419 -14.5418 -14.5418 -11.1543 -11.1543 -10.5413 -10.5413 -10.4511 -10.4511 -10.4398 -10.4398 -10.3950 -10.3950 -10.3758 -10.3758 -3.3667 -3.3667 -3.3522 -3.3522 -2.0762 -2.0762 -2.0350 -2.0350 -1.9709 -1.9709 -1.9398 -1.9398 -1.8110 -1.8110 -1.7202 -1.7202 -1.4093 -1.4093 -0.8339 -0.8339 -0.7838 -0.7838 -0.4589 -0.4589 0.2025 0.2025 0.4360 0.4360 0.5117 0.5117 1.7537 1.7537 1.7957 1.7957 1.8133 1.8133 1.8509 1.8509 1.9006 1.9006 2.1562 2.1562 2.2350 2.2350 2.4262 2.4262 2.5017 2.5017 2.6259 2.6259 2.6593 2.6593 3.1055 3.1055 5.1042 5.1042 5.4712 5.4712 10.2572 10.2572 10.7772 10.7772 10.8001 10.8001 11.0448 11.0448 11.1303 11.1303 k = 0.5000 0.0525 0.5381 ( 21582 PWs) bands (ev): -14.5420 -14.5420 -14.5419 -14.5419 -11.1544 -11.1544 -10.5405 -10.5405 -10.4518 -10.4518 -10.4397 -10.4397 -10.3949 -10.3949 -10.3751 -10.3751 -3.3681 -3.3681 -3.3535 -3.3535 -2.0802 -2.0802 -2.0396 -2.0396 -1.9734 -1.9734 -1.9397 -1.9397 -1.8071 -1.8071 -1.7211 -1.7211 -1.4140 -1.4140 -0.8369 -0.8369 -0.7732 -0.7732 -0.4578 -0.4578 0.1940 0.1940 0.4326 0.4326 0.5242 0.5242 1.7507 1.7507 1.7907 1.7907 1.8098 1.8098 1.8578 1.8578 1.9101 1.9101 2.1643 2.1643 2.2444 2.2444 2.4271 2.4271 2.5015 2.5015 2.6223 2.6223 2.6621 2.6621 3.1033 3.1033 5.1144 5.1144 5.4691 5.4691 10.2471 10.2471 10.7551 10.7551 10.7907 10.7907 10.9998 10.9998 11.0913 11.0913 k = 0.5000 0.0656 0.5196 ( 21576 PWs) bands (ev): -14.5421 -14.5421 -14.5420 -14.5420 -11.1546 -11.1546 -10.5394 -10.5394 -10.4525 -10.4525 -10.4397 -10.4397 -10.3948 -10.3948 -10.3742 -10.3742 -3.3699 -3.3699 -3.3549 -3.3549 -2.0862 -2.0862 -2.0442 -2.0442 -1.9759 -1.9759 -1.9399 -1.9399 -1.8026 -1.8026 -1.7222 -1.7222 -1.4199 -1.4199 -0.8396 -0.8396 -0.7613 -0.7613 -0.4563 -0.4563 0.1828 0.1828 0.4314 0.4314 0.5374 0.5374 1.7454 1.7454 1.7853 1.7853 1.8048 1.8048 1.8695 1.8695 1.9211 1.9211 2.1740 2.1740 2.2557 2.2557 2.4281 2.4281 2.5013 2.5013 2.6182 2.6182 2.6652 2.6652 3.1006 3.1006 5.1273 5.1273 5.4666 5.4666 10.2348 10.2348 10.7288 10.7288 10.7782 10.7782 10.9532 10.9532 11.0486 11.0486 k = 0.5000 0.0787 0.5010 ( 21584 PWs) bands (ev): -14.5422 -14.5422 -14.5421 -14.5421 -11.1549 -11.1549 -10.5381 -10.5381 -10.4532 -10.4532 -10.4399 -10.4399 -10.3947 -10.3947 -10.3732 -10.3732 -3.3721 -3.3721 -3.3566 -3.3566 -2.0945 -2.0945 -2.0482 -2.0482 -1.9784 -1.9784 -1.9403 -1.9403 -1.7975 -1.7975 -1.7232 -1.7232 -1.4267 -1.4267 -0.8418 -0.8418 -0.7483 -0.7483 -0.4546 -0.4546 0.1691 0.1691 0.4324 0.4324 0.5510 0.5510 1.7379 1.7379 1.7801 1.7801 1.7988 1.7988 1.8857 1.8857 1.9334 1.9334 2.1847 2.1847 2.2685 2.2685 2.4289 2.4289 2.5012 2.5012 2.6137 2.6137 2.6687 2.6687 3.0973 3.0973 5.1425 5.1425 5.4636 5.4636 10.2206 10.2206 10.6995 10.6995 10.7621 10.7621 10.9050 10.9050 11.0042 11.0042 k = 0.5000 0.0919 0.4825 ( 21590 PWs) bands (ev): -14.5423 -14.5423 -14.5421 -14.5421 -11.1551 -11.1551 -10.5366 -10.5366 -10.4539 -10.4539 -10.4402 -10.4402 -10.3945 -10.3945 -10.3720 -10.3720 -3.3747 -3.3747 -3.3584 -3.3584 -2.1049 -2.1049 -2.0516 -2.0516 -1.9809 -1.9809 -1.9409 -1.9409 -1.7922 -1.7922 -1.7243 -1.7243 -1.4344 -1.4344 -0.8435 -0.8435 -0.7346 -0.7346 -0.4526 -0.4526 0.1531 0.1531 0.4355 0.4355 0.5647 0.5647 1.7284 1.7284 1.7753 1.7753 1.7925 1.7925 1.9056 1.9056 1.9468 1.9468 2.1963 2.1963 2.2823 2.2823 2.4294 2.4294 2.5012 2.5012 2.6088 2.6088 2.6724 2.6724 3.0935 3.0935 5.1599 5.1599 5.4601 5.4601 10.2049 10.2049 10.6682 10.6682 10.7422 10.7422 10.8552 10.8552 10.9595 10.9595 k = 0.5000 0.1050 0.4639 ( 21592 PWs) bands (ev): -14.5425 -14.5425 -14.5422 -14.5422 -11.1554 -11.1554 -10.5349 -10.5349 -10.4546 -10.4546 -10.4407 -10.4407 -10.3944 -10.3944 -10.3706 -10.3706 -3.3777 -3.3777 -3.3602 -3.3602 -2.1169 -2.1169 -2.0543 -2.0543 -1.9837 -1.9837 -1.9414 -1.9414 -1.7867 -1.7867 -1.7253 -1.7253 -1.4428 -1.4428 -0.8447 -0.8447 -0.7202 -0.7202 -0.4503 -0.4503 0.1351 0.1351 0.4404 0.4404 0.5784 0.5784 1.7175 1.7175 1.7710 1.7710 1.7862 1.7862 1.9282 1.9282 1.9615 1.9615 2.2083 2.2083 2.2966 2.2966 2.4295 2.4295 2.5014 2.5014 2.6036 2.6036 2.6765 2.6765 3.0893 3.0893 5.1791 5.1791 5.4563 5.4563 10.1883 10.1883 10.6358 10.6358 10.7183 10.7183 10.8041 10.8041 10.9158 10.9158 k = 0.5000 0.1181 0.4454 ( 21580 PWs) bands (ev): -14.5427 -14.5427 -14.5424 -14.5424 -11.1557 -11.1557 -10.5330 -10.5330 -10.4551 -10.4551 -10.4415 -10.4415 -10.3943 -10.3943 -10.3692 -10.3692 -3.3810 -3.3810 -3.3621 -3.3621 -2.1299 -2.1299 -2.0567 -2.0567 -1.9868 -1.9868 -1.9416 -1.9416 -1.7812 -1.7812 -1.7261 -1.7261 -1.4516 -1.4516 -0.8456 -0.8456 -0.7056 -0.7056 -0.4477 -0.4477 0.1158 0.1158 0.4467 0.4467 0.5920 0.5920 1.7058 1.7058 1.7671 1.7671 1.7802 1.7802 1.9524 1.9524 1.9778 1.9778 2.2206 2.2206 2.3109 2.3109 2.4290 2.4290 2.5016 2.5016 2.5981 2.5981 2.6810 2.6810 3.0847 3.0847 5.1997 5.1997 5.4522 5.4522 