Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 8: 0:45 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: ./Cs2GeCl6.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 56 56 15 2405 2405 337 Max 57 57 16 2412 2412 340 Sum 4093 4093 1111 173463 173463 24357 bravais-lattice index = 14 lattice parameter (alat) = 13.6430 a.u. unit-cell volume = 1795.6171 (a.u.)^3 number of atoms/cell = 9 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 13.642991 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 Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for 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. # 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 Ge 4.00 72.64000 Ge( 1.00) Cl 7.00 35.45300 Cl( 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 0.2258064), 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 0.2954546 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 0.2045455 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 0.2954546), 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 0.2045455), 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 0.0454545 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: 173463 G-vectors FFT dimensions: ( 80, 80, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.72 Mb ( 618, 76) NL pseudopotentials 1.61 Mb ( 309, 342) Each V/rho on FFT grid 0.20 Mb ( 12800) Each G-vector array 0.02 Mb ( 2408) G-vector shells 0.01 Mb ( 787) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.87 Mb ( 618, 304) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.79 Mb ( 342, 2, 76) The potential is recalculated from file : ./Cs2GeCl6.save/charge-density.dat Starting wfc are 76 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 7.0 secs Computing kpt #: 2 total cpu time spent up to now is 10.9 secs Computing kpt #: 3 total cpu time spent up to now is 17.6 secs Computing kpt #: 4 total cpu time spent up to now is 20.6 secs Computing kpt #: 5 total cpu time spent up to now is 23.8 secs Computing kpt #: 6 total cpu time spent up to now is 26.8 secs Computing kpt #: 7 total cpu time spent up to now is 29.9 secs Computing kpt #: 8 total cpu time spent up to now is 33.1 secs Computing kpt #: 9 total cpu time spent up to now is 36.3 secs Computing kpt #: 10 total cpu time spent up to now is 39.4 secs Computing kpt #: 11 total cpu time spent up to now is 42.7 secs Computing kpt #: 12 total cpu time spent up to now is 45.9 secs Computing kpt #: 13 total cpu time spent up to now is 48.9 secs Computing kpt #: 14 total cpu time spent up to now is 52.0 secs Computing kpt #: 15 total cpu time spent up to now is 55.1 secs Computing kpt #: 16 total cpu time spent up to now is 58.2 secs Computing kpt #: 17 total cpu time spent up to now is 61.4 secs Computing kpt #: 18 total cpu time spent up to now is 64.5 secs Computing kpt #: 19 total cpu time spent up to now is 67.5 secs Computing kpt #: 20 total cpu time spent up to now is 70.6 secs Computing kpt #: 21 total cpu time spent up to now is 73.7 secs Computing kpt #: 22 total cpu time spent up to now is 76.9 secs Computing kpt #: 23 total cpu time spent up to now is 79.9 secs Computing kpt #: 24 total cpu time spent up to now is 82.8 secs Computing kpt #: 25 total cpu time spent up to now is 85.8 secs Computing kpt #: 26 total cpu time spent up to now is 88.9 