10.1709 10.1709 10.6031 10.6031 10.6908 10.6908 10.7518 10.7518 10.8736 10.8736 k = 0.5000 0.1312 0.4268 ( 21578 PWs) bands (ev): -14.5428 -14.5428 -14.5425 -14.5425 -11.1561 -11.1561 -10.5310 -10.5310 -10.4556 -10.4556 -10.4424 -10.4424 -10.3942 -10.3942 -10.3677 -10.3677 -3.3845 -3.3845 -3.3639 -3.3639 -2.1434 -2.1434 -2.0588 -2.0588 -1.9903 -1.9903 -1.9414 -1.9414 -1.7759 -1.7759 -1.7266 -1.7266 -1.4607 -1.4607 -0.8461 -0.8461 -0.6910 -0.6910 -0.4449 -0.4449 0.0954 0.0954 0.4538 0.4538 0.6054 0.6054 1.6936 1.6936 1.7636 1.7636 1.7746 1.7746 1.9758 1.9758 1.9972 1.9972 2.2331 2.2331 2.3249 2.3249 2.4279 2.4279 2.5018 2.5018 2.5921 2.5921 2.6857 2.6857 3.0798 3.0798 5.2215 5.2215 5.4479 5.4479 10.1532 10.1532 10.5705 10.5705 10.6602 10.6602 10.6993 10.6993 10.8332 10.8332 k = 0.5000 0.1443 0.4082 ( 21578 PWs) bands (ev): -14.5430 -14.5430 -14.5426 -14.5426 -11.1564 -11.1564 -10.5289 -10.5289 -10.4559 -10.4559 -10.4436 -10.4436 -10.3941 -10.3941 -10.3662 -10.3662 -3.3882 -3.3882 -3.3657 -3.3657 -2.1570 -2.1570 -2.0607 -2.0607 -1.9943 -1.9943 -1.9408 -1.9408 -1.7708 -1.7708 -1.7268 -1.7268 -1.4699 -1.4699 -0.8463 -0.8463 -0.6766 -0.6766 -0.4420 -0.4420 0.0746 0.0746 0.4616 0.4616 0.6184 0.6184 1.6815 1.6815 1.7604 1.7604 1.7696 1.7696 1.9959 1.9959 2.0216 2.0216 2.2456 2.2456 2.3382 2.3382 2.4263 2.4263 2.5021 2.5021 2.5858 2.5858 2.6908 2.6908 3.0747 3.0747 5.2440 5.2440 5.4434 5.4434 10.1355 10.1355 10.5385 10.5385 10.6272 10.6272 10.6478 10.6478 10.7942 10.7942 k = 0.5000 0.1575 0.3897 ( 21588 PWs) bands (ev): -14.5432 -14.5432 -14.5427 -14.5427 -11.1568 -11.1568 -10.5267 -10.5267 -10.4562 -10.4562 -10.4448 -10.4448 -10.3940 -10.3940 -10.3647 -10.3647 -3.3919 -3.3919 -3.3675 -3.3675 -2.1703 -2.1703 -2.0625 -2.0625 -1.9986 -1.9986 -1.9399 -1.9399 -1.7661 -1.7661 -1.7267 -1.7267 -1.4790 -1.4790 -0.8462 -0.8462 -0.6627 -0.6627 -0.4389 -0.4389 0.0537 0.0537 0.4695 0.4695 0.6310 0.6310 1.6696 1.6696 1.7576 1.7576 1.7653 1.7653 2.0132 2.0132 2.0496 2.0496 2.2581 2.2581 2.3504 2.3504 2.4241 2.4241 2.5022 2.5022 2.5790 2.5790 2.6960 2.6960 3.0696 3.0696 5.2667 5.2667 5.4389 5.4389 10.1180 10.1180 10.5069 10.5069 10.5900 10.5900 10.6015 10.6015 10.7562 10.7562 k = 0.5000 0.1706 0.3711 ( 21576 PWs) bands (ev): -14.5433 -14.5433 -14.5428 -14.5428 -11.1571 -11.1571 -10.5245 -10.5245 -10.4564 -10.4564 -10.4463 -10.4463 -10.3939 -10.3939 -10.3632 -10.3632 -3.3956 -3.3956 -3.3692 -3.3692 -2.1831 -2.1831 -2.0641 -2.0641 -2.0032 -2.0032 -1.9386 -1.9386 -1.7619 -1.7619 -1.7261 -1.7261 -1.4878 -1.4878 -0.8459 -0.8459 -0.6495 -0.6495 -0.4357 -0.4357 0.0333 0.0333 0.4773 0.4773 0.6429 0.6429 1.6582 1.6582 1.7550 1.7550 1.7615 1.7615 2.0291 2.0291 2.0790 2.0790 2.2706 2.2706 2.3612 2.3612 2.4216 2.4216 2.5023 2.5023 2.5719 2.5719 2.7013 2.7013 3.0645 3.0645 5.2891 5.2891 5.4345 5.4345 10.1010 10.1010 10.4752 10.4752 10.5464 10.5464 10.5660 10.5660 10.7184 10.7184 k = 0.5000 0.1837 0.3526 ( 21570 PWs) bands (ev): -14.5435 -14.5435 -14.5429 -14.5429 -11.1574 -11.1574 -10.5222 -10.5222 -10.4566 -10.4566 -10.4478 -10.4478 -10.3939 -10.3939 -10.3618 -10.3618 -3.3992 -3.3992 -3.3708 -3.3708 -2.1952 -2.1952 -2.0655 -2.0655 -2.0079 -2.0079 -1.9372 -1.9372 -1.7584 -1.7584 -1.7251 -1.7251 -1.4961 -1.4961 -0.8453 -0.8453 -0.6372 -0.6372 -0.4326 -0.4326 0.0137 0.0137 0.4849 0.4849 0.6540 0.6540 1.6475 1.6475 1.7528 1.7528 1.7584 1.7584 2.0443 2.0443 2.1085 2.1085 2.2832 2.2832 2.3704 2.3704 2.4188 2.4188 2.5020 2.5020 2.5644 2.5644 2.7066 2.7066 3.0595 3.0595 5.3108 5.3108 5.4303 5.4303 10.0848 10.0848 10.4423 10.4423 10.5058 10.5058 10.5348 10.5348 10.6805 10.6805 k = 0.5000 0.1968 0.3340 ( 21566 PWs) bands (ev): -14.5436 -14.5436 -14.5430 -14.5430 -11.1577 -11.1577 -10.5200 -10.5200 -10.4566 -10.4566 -10.4493 -10.4493 -10.3938 -10.3938 -10.3605 -10.3605 -3.4026 -3.4026 -3.3722 -3.3722 -2.2063 -2.2063 -2.0667 -2.0667 -2.0126 -2.0126 -1.9356 -1.9356 -1.7556 -1.7556 -1.7236 -1.7236 -1.5038 -1.5038 -0.8447 -0.8447 -0.6260 -0.6260 -0.4295 -0.4295 -0.0047 -0.0047 0.4919 0.4919 0.6642 0.6642 1.6378 1.6378 1.7507 1.7507 1.7558 1.7558 2.0585 2.0585 2.1370 2.1370 2.2959 2.2959 2.3777 2.3777 2.4160 2.4160 2.5013 2.5013 2.5568 2.5568 2.7115 2.7115 3.0548 3.0548 5.3313 5.3313 5.4264 5.4264 10.0697 10.0697 10.4076 10.4076 10.4724 10.4724 10.5066 10.5066 10.6430 10.6430 k = 0.5000 0.2099 0.3155 ( 21564 PWs) bands (ev): -14.5438 -14.5438 -14.5431 -14.5431 -11.1580 -11.1580 -10.5179 -10.5179 -10.4566 -10.4566 -10.4509 -10.4509 -10.3937 -10.3937 -10.3593 -10.3593 -3.4057 -3.4057 -3.3735 -3.3735 -2.2162 -2.2162 -2.0677 -2.0677 -2.0172 -2.0172 -1.9341 -1.9341 -1.7534 -1.7534 -1.7218 -1.7218 -1.5107 -1.5107 -0.8440 -0.8440 -0.6160 -0.6160 -0.4266 -0.4266 -0.0216 -0.0216 0.4982 0.4982 0.6734 0.6734 1.6291 1.6291 1.7489 1.7489 1.7538 1.7538 2.0717 