secs Computing kpt #: 27 total cpu time spent up to now is 91.9 secs Computing kpt #: 28 total cpu time spent up to now is 94.9 secs Computing kpt #: 29 total cpu time spent up to now is 97.9 secs Computing kpt #: 30 total cpu time spent up to now is 100.5 secs Computing kpt #: 31 total cpu time spent up to now is 103.6 secs Computing kpt #: 32 total cpu time spent up to now is 106.6 secs Computing kpt #: 33 total cpu time spent up to now is 109.6 secs Computing kpt #: 34 total cpu time spent up to now is 112.1 secs Computing kpt #: 35 total cpu time spent up to now is 114.6 secs Computing kpt #: 36 total cpu time spent up to now is 117.2 secs Computing kpt #: 37 total cpu time spent up to now is 120.1 secs Computing kpt #: 38 total cpu time spent up to now is 123.3 secs Computing kpt #: 39 total cpu time spent up to now is 126.4 secs Computing kpt #: 40 total cpu time spent up to now is 129.5 secs Computing kpt #: 41 total cpu time spent up to now is 132.5 secs Computing kpt #: 42 total cpu time spent up to now is 135.8 secs Computing kpt #: 43 total cpu time spent up to now is 139.0 secs Computing kpt #: 44 total cpu time spent up to now is 142.2 secs Computing kpt #: 45 total cpu time spent up to now is 145.2 secs Computing kpt #: 46 total cpu time spent up to now is 148.5 secs Computing kpt #: 47 total cpu time spent up to now is 151.5 secs Computing kpt #: 48 total cpu time spent up to now is 154.6 secs Computing kpt #: 49 total cpu time spent up to now is 157.8 secs Computing kpt #: 50 total cpu time spent up to now is 160.9 secs Computing kpt #: 51 total cpu time spent up to now is 164.1 secs Computing kpt #: 52 total cpu time spent up to now is 167.4 secs Computing kpt #: 53 total cpu time spent up to now is 170.6 secs Computing kpt #: 54 total cpu time spent up to now is 173.8 secs Computing kpt #: 55 total cpu time spent up to now is 177.1 secs Computing kpt #: 56 total cpu time spent up to now is 180.2 secs Computing kpt #: 57 total cpu time spent up to now is 183.9 secs Computing kpt #: 58 total cpu time spent up to now is 187.3 secs Computing kpt #: 59 total cpu time spent up to now is 191.3 secs Computing kpt #: 60 total cpu time spent up to now is 198.0 secs Computing kpt #: 61 total cpu time spent up to now is 202.5 secs Computing kpt #: 62 total cpu time spent up to now is 206.7 secs Computing kpt #: 63 total cpu time spent up to now is 211.0 secs Computing kpt #: 64 total cpu time spent up to now is 215.2 secs Computing kpt #: 65 total cpu time spent up to now is 219.5 secs Computing kpt #: 66 total cpu time spent up to now is 223.2 secs Computing kpt #: 67 total cpu time spent up to now is 226.9 secs Computing kpt #: 68 total cpu time spent up to now is 230.5 secs Computing kpt #: 69 total cpu time spent up to now is 234.2 secs Computing kpt #: 70 total cpu time spent up to now is 237.9 secs Computing kpt #: 71 total cpu time spent up to now is 241.4 secs Computing kpt #: 72 total cpu time spent up to now is 245.1 secs Computing kpt #: 73 total cpu time spent up to now is 249.3 secs Computing kpt #: 74 total cpu time spent up to now is 253.9 secs Computing kpt #: 75 total cpu time spent up to now is 257.3 secs Computing kpt #: 76 total cpu time spent up to now is 260.6 secs Computing kpt #: 77 total cpu time spent up to now is 264.0 secs Computing kpt #: 