2.0717 2.1637 2.1637 2.3090 2.3090 2.3830 2.3830 2.4132 2.4132 2.4996 2.4996 2.5495 2.5495 2.7161 2.7161 3.0505 3.0505 5.3500 5.3500 5.4229 5.4229 10.0558 10.0558 10.3724 10.3724 10.4460 10.4460 10.4817 10.4817 10.6071 10.6071 k = 0.5000 0.2231 0.2969 ( 21556 PWs) bands (ev): -14.5439 -14.5439 -14.5432 -14.5432 -11.1582 -11.1582 -10.5159 -10.5159 -10.4566 -10.4566 -10.4523 -10.4523 -10.3937 -10.3937 -10.3583 -10.3583 -3.4085 -3.4085 -3.3747 -3.3747 -2.2248 -2.2248 -2.0684 -2.0684 -2.0214 -2.0214 -1.9327 -1.9327 -1.7518 -1.7518 -1.7199 -1.7199 -1.5168 -1.5168 -0.8432 -0.8432 -0.6073 -0.6073 -0.4239 -0.4239 -0.0364 -0.0364 0.5037 0.5037 0.6814 0.6814 1.6215 1.6215 1.7473 1.7473 1.7523 1.7523 2.0837 2.0837 2.1878 2.1878 2.3225 2.3225 2.3865 2.3865 2.4106 2.4106 2.4963 2.4963 2.5432 2.5432 2.7202 2.7202 3.0467 3.0467 5.3664 5.3664 5.4201 5.4201 10.0434 10.0434 10.3394 10.3394 10.4249 10.4249 10.4604 10.4604 10.5745 10.5745 k = 0.5000 0.2362 0.2784 ( 21560 PWs) bands (ev): -14.5440 -14.5440 -14.5433 -14.5433 -11.1584 -11.1584 -10.5141 -10.5141 -10.4566 -10.4566 -10.4537 -10.4537 -10.3936 -10.3936 -10.3574 -10.3574 -3.4109 -3.4109 -3.3756 -3.3756 -2.2320 -2.2320 -2.0689 -2.0689 -2.0252 -2.0252 -1.9314 -1.9314 -1.7507 -1.7507 -1.7179 -1.7179 -1.5219 -1.5219 -0.8426 -0.8426 -0.6001 -0.6001 -0.4216 -0.4216 -0.0491 -0.0491 0.5084 0.5084 0.6880 0.6880 1.6152 1.6152 1.7460 1.7460 1.7512 1.7512 2.0940 2.0940 2.2085 2.2085 2.3364 2.3364 2.3884 2.3884 2.4084 2.4084 2.4909 2.4909 2.5384 2.5384 2.7236 2.7236 3.0436 3.0436 5.3799 5.3799 5.4181 5.4181 10.0328 10.0328 10.3104 10.3104 10.4081 10.4081 10.4431 10.4431 10.5467 10.5467 k = 0.5000 0.2493 0.2598 ( 21570 PWs) bands (ev): -14.5441 -14.5441 -14.5433 -14.5433 -11.1586 -11.1586 -10.5127 -10.5127 -10.4566 -10.4566 -10.4549 -10.4549 -10.3936 -10.3936 -10.3567 -10.3567 -3.4127 -3.4127 -3.3764 -3.3764 -2.2378 -2.2378 -2.0691 -2.0691 -2.0284 -2.0284 -1.9303 -1.9303 -1.7500 -1.7500 -1.7162 -1.7162 -1.5259 -1.5259 -0.8420 -0.8420 -0.5945 -0.5945 -0.4197 -0.4197 -0.0592 -0.0592 0.5120 0.5120 0.6933 0.6933 1.6103 1.6103 1.7450 1.7450 1.7503 1.7503 2.1024 2.1024 2.2250 2.2250 2.3505 2.3505 2.3890 2.3890 2.4066 2.4066 2.4833 2.4833 2.5355 2.5355 2.7263 2.7263 3.0410 3.0410 5.3899 5.3899 5.4175 5.4175 10.0243 10.0243 10.2868 10.2868 10.3947 10.3947 10.4297 10.4297 10.5247 10.5247 k = 0.5000 0.2624 0.2412 ( 21572 PWs) bands (ev): -14.5441 -14.5441 -14.5433 -14.5433 -11.1587 -11.1587 -10.5116 -10.5116 -10.4565 -10.4565 -10.4557 -10.4557 -10.3936 -10.3936 -10.3562 -10.3562 -3.4141 -3.4141 -3.3770 -3.3770 -2.2419 -2.2419 -2.0693 -2.0693 -2.0308 -2.0308 -1.9295 -1.9295 -1.7495 -1.7495 -1.7149 -1.7149 -1.5289 -1.5289 -0.8415 -0.8415 -0.5903 -0.5903 -0.4183 -0.4183 -0.0667 -0.0667 0.5147 0.5147 0.6972 0.6972 1.6067 1.6067 1.7442 1.7442 1.7498 1.7498 2.1086 2.1086 2.2370 2.2370 2.3639 2.3639 2.3885 2.3885 2.4053 2.4053 2.4749 2.4749 2.5340 2.5340 2.7282 2.7282 3.0392 3.0392 5.3960 5.3960 5.4182 5.4182 10.0180 10.0180 10.2694 10.2694 10.3849 10.3849 10.4204 10.4204 10.5090 10.5090 k = 0.5000 0.2756 0.2227 ( 21546 PWs) bands (ev): -14.5442 -14.5442 -14.5434 -14.5434 -11.1588 -11.1588 -10.5109 -10.5109 -10.4565 -10.4565 -10.4563 -10.4563 -10.3936 -10.3936 -10.3559 -10.3559 -3.4150 -3.4150 -3.3773 -3.3773 -2.2444 -2.2444 -2.0693 -2.0693 -2.0323 -2.0323 -1.9291 -1.9291 -1.7493 -1.7493 -1.7140 -1.7140 -1.5306 -1.5306 -0.8412 -0.8412 -0.5879 -0.5879 -0.4174 -0.4174 -0.0712 -0.0712 0.5163 0.5163 0.6995 0.6995 1.6045 1.6045 1.7438 1.7438 1.7494 1.7494 2.1124 2.1124 2.2442 2.2442 2.3750 2.3750 2.3870 2.3870 2.4044 2.4044 2.4678 2.4678 2.5334 2.5334 2.7294 2.7294 3.0381 3.0381 5.3988 5.3988 5.4196 5.4196 10.0142 10.0142 10.2588 10.2588 10.3788 10.3788 10.4150 10.4150 10.4996 10.4996 k = 0.5000 0.2887 0.2041 ( 21542 PWs) bands (ev): -14.5442 -14.5442 -14.5434 -14.5434 -11.1588 -11.1588 -10.5106 -10.5106 -10.4566 -10.4566 -10.4564 -10.4564 -10.3936 -10.3936 -10.3558 -10.3558 -3.4152 -3.4152 -3.3774 -3.3774 -2.2452 -2.2452 -2.0693 -2.0693 -2.0328 -2.0328 -1.9289 -1.9289 -1.7492 -1.7492 -1.7138 -1.7138 -1.5312 -1.5312 -0.8411 -0.8411 -0.5870 -0.5870 -0.4171 -0.4171 -0.0727 -0.0727 0.5169 0.5169 0.7003 0.7003 1.6038 1.6038 1.7437 1.7437 1.7493 1.7493 2.1137 2.1137 2.2466 2.2466 2.3807 2.3807 2.3849 2.3849 2.4042 2.4042 2.4650 2.4650 2.5332 2.5332 2.7298 2.7298 3.0377 3.0377 5.3995 5.3995 5.4203 5.4203 10.0129 10.0129 10.2552 10.2552 10.3767 10.3767 10.4132 10.4132 10.4965 10.4965 k = 0.5000 0.2887 0.2041 ( 21542 PWs) bands (ev): -14.5442 -14.5442 -14.5434 -14.5434 -11.1588 -11.1588 -10.5106 -10.5106 -10.4566 -10.4566 -10.4564 -10.4564 -10.3936 -10.3936 -10.3558 -10.3558 -3.4152 -3.4152 -3.3774 -3.3774 -2.2452 -2.2452 -2.0693 -2.0693 -2.0328 -2.0328 -1.9289 -1.9289 -1.7492 -1.7492 -1.7138 -1.7138 -1.5312 -1.5312 -0.8411 -0.8411 -0.5870 -0.5870 -0.4171 -0.4171 -0.0727 -0.0727 0.5169 0.5169 0.7003 0.7003 1.6038 1.6038 1.7437 1.7437 1.7493 1.7493 2.1137 2.1137 2.2466 2.2466 2.3807 2.3807 2.3849 2.3849 2.4042 2.4042 2.4650 2.4650 2.5332 2.5332 2.7298 2.7298 3.0377 3.0377 5.3995 5.3995 5.4203 5.4203 10.0129 10.0129 10.2552 10.2552 10.3767 10.3767 10.4132 10.4132 10.4965 10.4965 k = 0.4934 0.2849 0.2256 ( 21557 PWs) bands (ev): -14.5442 -14.5442 -14.5434 -14.5434 -11.1588 -11.1588 -10.5109 -10.5109 -10.4565 -10.4565 -10.4563 -10.4563 -10.3936 -10.3936 -10.3559 -10.3559 -3.4149 -3.4149 -3.3773 -3.3773 -2.2444 -2.2444 -2.0693 -2.0693 -2.0323 -2.0323 -1.9291 -1.9291 -1.7493 -1.7493 -1.7140 -1.7140 -1.5306 -1.5306 -0.8412 -0.8412 -0.5879 -0.5879 -0.4174 -0.4174 -0.0712 -0.0712 0.5163 0.5163 0.6995 0.6995 1.6045 1.6045 1.7438 1.7438 1.7494 1.7494 2.1124 2.1124 2.2442 2.2442 2.3749 2.3749 2.3870 2.3870 2.4044 2.4044 2.4678 2.4678 2.5334 2.5334 2.7294 2.7294 3.0381 3.0381 5.3988 5.3988 5.4196 5.4196 10.0142 10.0142 10.2588 10.2588 10.3788 10.3788 10.4150 10.4150 10.4997 10.4997 k = 0.4868 0.2811 0.2471 ( 21561 PWs) bands (ev): -14.5441 -14.5441 -14.5433 -14.5433 -11.1587 -11.1587 -10.5116 -10.5116 -10.4565 -10.4565 -10.4557 -10.4557 -10.3936 -10.3936 -10.3562 -10.3562 -3.4141 -3.4141 -3.3770 -3.3770 -2.2419 -2.2419 -2.0693 -2.0693 -2.0308 -2.0308 -1.9295 -1.9295 -1.7495 -1.7495 -1.7149 -1.7149 -1.5288 -1.5288 -0.8415 -0.8415 -0.5904 -0.5904 -0.4183 -0.4183 -0.0666 -0.0666 0.5147 0.5147 0.6972 0.6972 1.6067 1.6067 1.7443 1.7443 1.7498 1.7498 2.1086 2.1086 2.2370 2.2370 2.3639 2.3639 2.3884 2.3884 2.4053 2.4053 2.4750 2.4750 2.5340 2.5340 2.7282 2.7282 3.0392 3.0392 5.3960 5.3960 5.4182 5.4182 10.0181 10.0181 10.2695 10.2695 10.3849 10.3849 10.4205 10.4205 10.5091 10.5091 k = 0.4803 0.2773 0.2686 ( 21549 PWs) bands (ev): -14.5441 -14.5441 -14.5433 -14.5433 -11.1586 -11.1586 -10.5127 -10.5127 -10.4566 -10.4566 -10.4548 -10.4548 -10.3936 -10.3936 -10.3567 -10.3567 -3.4127 -3.4127 -3.3764 -3.3764 -2.2377 -2.2377 -2.0691 -2.0691 -2.0283 -2.0283 -1.9303 -1.9303 -1.7500 -1.7500 -1.7162 -1.7162 -1.5259 -1.5259 -0.8420 -0.8420 -0.5945 -0.5945 -0.4197 -0.4197 -0.0592 -0.0592 0.5120 0.5120 0.6933 0.6933 1.6103 1.6103 1.7450 1.7450 1.7503 1.7503 2.1023 2.1023 2.2249 2.2249 2.3505 2.3505 2.3887 2.3887 2.4068 2.4068 2.4834 2.4834 2.5355 2.5355 2.7263 2.7263 3.0410 3.0410 5.3898 5.3898 5.4175 5.4175 10.0244 10.0244 10.2869 10.2869 10.3947 10.3947 10.4300 10.4300 10.5248 10.5248 k = 0.4737 0.2735 0.2901 ( 21546 PWs) bands (ev): -14.5440 -14.5440 -14.5432 -14.5432 -11.1584 -11.1584 -10.5142 -10.5142 -10.4566 -10.4566 -10.4537 -10.4537 -10.3936 -10.3936 -10.3574 -10.3574 -3.4108 -3.4108 -3.3756 -3.3756 -2.2320 -2.2320 -2.0689 -2.0689 -2.0252 -2.0252 -1.9314 -1.9314 -1.7507 -1.7507 -1.7180 -1.7180 -1.5218 -1.5218 -0.8426 -0.8426 -0.6002 -0.6002 -0.4216 -0.4216 -0.0490 -0.0490 0.5083 0.5083 0.6880 0.6880 1.6153 1.6153 1.7460 1.7460 1.7511 1.7511 2.0939 2.0939 2.2082 2.2082 2.3366 2.3366 2.3878 2.3878 2.4088 2.4088 2.4908 2.4908 2.5385 2.5385 2.7236 2.7236 3.0436 3.0436 5.3797 5.3797 5.4183 5.4183 10.0329 10.0329 10.3106 10.3106 10.4079 10.4079 10.4439 10.4439 10.5468 10.5468 k = 0.4671 0.2697 0.3116 ( 21560 PWs) bands (ev): -14.5439 -14.5439 -14.5432 -14.5432 -11.1582 -11.1582 -10.5159 -10.5159 -10.4567 -10.4567 -10.4523 -10.4523 -10.3937 -10.3937 -10.3583 -10.3583 -3.4085 -3.4085 -3.3747 -3.3747 -2.2247 -2.2247 -2.0684 -2.0684 -2.0214 -2.0214 -1.9327 -1.9327 -1.7518 -1.7518 -1.7199 -1.7199 -1.5167 -1.5167 -0.8433 -0.8433 -0.6075 -0.6075 -0.4240 -0.4240 -0.0363 -0.0363 0.5037 0.5037 0.6813 0.6813 1.6216 1.6216 1.7474 1.7474 1.7522 1.7522 2.0835 2.0835 2.1873 2.1873 2.3230 2.3230 2.3859 2.3859 2.4109 2.4109 2.4962 2.4962 2.5432 2.5432 2.7202 2.7202 3.0468 3.0468 5.3658 5.3658 5.4205 5.4205 10.0435 10.0435 10.3395 10.3395 10.4242 10.4242 10.4623 10.4623 10.5746 10.5746 k = 0.4605 0.2659 0.3330 ( 21552 PWs) bands (ev): -14.5438 -14.5438 -14.5431 -14.5431 -11.1580 -11.1580 -10.5179 -10.5179 -10.4568 -10.4568 -10.4507 -10.4507 -10.3937 -10.3937 -10.3593 -10.3593 -3.4057 -3.4057 -3.3735 -3.3735 -2.2160 -2.2160 -2.0677 -2.0677 -2.0171 -2.0171 -1.9341 -1.9341 -1.7533 -1.7533 -1.7220 -1.7220 -1.5106 -1.5106 -0.8440 -0.8440 -0.6162 -0.6162 -0.4266 -0.4266 -0.0213 -0.0213 0.4981 0.4981 0.6733 0.6733 1.6292 1.6292 1.7491 1.7491 1.7536 1.7536 2.0717 2.0717 2.1627 2.1627 2.3101 2.3101 2.3829 2.3829 2.4126 2.4126 2.4997 2.4997 2.5493 2.5493 2.7162 2.7162 3.0506 3.0506 5.3489 5.3489 5.4237 5.4237 10.0558 10.0558 10.3722 10.3722 10.4447 10.4447 10.4851 10.4851 10.6075 10.6075 k = 0.4539 0.2621 0.3545 ( 21562 PWs) bands (ev): -14.5437 -14.5437 -14.5430 -14.5430 -11.1577 -11.1577 -10.5200 -10.5200 -10.4569 -10.4569 -10.4490 -10.4490 -10.3938 -10.3938 -10.3605 -10.3605 -3.4026 -3.4026 -3.3722 -3.3722 -2.2061 -2.2061 -2.0668 -2.0668 -2.0126 -2.0126 -1.9356 -1.9356 -1.7553 -1.7553 -1.7239 -1.7239 -1.5036 -1.5036 -0.8447 -0.8447 -0.6262 -0.6262 -0.4295 -0.4295 -0.0045 -0.0045 0.4918 0.4918 0.6641 0.6641 1.6379 1.6379 1.7511 1.7511 1.7553 1.7553 2.0586 2.0586 2.1354 2.1354 2.2981 2.2981 2.3789 2.3789 2.4131 2.4131 2.5022 2.5022 2.5559 2.5559 2.7119 2.7119 3.0550 3.0550 5.3295 5.3295 5.4278 5.4278 10.0694 10.0694 10.4062 10.4062 10.4708 10.4708 10.5115 10.5115 10.6441 10.6441 k = 0.4474 0.2583 0.3760 ( 21568 PWs) bands (ev): -14.5436 -14.5436 -14.5428 -14.5428 -11.1574 -11.1574 -10.5222 -10.5222 -10.4570 -10.4570 -10.4473 -10.4473 -10.3939 -10.3939 -10.3619 -10.3619 -3.3992 -3.3992 -3.3707 -3.3707 -2.1950 -2.1950 -2.0656 -2.0656 -2.0079 -2.0079 -1.9371 -1.9371 -1.7578 -1.7578 -1.7257 -1.7257 -1.4959 -1.4959 -0.8454 -0.8454 -0.6375 -0.6375 -0.4325 -0.4325 0.0139 0.0139 0.4848 0.4848 0.6538 0.6538 1.6477 1.6477 1.7536 1.7536 1.7572 1.7572 2.0447 2.0447 2.1062 2.1062 2.2867 2.2867 2.3739 2.3739 2.4119 2.4119 2.5048 2.5048 2.5620 2.5620 2.7074 2.7074 3.0597 3.0597 5.3081 5.3081 5.4327 5.4327 10.0841 10.0841 10.4391 10.4391 10.5041 10.5041 10.5405 10.5405 10.6828 10.6828 k = 0.4408 0.2545 0.3975 ( 21582 PWs) bands (ev): -14.5435 -14.5435 -14.5426 -14.5426 -11.1571 -11.1571 -10.5244 -10.5244 -10.4571 -10.4571 -10.4457 -10.4457 -10.3939 -10.3939 -10.3633 -10.3633 -3.3956 -3.3956 -3.3692 -3.3692 -2.1830 -2.1830 -2.0643 -2.0643 -2.0032 -2.0032 -1.9385 -1.9385 -1.7607 -1.7607 -1.7271 -1.7271 -1.4876 -1.4876 -0.8459 -0.8459 -0.6498 -0.6498 -0.4356 -0.4356 0.0333 0.0333 0.4774 0.4774 0.6427 0.6427 1.6583 1.6583 1.7563 1.7563 1.7595 1.7595 2.0302 2.0302 2.0758 2.0758 2.2761 2.2761 2.3680 2.3680 2.4087 2.4087 2.5080 2.5080 2.5672 2.5672 2.7031 2.7031 3.0648 3.0648 5.2850 5.2850 5.4382 5.4382 10.0995 10.0995 10.4699 10.4699 10.5434 10.5434 10.5713 10.5713 10.7220 10.7220 k = 0.4342 0.2507 0.4190 ( 21577 PWs) bands (ev): -14.5435 -14.5435 -14.5424 -14.5424 -11.1568 -11.1568 -10.5265 -10.5265 -10.4573 -10.4573 -10.4440 -10.4440 -10.3940 -10.3940 -10.3648 -10.3648 -3.3918 -3.3918 -3.3675 -3.3675 -2.1703 -2.1703 -2.0628 -2.0628 -1.9988 -1.9988 -1.9395 -1.9395 -1.7640 -1.7640 -1.7283 -1.7283 -1.4789 -1.4789 -0.8462 -0.8462 -0.6631 -0.6631 -0.4386 -0.4386 0.0534 0.0534 0.4697 0.4697 0.6309 0.6309 1.6696 1.6696 1.7591 1.7591 1.7622 1.7622 2.0152 2.0152 2.0455 2.0455 2.2660 2.2660 2.3612 2.3612 2.4035 2.4035 2.5121 2.5121 2.5710 2.5710 2.6993 2.6993 3.0701 3.0701 5.2608 5.2608 5.4444 5.4444 10.1152 10.1152 10.5000 10.5000 10.5845 10.5845 10.6032 10.6032 10.7614 10.7614 k = 0.4276 0.2469 0.4405 ( 21565 PWs) bands (ev): -14.5435 -14.5435 -14.5421 -14.5421 -11.1564 -11.1564 -10.5285 -10.5285 -10.4574 -10.4574 -10.4424 -10.4424 -10.3940 -10.3940 -10.3664 -10.3664 -3.3881 -3.3881 -3.3658 -3.3658 -2.1571 -2.1571 -2.0613 -2.0613 -1.9947 -1.9947 -1.9401 -1.9401 -1.7675 -1.7675 -1.7292 -1.7292 -1.4699 -1.4699 -0.8464 -0.8464 -0.6770 -0.6770 -0.4414 -0.4414 0.0737 0.0737 0.4619 0.4619 0.6186 0.6186 1.6811 1.6811 1.7616 1.7616 1.7656 1.7656 1.9992 1.9992 2.0171 2.0171 2.2565 2.2565 2.3535 2.3535 2.3966 2.3966 2.5166 2.5166 2.5734 2.5734 2.6963 2.6963 3.0754 3.0754 5.2359 5.2359 5.4511 5.4511 10.1309 10.1309 10.5302 10.5302 10.6216 10.6216 10.6366 10.6366 10.8029 10.8029 k = 0.4211 0.2431 0.4620 ( 21578 PWs) bands (ev): -14.5435 -14.5435 -14.5417 -14.5417 -11.1561 -11.1561 -10.5304 -10.5304 -10.4576 -10.4576 -10.4409 -10.4409 -10.3941 -10.3941 -10.3680 -10.3680 -3.3844 -3.3844 -3.3641 -3.3641 -2.1439 -2.1439 -2.0598 -2.0598 -1.9913 -1.9913 -1.9400 -1.9400 -1.7711 -1.7711 -1.7298 -1.7298 -1.4609 -1.4609 -0.8464 -0.8464 -0.6912 -0.6912 -0.4440 -0.4440 0.0935 0.0935 0.4545 0.4545 0.6060 0.6060 1.6926 1.6926 1.7637 1.7637 1.7697 1.7697 1.9784 1.9784 1.9954 1.9954 2.2475 2.2475 2.3450 2.3450 2.3884 2.3884 2.5212 2.5212 2.5746 2.5746 2.6944 2.6944 3.0808 3.0808 5.2107 5.2107 5.4584 5.4584 10.1461 10.1461 10.5607 10.5607 10.6515 10.6515 10.6701 10.6701 10.8485 10.8485 k = 0.4145 0.2393 0.4835 ( 21573 PWs) bands (ev): -14.5436 -14.5436 -14.5414 -14.5414 -11.1558 -11.1558 -10.5320 -10.5320 -10.4577 -10.4577 -10.4395 -10.4395 -10.3941 -10.3941 -10.3696 -10.3696 -3.3809 -3.3809 -3.3624 -3.3624 -2.1309 -2.1309 -2.0582 -2.0582 -1.9886 -1.9886 -1.9392 -1.9392 -1.7746 -1.7746 -1.7303 -1.7303 -1.4520 -1.4520 -0.8462 -0.8462 -0.7054 -0.7054 -0.4464 -0.4464 0.1123 0.1123 0.4477 0.4477 0.5934 0.5934 1.7034 1.7034 1.7652 1.7652 1.7744 1.7744 1.9541 1.9541 1.9810 1.9810 2.2391 2.2391 2.3358 2.3358 2.3792 2.3792 2.5249 2.5249 2.5753 2.5753 2.6936 2.6936 3.0860 3.0860 5.1857 5.1857 5.4661 5.4661 10.1606 10.1606 10.5909 10.5909 10.6758 10.6758 10.6998 10.6998 10.8987 10.8987 k = 0.4079 0.2355 