78 total cpu time spent up to now is 267.4 secs Computing kpt #: 79 total cpu time spent up to now is 270.7 secs Computing kpt #: 80 total cpu time spent up to now is 274.0 secs Computing kpt #: 81 total cpu time spent up to now is 277.2 secs Computing kpt #: 82 total cpu time spent up to now is 280.4 secs Computing kpt #: 83 total cpu time spent up to now is 283.7 secs Computing kpt #: 84 total cpu time spent up to now is 286.9 secs Computing kpt #: 85 total cpu time spent up to now is 290.1 secs Computing kpt #: 86 total cpu time spent up to now is 293.2 secs Computing kpt #: 87 total cpu time spent up to now is 296.4 secs Computing kpt #: 88 total cpu time spent up to now is 299.5 secs Computing kpt #: 89 total cpu time spent up to now is 302.7 secs Computing kpt #: 90 total cpu time spent up to now is 305.9 secs Computing kpt #: 91 total cpu time spent up to now is 309.1 secs Computing kpt #: 92 total cpu time spent up to now is 312.3 secs Computing kpt #: 93 total cpu time spent up to now is 315.5 secs Computing kpt #: 94 total cpu time spent up to now is 318.8 secs Computing kpt #: 95 total cpu time spent up to now is 322.1 secs Computing kpt #: 96 total cpu time spent up to now is 325.4 secs Computing kpt #: 97 total cpu time spent up to now is 328.5 secs Computing kpt #: 98 total cpu time spent up to now is 331.8 secs Computing kpt #: 99 total cpu time spent up to now is 335.1 secs Computing kpt #: 100 total cpu time spent up to now is 338.2 secs Computing kpt #: 101 total cpu time spent up to now is 341.4 secs Computing kpt #: 102 total cpu time spent up to now is 344.4 secs Computing kpt #: 103 total cpu time spent up to now is 347.7 secs Computing kpt #: 104 total cpu time spent up to now is 350.8 secs Computing kpt #: 105 total cpu time spent up to now is 353.9 secs Computing kpt #: 106 total cpu time spent up to now is 357.1 secs Computing kpt #: 107 total cpu time spent up to now is 360.3 secs Computing kpt #: 108 total cpu time spent up to now is 363.5 secs Computing kpt #: 109 total cpu time spent up to now is 366.8 secs Computing kpt #: 110 total cpu time spent up to now is 370.1 secs Computing kpt #: 111 total cpu time spent up to now is 374.3 secs Computing kpt #: 112 total cpu time spent up to now is 377.5 secs Computing kpt #: 113 total cpu time spent up to now is 380.8 secs Computing kpt #: 114 total cpu time spent up to now is 383.9 secs Computing kpt #: 115 total cpu time spent up to now is 387.2 secs Computing kpt #: 116 total cpu time spent up to now is 390.4 secs Computing kpt #: 117 total cpu time spent up to now is 393.6 secs Computing kpt #: 118 total cpu time spent up to now is 397.1 secs Computing kpt #: 119 total cpu time spent up to now is 400.6 secs Computing kpt #: 120 total cpu time spent up to now is 404.2 secs Computing kpt #: 121 total cpu time spent up to now is 407.6 secs Computing kpt #: 122 total cpu time spent up to now is 411.1 secs Computing kpt #: 123 total cpu time spent up to now is 415.0 secs Computing kpt #: 124 total cpu time spent up to now is 418.5 secs Computing kpt #: 125 total cpu time spent up to now is 422.0 secs Computing kpt #: 126 total cpu time spent up to now is 425.5 secs Computing kpt #: 127 total cpu time spent up to now is 429.0 secs Computing kpt #: 128 total cpu time spent up to now is 432.3 secs Computing kpt #: 129 total cpu time spent up to now is 436.0 secs Computing kpt #: 130 total cpu time spent up to now is 439.5 secs Computing kpt #: 131 total cpu time spent up to now is 442.9 secs Computing kpt #: 132 total cpu time spent up to now is 446.2 secs Computing kpt #: 133 total cpu time spent up to now is 450.3 secs Computing kpt #: 134 total cpu time spent up to now is 454.3 secs Computing kpt #: 135 total cpu time spent up to now is 458.3 secs Computing kpt #: 136 total cpu time spent up to now is 462.7 secs Computing kpt #: 137 total cpu time spent up to now is 467.0 secs Computing kpt #: 138 total cpu time spent up to now is 471.8 secs Computing kpt #: 139 total cpu time spent up to now is 476.3 secs Computing kpt #: 140 total cpu time spent up to now is 480.6 secs Computing kpt #: 141 total cpu time spent up to now is 485.0 secs Computing kpt #: 142 total cpu time spent up to now is 489.1 secs Computing kpt #: 143 total cpu time spent up to now is 493.0 secs Computing kpt #: 144 total cpu time spent up to now is 497.0 secs Computing kpt #: 145 total cpu time spent up to now is 500.6 secs Computing kpt #: 146 total cpu time spent up to now is 504.8 secs Computing kpt #: 147 total cpu time spent up to now is 508.1 secs Computing kpt #: 148 total cpu time spent up to now is 511.5 secs Computing kpt #: 149 total cpu time spent up to now is 514.9 secs Computing kpt #: 150 total cpu time spent up to now is 518.3 secs Computing kpt #: 151 total cpu time spent up to now is 521.6 secs Computing kpt #: 152 total cpu time spent up to now is 525.0 secs Computing kpt #: 153 total cpu time spent up to now is 528.2 secs Computing kpt #: 154 total cpu time spent up to now is 531.5 secs Computing kpt #: 155 total cpu time spent up to now is 534.9 secs Computing kpt #: 156 total cpu time spent up to now is 538.3 secs Computing kpt #: 157 total cpu time spent up to now is 541.5 secs Computing kpt #: 158 total cpu time spent up to now is 544.9 secs Computing kpt #: 159 total cpu time spent up to now is 548.3 secs Computing kpt #: 160 total cpu time spent up to now is 551.7 secs Computing kpt #: 161 total cpu time spent up to now is 555.0 secs Computing kpt #: 162 total cpu time spent up to now is 558.8 secs Computing kpt #: 163 total cpu time spent up to now is 562.4 secs Computing kpt #: 164 total cpu time spent up to now is 566.3 secs Computing kpt #: 165 total cpu time spent up to now is 570.1 secs Computing kpt #: 166 total cpu time spent up to now is 573.6 secs Computing kpt #: 167 total cpu time spent up to now is 577.6 secs Computing kpt #: 168 total cpu time spent up to now is 581.5 secs Computing kpt #: 169 total cpu time spent up to now is 585.4 secs Computing kpt #: 170 total cpu time spent up to now is 589.3 secs Computing kpt #: 171 total cpu time spent up to now is 593.7 secs Computing kpt #: 172 total cpu time spent up to now is 597.2 secs Computing kpt #: 173 total cpu time spent up to now is 600.9 secs Computing kpt #: 174 total cpu time spent up to now is 604.7 secs Computing kpt #: 175 total cpu time spent up to now is 608.4 secs Computing kpt #: 176 total cpu time spent up to now is 612.2 secs Computing kpt #: 177 total cpu time spent up to now is 615.9 secs Computing kpt #: 178 total cpu time spent up to now is 619.6 secs Computing kpt #: 179 total cpu time