0.5049 ( 21586 PWs) bands (ev): -14.5438 -14.5438 -14.5410 -14.5410 -11.1556 -11.1556 -10.5335 -10.5335 -10.4579 -10.4579 -10.4382 -10.4382 -10.3941 -10.3941 -10.3712 -10.3712 -3.3777 -3.3777 -3.3607 -3.3607 -2.1188 -2.1188 -2.0565 -2.0565 -1.9866 -1.9866 -1.9376 -1.9376 -1.7778 -1.7778 -1.7305 -1.7305 -1.4436 -1.4436 -0.8460 -0.8460 -0.7192 -0.7192 -0.4483 -0.4483 0.1295 0.1295 0.4419 0.4419 0.5810 0.5810 1.7125 1.7125 1.7662 1.7662 1.7795 1.7795 1.9320 1.9320 1.9697 1.9697 2.2313 2.2313 2.3260 2.3260 2.3694 2.3694 2.5269 2.5269 2.5765 2.5765 2.6938 2.6938 3.0911 3.0911 5.1613 5.1613 5.4742 5.4742 10.1740 10.1740 10.6194 10.6194 10.6946 10.6946 10.7253 10.7253 10.9521 10.9521 k = 0.4013 0.2317 0.5264 ( 21573 PWs) bands (ev): -14.5440 -14.5440 -14.5406 -14.5406 -11.1553 -11.1553 -10.5347 -10.5347 -10.4581 -10.4581 -10.4371 -10.4371 -10.3941 -10.3941 -10.3728 -10.3728 -3.3748 -3.3748 -3.3591 -3.3591 -2.1081 -2.1081 -2.0546 -2.0546 -1.9853 -1.9853 -1.9354 -1.9354 -1.7807 -1.7807 -1.7306 -1.7306 -1.4357 -1.4357 -0.8459 -0.8459 -0.7321 -0.7321 -0.4499 -0.4499 0.1444 0.1444 0.4373 0.4373 0.5693 0.5693 1.7184 1.7184 1.7663 1.7663 1.7851 1.7851 1.9149 1.9149 1.9605 1.9605 2.2242 2.2242 2.3160 2.3160 2.3593 2.3593 2.5264 2.5264 2.5790 2.5790 2.6949 2.6949 3.0959 3.0959 5.1377 5.1377 5.4827 5.4827 10.1858 10.1858 10.6440 10.6440 10.7073 10.7073 10.7491 10.7491 11.0065 11.0065 k = 0.3947 0.2279 0.5479 ( 21570 PWs) bands (ev): -14.5442 -14.5442 -14.5401 -14.5401 -11.1552 -11.1552 -10.5355 -10.5355 -10.4583 -10.4583 -10.4361 -10.4361 -10.3941 -10.3941 -10.3743 -10.3743 -3.3724 -3.3724 -3.3576 -3.3576 -2.0993 -2.0993 -2.0525 -2.0525 -1.9846 -1.9846 -1.9327 -1.9327 -1.7831 -1.7831 -1.7304 -1.7304 -1.4287 -1.4287 -0.8460 -0.8460 -0.7434 -0.7434 -0.4510 -0.4510 0.1567 0.1567 0.4340 0.4340 0.5587 0.5587 1.7198 1.7198 1.7657 1.7657 1.7915 1.7915 1.9047 1.9047 1.9534 1.9534 2.2177 2.2177 2.3058 2.3058 2.3492 2.3492 2.5233 2.5233 2.5833 2.5833 2.6967 2.6967 3.1003 3.1003 5.1155 5.1155 5.4915 5.4915 10.1955 10.1955 10.6621 10.6621 10.7133 10.7133 10.7743 10.7743 11.0591 11.0591 k = 0.3882 0.2241 0.5694 ( 21593 PWs) bands (ev): -14.5445 -14.5445 -14.5397 -14.5397 -11.1550 -11.1550 -10.5361 -10.5361 -10.4586 -10.4586 -10.4352 -10.4352 -10.3941 -10.3941 -10.3757 -10.3757 -3.3705 -3.3705 -3.3562 -3.3562 -2.0928 -2.0928 -2.0503 -2.0503 -1.9841 -1.9841 -1.9299 -1.9299 -1.7851 -1.7851 -1.7298 -1.7298 -1.4227 -1.4227 -0.8467 -0.8467 -0.7526 -0.7526 -0.4516 -0.4516 0.1661 0.1661 0.4318 0.4318 0.5496 0.5496 1.7159 1.7159 1.7643 1.7643 1.7990 1.7990 1.9020 1.9020 1.9483 1.9483 2.2120 2.2120 2.2959 2.2959 2.3393 2.3393 2.5183 2.5183 2.5889 2.5889 2.6990 2.6990 3.1044 3.1044 5.0949 5.0949 5.5005 5.5005 10.2026 10.2026 10.6717 10.6717 10.7125 10.7125 10.8028 10.8028 11.1077 11.1077 k = 0.3816 0.2203 0.5909 ( 21575 PWs) bands (ev): -14.5448 -14.5448 -14.5392 -14.5392 -11.1550 -11.1550 -10.5363 -10.5363 -10.4589 -10.4589 -10.4343 -10.4343 -10.3941 -10.3941 -10.3770 -10.3770 -3.3692 -3.3692 -3.3550 -3.3550 -2.0888 -2.0888 -2.0483 -2.0483 -1.9838 -1.9838 -1.9271 -1.9271 -1.7865 -1.7865 -1.7289 -1.7289 -1.4180 -1.4180 -0.8481 -0.8481 -0.7591 -0.7591 -0.4517 -0.4517 0.1725 0.1725 0.4302 0.4302 0.5426 0.5426 1.7077 1.7077 1.7622 1.7622 1.8076 1.8076 1.9060 1.9060 1.9450 1.9450 2.2071 2.2071 2.2863 2.2863 2.3300 2.3300 2.5121 2.5121 2.5955 2.5955 2.7016 2.7016 3.1081 3.1081 5.0762 5.0762 5.5097 5.5097 10.2066 10.2066 10.6720 10.6720 10.7058 10.7058 10.8344 10.8344 11.1499 11.1499 k = 0.3750 0.2165 0.6124 ( 21570 PWs) bands (ev): -14.5452 -14.5452 -14.5387 -14.5387 -11.1550 -11.1550 -10.5362 -10.5362 -10.4592 -10.4592 -10.4335 -10.4335 -10.3942 -10.3942 -10.3781 -10.3781 -3.3685 -3.3685 -3.3539 -3.3539 -2.0868 -2.0868 -2.0473 -2.0473 -1.9836 -1.9836 -1.9247 -1.9247 -1.7874 -1.7874 -1.7275 -1.7275 -1.4147 -1.4147 -0.8500 -0.8500 -0.7627 -0.7627 -0.4514 -0.4514 0.1762 0.1762 0.4285 0.4285 0.5382 0.5382 1.6972 1.6972 1.7596 1.7596 1.8168 1.8168 1.9153 1.9153 1.9435 1.9435 2.2029 2.2029 2.2776 2.2776 2.3214 2.3214 2.5053 2.5053 2.6025 2.6025 2.7043 2.7043 3.1113 3.1113 5.0597 5.0597 5.5190 5.5190 10.2069 10.2069 10.6628 10.6628 10.6942 10.6942 10.8682 10.8682 11.1810 11.1810 k = 0.6250-0.0722 0.4082 ( 21570 PWs) bands (ev): -14.5452 -14.5452 -14.5387 -14.5387 -11.1550 -11.1550 -10.5362 -10.5362 -10.4592 -10.4592 -10.4335 -10.4335 -10.3942 -10.3942 -10.3781 -10.3781 -3.3685 -3.3685 -3.3539 -3.3539 -2.0868 -2.0868 -2.0473 -2.0473 -1.9836 -1.9836 -1.9247 -1.9247 -1.7874 -1.7874 -1.7275 -1.7275 -1.4147 -1.4147 -0.8500 -0.8500 -0.7627 -0.7627 -0.4514 -0.4514 0.1762 0.1762 0.4285 0.4285 0.5382 0.5382 1.6972 1.6972 1.7596 1.7596 1.8168 1.8168 1.9153 1.9153 1.9435 1.9435 2.2029 2.2029 2.2776 2.2776 2.3214 2.3214 2.5053 2.5053 2.6025 2.6025 2.7043 2.7043 