spent up to now is 623.9 secs Computing kpt #: 180 total cpu time spent up to now is 627.7 secs Computing kpt #: 181 total cpu time spent up to now is 631.3 secs Computing kpt #: 182 total cpu time spent up to now is 635.0 secs Computing kpt #: 183 total cpu time spent up to now is 638.6 secs Computing kpt #: 184 total cpu time spent up to now is 642.1 secs Computing kpt #: 185 total cpu time spent up to now is 645.9 secs Computing kpt #: 186 total cpu time spent up to now is 650.5 secs Computing kpt #: 187 total cpu time spent up to now is 654.7 secs Computing kpt #: 188 total cpu time spent up to now is 659.2 secs Computing kpt #: 189 total cpu time spent up to now is 663.7 secs Computing kpt #: 190 total cpu time spent up to now is 667.5 secs Computing kpt #: 191 total cpu time spent up to now is 672.1 secs Computing kpt #: 192 total cpu time spent up to now is 677.3 secs Computing kpt #: 193 total cpu time spent up to now is 681.8 secs Computing kpt #: 194 total cpu time spent up to now is 687.0 secs Computing kpt #: 195 total cpu time spent up to now is 692.1 secs Computing kpt #: 196 total cpu time spent up to now is 696.7 secs Computing kpt #: 197 total cpu time spent up to now is 701.2 secs Computing kpt #: 198 total cpu time spent up to now is 704.8 secs Computing kpt #: 199 total cpu time spent up to now is 709.8 secs Computing kpt #: 200 total cpu time spent up to now is 713.3 secs Computing kpt #: 201 total cpu time spent up to now is 716.7 secs Computing kpt #: 202 total cpu time spent up to now is 719.9 secs Computing kpt #: 203 total cpu time spent up to now is 723.3 secs Computing kpt #: 204 total cpu time spent up to now is 726.6 secs Computing kpt #: 205 total cpu time spent up to now is 729.8 secs Computing kpt #: 206 total cpu time spent up to now is 733.0 secs Computing kpt #: 207 total cpu time spent up to now is 736.5 secs Computing kpt #: 208 total cpu time spent up to now is 739.6 secs Computing kpt #: 209 total cpu time spent up to now is 742.7 secs Computing kpt #: 210 total cpu time spent up to now is 745.8 secs ethr = 1.56E-08, avg # of iterations = 31.7 total cpu time spent up to now is 745.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 21595 PWs) bands (ev): -15.1329 -15.1329 -15.0822 -15.0822 -11.9689 -11.9689 -10.9464 -10.9464 -10.9403 -10.9403 -10.9403 -10.9403 -10.5297 -10.5297 -10.5297 -10.5297 -4.8384 -4.8384 -4.1096 -4.1096 -3.9535 -3.9535 -2.8618 -2.8618 -2.8618 -2.8618 -2.6465 -2.6465 -2.6465 -2.6465 -1.0671 -1.0671 -0.9217 -0.9217 -0.9217 -0.9217 0.6342 0.6342 0.8433 0.8433 0.8433 0.8433 1.3883 1.3883 1.3883 1.3883 1.5054 1.5054 1.5054 1.5054 1.5654 1.5654 1.7976 1.7976 2.0047 2.0047 2.0047 2.0047 2.2234 2.2234 2.2938 2.2938 2.2938 2.2938 4.1541 4.1541 8.4189 8.4189 8.5442 8.5442 8.5442 8.5442 8.6367 8.6367 8.6367 8.6367 k = 0.0161-0.0093 0.0132 ( 21691 PWs) bands (ev): -15.1328 -15.1328 -15.0822 -15.0822 -11.9689 -11.9689 -10.9464 -10.9464 -10.9403 -10.9403 -10.9403 -10.9403 -10.5300 -10.5300 -10.5296 -10.5296 -4.8379 -4.8379 -4.1091 -4.1091 -3.9533 -3.9533 -2.8612 -2.8612 -2.8610 -2.8610 -2.6461 -2.6461 -2.6459 -2.6459 -1.0671 -1.0671 -0.9220 -0.9220 -0.9220 -0.9220 0.6339 0.6339 0.8420 0.8420 0.8429 0.8429 1.3866 1.3866 1.3883 1.3883 1.5049 1.5049 1.5052 1.5052 1.5650 1.5650 1.7966 1.7966 2.0029 2.0029 2.0041 2.0041 2.2225 