3.1113 3.1113 5.0597 5.0597 5.5190 5.5190 10.2069 10.2069 10.6628 10.6628 10.6942 10.6942 10.8682 10.8682 11.1810 11.1810 k = 0.6136-0.0919 0.4082 ( 21570 PWs) bands (ev): -14.5460 -14.5460 -14.5378 -14.5378 -11.1550 -11.1550 -10.5355 -10.5355 -10.4599 -10.4599 -10.4321 -10.4321 -10.3943 -10.3943 -10.3800 -10.3800 -3.3682 -3.3682 -3.3522 -3.3522 -2.0854 -2.0854 -2.0474 -2.0474 -1.9833 -1.9833 -1.9208 -1.9208 -1.7884 -1.7884 -1.7246 -1.7246 -1.4107 -1.4107 -0.8539 -0.8539 -0.7653 -0.7653 -0.4503 -0.4503 0.1799 0.1799 0.4236 0.4236 0.5349 0.5349 1.6791 1.6791 1.7552 1.7552 1.8332 1.8332 1.9347 1.9347 1.9436 1.9436 2.1966 2.1966 2.2638 2.2638 2.3079 2.3079 2.4922 2.4922 2.6152 2.6152 2.7093 2.7093 3.1163 3.1163 5.0338 5.0338 5.5352 5.5352 10.2022 10.2022 10.6361 10.6361 10.6731 10.6731 10.9259 10.9259 11.1679 11.1679 k = 0.6023-0.1115 0.4082 ( 21592 PWs) bands (ev): -14.5467 -14.5467 -14.5370 -14.5370 -11.1552 -11.1552 -10.5345 -10.5345 -10.4607 -10.4607 -10.4306 -10.4306 -10.3946 -10.3946 -10.3820 -10.3820 -3.3683 -3.3683 -3.3507 -3.3507 -2.0850 -2.0850 -2.0486 -2.0486 -1.9829 -1.9829 -1.9166 -1.9166 -1.7888 -1.7888 -1.7217 -1.7217 -1.4076 -1.4076 -0.8583 -0.8583 -0.7664 -0.7664 -0.4487 -0.4487 0.1827 0.1827 0.4166 0.4166 0.5345 0.5345 1.6622 1.6622 1.7511 1.7511 1.8495 1.8495 1.9397 1.9397 1.9605 1.9605 2.1910 2.1910 2.2507 2.2507 2.2951 2.2951 2.4773 2.4773 2.6278 2.6278 2.7142 2.7142 3.1212 3.1212 5.0093 5.0093 5.5510 5.5510 10.1948 10.1948 10.6081 10.6081 10.6532 10.6532 10.9798 10.9798 11.1139 11.1139 k = 0.5909-0.1312 0.4082 ( 21582 PWs) bands (ev): -14.5473 -14.5473 -14.5363 -14.5363 -11.1554 -11.1554 -10.5332 -10.5332 -10.4617 -10.4617 -10.4288 -10.4288 -10.3950 -10.3950 -10.3838 -10.3838 -3.3685 -3.3685 -3.3494 -3.3494 -2.0855 -2.0855 -2.0507 -2.0507 -1.9826 -1.9826 -1.9123 -1.9123 -1.7888 -1.7888 -1.7189 -1.7189 -1.4051 -1.4051 -0.8627 -0.8627 -0.7661 -0.7661 -0.4469 -0.4469 0.1842 0.1842 0.4085 0.4085 0.5364 0.5364 1.6468 1.6468 1.7475 1.7475 1.8653 1.8653 1.9394 1.9394 1.9844 1.9844 2.1860 2.1860 2.2385 2.2385 2.2832 2.2832 2.4611 2.4611 2.6400 2.6400 2.7191 2.7191 3.1259 3.1259 4.9864 4.9864 5.5664 5.5664 10.1854 10.1854 10.5819 10.5819 10.6319 10.6319 11.0287 11.0287 11.0671 11.0671 k = 0.5795-0.1509 0.4082 ( 21580 PWs) bands (ev): -14.5479 -14.5479 -14.5357 -14.5357 -11.1556 -11.1556 -10.5318 -10.5318 -10.4628 -10.4628 -10.4269 -10.4269 -10.3957 -10.3957 -10.3855 -10.3855 -3.3689 -3.3689 -3.3484 -3.3484 -2.0865 -2.0865 -2.0532 -2.0532 -1.9824 -1.9824 -1.9080 -1.9080 -1.7884 -1.7884 -1.7162 -1.7162 -1.4033 -1.4033 -0.8672 -0.8672 -0.7649 -0.7649 -0.4449 -0.4449 0.1847 0.1847 0.4002 0.4002 0.5396 0.5396 1.6330 1.6330 1.7443 1.7443 1.8801 1.8801 1.9391 1.9391 2.0095 2.0095 2.1817 2.1817 2.2273 2.2273 2.2722 2.2722 2.4439 2.4439 2.6513 2.6513 2.7237 2.7237 3.1303 3.1303 4.9655 4.9655 5.5808 5.5808 10.1751 10.1751 10.5582 10.5582 10.6092 10.6092 11.0250 11.0250 11.0756 11.0756 k = 0.5682-0.1706 0.4082 ( 21570 PWs) bands (ev): -14.5484 -14.5484 -14.5352 -14.5352 -11.1558 -11.1558 -10.5302 -10.5302 -10.4639 -10.4639 -10.4249 -10.4249 -10.3967 -10.3967 -10.3869 -10.3869 -3.3693 -3.3693 -3.3475 -3.3475 -2.0880 -2.0880 -2.0557 -2.0557 -1.9823 -1.9823 -1.9039 -1.9039 -1.7878 -1.7878 -1.7137 -1.7137 -1.4019 -1.4019 -0.8713 -0.8713 -0.7633 -0.7633 -0.4428 -0.4428 0.1843 0.1843 0.3924 0.3924 0.5434 0.5434 1.6209 1.6209 1.7415 1.7415 1.8935 1.8935 1.9392 1.9392 2.0350 2.0350 2.1784 2.1784 2.2173 2.2173 2.2622 2.2622 2.4259 2.4259 2.6614 2.6614 2.7280 2.7280 3.1343 3.1343 4.9467 4.9467 5.5940 5.5940 10.1645 10.1645 10.5374 10.5374 10.5857 10.5857 10.9925 10.9925 11.1146 11.1146 k = 0.5568-0.1903 0.4082 ( 21574 PWs) bands (ev): -14.5488 -14.5488 -14.5347 -14.5347 -11.1560 -11.1560 -10.5287 -10.5287 -10.4651 -10.4651 -10.4227 -10.4227 -10.3982 -10.3982 -10.3879 -10.3879 -3.3696 -3.3696 -3.3469 -3.3469 -2.0898 -2.0898 -2.0581 -2.0581 -1.9824 -1.9824 -1.9001 -1.9001 -1.7870 -1.7870 -1.7116 -1.7116 -1.4010 -1.4010 -0.8750 -0.8750 -0.7615 -0.7615 -0.4408 -0.4408 0.1831 0.1831 0.3857 0.3857 0.5472 0.5472 1.6106 1.6106 1.7392 1.7392 1.9051 1.9051 1.9395 1.9395 2.0601 2.0601 2.1762 2.1762 2.2087 2.2087 2.2532 2.2532 2.4077 2.4077 2.6702 2.6702 2.7318 2.7318 3.1378 3.1378 4.9303 4.9303 5.6058 5.6058 10.1544 10.1544 10.5197 10.5197 10.5627 10.5627 10.9666 10.9666 11.1472 11.1472 k = 0.5455-0.2099 0.4082 ( 21586 PWs) bands (ev): -14.5492 -14.5492 -14.5344 -14.5344 -11.1561 -11.1561 -10.5272 -10.5272 -10.4662 -10.4662 -10.4204 -10.4204 -10.4001 -10.4001 -10.3886 -10.3886 -3.3700 -3.3700 -3.3464 -3.3464 -2.0916 -2.0916 -2.0601 -2.0601 -1.9825 -1.9825 -1.8970 -1.8970 -1.7862 -1.7862 -1.7097 -1.7097 -1.4003 -1.4003 -0.8782 -0.8782 -0.7597 -0.7597 -0.4389 -0.4389 0.1815 0.1815 0.3802 0.3802 0.5508 0.5508 1.6022 1.6022 1.7373 1.7373 1.9145 1.9145 1.9403 1.9403 2.0835 2.0835 2.1755 2.1755 2.2014 2.2014 2.2450 2.2450 2.3897 2.3897 2.6775 2.6775 2.7351 2.7351 3.1408 3.1408 4.9166 4.9166 5.6158 5.6158 10.1454 10.1454 10.5052 10.5052 10.5416 10.5416 10.9466 10.9466 11.1705 11.1705 k = 0.5341-0.2296 0.4082 ( 21582 PWs) bands (ev): -14.5494 -14.5494 -14.5341 -14.5341 -11.1563 -11.1563 -10.5259 -10.5259 -10.4672 -10.4672 -10.4181 -10.4181 -10.4022 -10.4022 -10.3890 -10.3890 -3.3703 -3.3703 -3.3461 -3.3461 -2.0932 -2.0932 -2.0617 -2.0617 -1.9827 -1.9827 -1.8944 -1.8944 -1.7854 -1.7854 -1.7083 -1.7083 -1.3999 -1.3999 -0.8806 -0.8806 -0.7582 -0.7582 -0.4374 -0.4374 0.1798 0.1798 0.3760 0.3760 0.5538 0.5538 1.5955 1.5955 1.7358 1.7358 1.9215 1.9215 1.9415 1.9415 2.1038 2.1038 2.1770 2.1770 2.1957 2.1957 2.2376 2.2376 2.3730 2.3730 2.6833 2.6833 2.7377 2.7377 3.1432 3.1432 4.9056 4.9056 5.6238 5.6238 10.1379 10.1379 10.4938 10.4938 10.5238 10.5238 10.9320 10.9320 11.1808 11.1808 k = 0.5227-0.2493 0.4082 ( 21588 PWs) bands (ev): -14.5496 -14.5496 -14.5339 -14.5339 -11.1564 -11.1564 -10.5249 -10.5249 -10.4680 -10.4680 -10.4157 -10.4157 -10.4045 -10.4045 -10.3893 -10.3893 -3.3705 -3.3705 -3.3459 -3.3459 -2.0945 -2.0945 -2.0628 -2.0628 -1.9828 -1.9828 -1.8925 -1.8925 -1.7848 -1.7848 -1.7072 -1.7072 -1.3996 -1.3996 -0.8824 -0.8824 -0.7570 -0.7570 -0.4362 -0.4362 0.1783 0.1783 0.3731 0.3731 0.5561 0.5561 1.5908 1.5908 1.7347 1.7347 1.9259 1.9259 1.9431 1.9431 2.1190 2.1190 2.1813 2.1813 2.1915 2.1915 2.2307 2.2307 2.3587 2.3587 2.6875 2.6875 2.7397 2.7397 3.1449 3.1449 4.8977 4.8977 5.6297 5.6297 10.1323 10.1323 10.4856 10.4856 10.5103 10.5103 10.9221 10.9221 11.1812 11.1812 k = 0.5114-0.2690 0.4082 ( 21608 PWs) bands (ev): -14.5498 -14.5498 -14.5338 -14.5338 -11.1565 -11.1565 -10.5242 -10.5242 -10.4685 -10.4685 -10.4135 -10.4135 -10.4066 -10.4066 -10.3894 -10.3894 -3.3706 -3.3706 -3.3458 -3.3458 -2.0954 -2.0954 -2.0635 -2.0635 -1.9829 -1.9829 -1.8914 -1.8914 -1.7844 -1.7844 -1.7065 -1.7065 -1.3995 -1.3995 -0.8835 -0.8835 -0.7562 -0.7562 -0.4355 -0.4355 0.1773 0.1773 0.3714 0.3714 0.5575 0.5575 1.5879 1.5879 1.7341 1.7341 1.9281 1.9281 1.9445 1.9445 2.1277 2.1277 2.1876 2.1876 2.1890 2.1890 2.2247 2.2247 2.3489 2.3489 2.6900 2.6900 2.7409 2.7409 3.1460 3.1460 4.8929 4.8929 5.6333 5.6333 10.1288 10.1288 10.4807 10.4807 10.5018 10.5018 10.9163 10.9163 11.1793 11.1793 k = 0.5000-0.2887 0.4082 ( 21604 PWs) bands (ev): -14.5498 -14.5498 -14.5337 -14.5337 -11.1565 -11.1565 -10.5240 -10.5240 -10.4686 -10.4686 -10.4124 -10.4124 -10.4077 -10.4077 -10.3895 -10.3895 -3.3707 -3.3707 -3.3458 -3.3458 -2.0956 -2.0956 -2.0637 -2.0637 -1.9830 -1.9830 -1.8910 -1.8910 -1.7843 -1.7843 -1.7063 -1.7063 -1.3994 -1.3994 -0.8839 -0.8839 -0.7560 -0.7560 -0.4352 -0.4352 0.1770 0.1770 0.3708 0.3708 0.5580 0.5580 1.5869 1.5869 1.7339 1.7339 1.9288 1.9288 1.9451 1.9451 2.1304 2.1304 2.1881 2.1881 2.1910 2.1910 2.2218 2.2218 2.3454 2.3454 2.6909 2.6909 2.7413 2.7413 3.1463 3.1463 4.8913 4.8913 5.6345 5.6345 10.1276 10.1276 10.4791 10.4791 10.4990 10.4990 10.9144 10.9144 11.1784 11.1784 Writing output data file Cs2PtCl6.save init_run : 1.04s CPU 1.25s WALL ( 1 calls) electrons : 982.22s CPU 992.95s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.10s CPU 0.15s WALL ( 1 calls) Called by electrons: c_bands : 982.21s CPU 992.93s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.03s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.02s WALL ( 1 calls) newd : 0.32s CPU 0.38s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.23s CPU 0.25s WALL ( 210 calls) cegterg : 927.01s CPU 936.73s WALL ( 588 calls) Called by sum_band: Called by *egterg: h_psi : 626.01s CPU 631.96s WALL ( 10244 calls) s_psi : 29.00s CPU 29.01s WALL ( 10244 calls) g_psi : 0.95s CPU 0.91s WALL ( 9446 calls) cdiaghg : 216.38s CPU 217.38s WALL ( 9656 calls) cegterg:over : 37.72s CPU 37.86s WALL ( 9446 calls) cegterg:upda : 32.04s CPU 32.09s WALL ( 9446 calls) cegterg:last : 16.17s CPU 16.13s WALL ( 1218 calls) cdiaghg:chol : 9.29s CPU 9.33s WALL ( 9656 calls) cdiaghg:inve : 6.29s CPU 6.58s WALL ( 9656 calls) cdiaghg:para : 14.40s CPU 14.43s WALL ( 19312 calls) Called by h_psi: h_psi:vloc : 544.69s CPU 550.12s WALL ( 10244 calls) h_psi:vnl : 80.34s CPU 80.84s WALL ( 10244 calls) add_vuspsi : 43.21s CPU 43.70s WALL ( 10244 calls) General routines calbec : 37.04s CPU 37.10s WALL ( 10244 calls) fft : 0.04s CPU 0.04s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 521.12s CPU 526.01s WALL ( 1186320 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.06s CPU 0.30s WALL ( 420 calls) Parallel routines fft_scatter : 277.32s CPU 280.29s WALL ( 1186343 calls) PWSCF : 17m36.43s CPU 18m 3.35s WALL This run was terminated on: 8:19:11 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=