2.2225 2.2926 2.2926 2.2934 2.2934 4.1567 4.1567 8.4206 8.4206 8.5459 8.5459 8.5459 8.5459 8.6395 8.6395 8.6395 8.6395 k = 0.0323-0.0186 0.0263 ( 21763 PWs) bands (ev): -15.1326 -15.1326 -15.0823 -15.0823 -11.9688 -11.9688 -10.9465 -10.9465 -10.9405 -10.9405 -10.9404 -10.9404 -10.5308 -10.5308 -10.5296 -10.5296 -4.8365 -4.8365 -4.1078 -4.1078 -3.9526 -3.9526 -2.8595 -2.8595 -2.8583 -2.8583 -2.6449 -2.6449 -2.6444 -2.6444 -1.0670 -1.0670 -0.9228 -0.9228 -0.9227 -0.9227 0.6330 0.6330 0.8383 0.8383 0.8418 0.8418 1.3815 1.3815 1.3882 1.3882 1.5035 1.5035 1.5043 1.5043 1.5637 1.5637 1.7937 1.7937 1.9975 1.9975 2.0021 2.0021 2.2200 2.2200 2.2891 2.2891 2.2921 2.2921 4.1641 4.1641 8.4255 8.4255 8.5511 8.5511 8.5512 8.5512 8.6477 8.6477 8.6479 8.6479 k = 0.0484-0.0279 0.0395 ( 21779 PWs) bands (ev): -15.1323 -15.1323 -15.0824 -15.0824 -11.9686 -11.9686 -10.9467 -10.9467 -10.9407 -10.9407 -10.9405 -10.9405 -10.5323 -10.5323 -10.5295 -10.5295 -4.8341 -4.8341 -4.1055 -4.1055 -3.9515 -3.9515 -2.8565 -2.8565 -2.8539 -2.8539 -2.6429 -2.6429 -2.6418 -2.6418 -1.0669 -1.0669 -0.9242 -0.9242 -0.9240 -0.9240 0.6314 0.6314 0.8321 0.8321 0.8398 0.8398 1.3730 1.3730 1.3880 1.3880 1.5011 1.5011 1.5030 1.5030 1.5616 1.5616 1.7887 1.7887 1.9887 1.9887 1.9988 1.9988 2.2157 2.2157 2.2833 2.2833 2.2901 2.2901 4.1765 4.1765 8.4336 8.4336 8.5597 8.5597 8.5600 8.5600 8.6613 8.6613 8.6617 8.6617 k = 0.0645-0.0372 0.0527 ( 21791 PWs) bands (ev): -15.1319 -15.1319 -15.0826 -15.0826 -11.9684 -11.9684 -10.9469 -10.9469 -10.9410 -10.9410 -10.9406 -10.9406 -10.5344 -10.5344 -10.5294 -10.5294 -4.8309 -4.8309 -4.1023 -4.1023 -3.9499 -3.9499 -2.8524 -2.8524 -2.8478 -2.8478 -2.6401 -2.6401 -2.6382 -2.6382 -1.0668 -1.0668 -0.9261 -0.9261 -0.9257 -0.9257 0.6290 0.6290 0.8237 0.8237 0.8371 0.8371 1.3612 1.3612 1.3877 1.3877 1.4977 1.4977 1.5011 1.5011 1.5588 1.5588 1.7815 1.7815 1.9769 1.9769 1.9942 1.9942 2.2094 2.2094 2.2752 2.2752 2.2876 2.2876 4.1935 4.1935 8.4449 8.4449 8.5716 8.5716 8.5721 8.5721 8.6802 8.6802 8.6809 8.6809 k = 0.0806-0.0466 0.0658 ( 21803 PWs) bands (ev): -15.1313 -15.1313 -15.0828 -15.0828 -11.9682 -11.9682 -10.9472 -10.9472 -10.9414 -10.9414 -10.9408 -10.9408 -10.5370 -10.5370 -10.5292 -10.5292 -4.8267 -4.8267 -4.0983 -4.0983 -3.9479 -3.9479 -2.8471 -2.8471 -2.8399 -2.8399 -2.6366 -2.6366 -2.6336 -2.6336 -1.0666 -1.0666 -0.9286 -0.9286 -0.9278 -0.9278 0.6256 0.6256 0.8134 0.8134 0.8337 0.8337 1.3462 1.3462 1.3874 1.3874 1.4934 1.4934 1.4988 1.4988 1.5552 1.5552 1.7720 1.7720 1.9625 1.9625 1.9883 1.9883 2.2011 2.2011 2.2650 2.2650 2.2849 2.2849 4.2149 4.2149 8.4592 8.4592 8.5868 8.5868 8.5874 8.5874 8.7044 8.7044 8.7052 8.7052 k = 0.0968-0.0559 0.0790 ( 21787 PWs) bands (ev): -15.1306 -15.1306 -15.0831 -15.0831 -11.9679 -11.9679 -10.9475 -10.9475 -10.9419 -10.9419 -10.9409 -10.9409 -10.5401 -10.5401 -10.5291 -10.5291 -4.8218 -4.8218 -4.0935 -4.0935 -3.9455 -3.9455 -2.8408 -2.8408 -2.8305 -2.8305 -2.6323 -2.6323 -2.6280 -2.6280 -1.0664 -1.0664 -0.9316 -0.9316 -0.9303 -0.9303 0.6209 0.6209 0.8016 0.8016 0.8295 0.8295 1.3283 1.3283 1.3870 1.3870 1.4882 1.4882 1.4961 1.4961 1.5511 1.5511 1.7599 1.7599 1.9462 1.9462 1.9813 1.9813 2.1906 2.1906 2.2528 2.2528 2.2822 2.2822 4.2403 4.2403 8.4764 8.4764 8.6051 8.6051 8.6058 8.6058 8.7336 8.7336 8.7344 8.7344 k = 0.1129-0.0652 0.0922 ( 21787 PWs) bands (ev): -15.1299 -15.1299 -15.0834 -15.0834 -11.9675 -11.9675 -10.9479 -10.9479 -10.9425 -10.9425 -10.9411 -10.9411 -10.5437 -10.5437 -10.5288 -10.5288 -4.8160 -4.8160 -4.0879 -4.0879 -3.9426 -3.9426 -2.8335 -2.8335 -2.8194 -2.8194 -2.6274 -2.6274 -2.6216 -2.6216 -1.0660 -1.0660 -0.9352 -0.9352 -0.9331 -0.9331 0.6145 0.6145 0.7888 0.7888 0.8247 0.8247 1.3075 1.3075 1.3865 1.3865 1.4822 1.4822 1.4931 1.4931 1.5465 1.5465 1.7449 1.7449 1.9286 1.9286 1.9730 1.9730 2.1779 2.1779 2.2387 2.2387 2.2796 2.2796 4.2695 4.2695 8.4963 8.4963 8.6264 8.6264 8.6271 8.6271 8.7677 8.7677 8.7683 8.7683 k = 0.1290-0.0745 0.1054 ( 21763 PWs) bands (ev): -15.1290 -15.1290 -15.0837 -15.0837 -11.9671 -11.9671 -10.9484 -10.9484 -10.9431 -10.9431 -10.9413 -10.9413 -10.5478 -10.5478 -10.5286 -10.5286 -4.8095 -4.8095 -4.0815 -4.0815 -3.9395 -3.9395 -2.8251 -2.8251 -2.8068 -2.8068 -2.6218 -2.6218 -2.6144 -2.6144 -1.0656 -1.0656 -0.9392 -0.9392 -0.9361 -0.9361 0.6060 0.6060 0.7756 0.7756 0.8191 0.8191 1.2841 1.2841 1.3859 1.3859 1.4755 1.4755 1.4898 1.4898 1.5415 1.5415 1.7268 1.7268 1.9104 1.9104 1.9636 1.9636 2.1631 2.1631 2.2228 2.2228 2.2772 2.2772 4.3019 4.3019 8.5186 8.5186 8.6505 8.6505 8.6509 8.6509 8.8065 8.8065 8.8067 8.8067 k = 0.1452-0.0838 0.1185 ( 21739 PWs) bands (ev): -15.1280 -15.1280 -15.0841 -15.0841 -11.9667 -11.9667 -10.9489 -10.9489 -10.9438 -10.9438 -10.9415 -10.9415 -10.5523 -10.5523 -10.5283 -10.5283 -4.8024 -4.8024 -4.0745 -4.0745 -3.9360 -3.9360 -2.8159 -2.8159 -2.7928 -2.7928 -2.6156 -2.6156 -2.6064 -2.6064 -1.0651 -1.0651 -0.9438 -0.9438 -0.9393 -0.9393 0.5949 0.5949 0.7629 0.7629 0.8129 0.8129 1.2583 1.2583 1.3853 1.3853 1.4679 1.4679 1.4863 1.4863 1.5362 1.5362 1.7055 1.7055 1.8922 1.8922 1.9532 1.9532 2.1464 2.1464 2.2054 2.2054 2.2749 2.2749 4.3371 4.3371 8.5433 8.5433 8.6771 8.6771 8.6772 8.6772 8.8495 8.8495 8.8498 8.8498 k = 0.1613-0.0931 0.1317 ( 21727 PWs) bands (ev): -15.1270 -15.1270 -15.0845 -15.0845 -11.9662 -11.9662 -10.9495 -10.9495 -10.9445 -10.9445 -10.9416 -10.9416 -10.5572 -10.5572 -10.5281 -10.5281 -4.7947 -4.7947 -4.0670 -4.0670 -3.9322 -3.9322 -2.8059 -2.8059 -2.7775 -2.7775 -2.6087 -2.6087 -2.5977 -2.5977 -1.0645 -1.0645 -0.9488 -0.9488 -0.9426 -0.9426 0.5805 0.5805 0.7513 0.7513 0.8061 0.8061 1.2303 1.2303 1.3847 1.3847 1.4598 1.4598 1.4827 1.4827 1.5308 1.5308 1.6810 1.6810 1.8745 1.8745 1.9418 1.9418 2.1281 2.1281 2.1866 2.1866 2.2729 2.2729 4.3748 4.3748 8.5699 8.5699 8.7053 8.7053 8.7063 8.7063 8.8963 8.8963 8.8972 8.8972 k = 0.1774-0.1024 0.1449 ( 21723 PWs) bands (ev): -15.1259 -15.1259 -15.0849 -15.0849 -11.9657 -11.9657 -10.9501 -10.9501 -10.9453 -10.9453 -10.9417 -10.9417 -10.5625 -10.5625 -10.5278 -10.5278 -4.7864 -4.7864 -4.0589 -4.0589 -3.9281 -3.9281 -2.7951 -2.7951 -2.7609 -2.7609 -2.6014 -2.6014 -2.5884 -2.5884 -1.0638 -1.0638 -0.9543 -0.9543 -0.9458 -0.9458 0.5627 0.5627 0.7412 0.7412 0.7987 0.7987 1.2005 1.2005 1.3839 1.3839 1.4511 1.4511 1.4790 1.4790 1.5254 1.5254 1.6534 1.6534 1.8575 1.8575 1.9295 1.9295 2.1082 2.1082 2.1667 2.1667 2.2710 2.2710 4.4144 4.4144 8.5982 8.5982 8.7353 8.7353 8.7377 8.7377 8.9470 8.9470 8.9485 8.9485 k = 0.1935-0.1117 0.1580 ( 21691 PWs) bands (ev): -15.1247 -15.1247 -15.0854 -15.0854 -11.9652 -11.9652 -10.9508 -10.9508 -10.9462 -10.9462 -10.9418 -10.9418 -10.5681 -10.5681 -10.5274 -10.5274 -4.7778 -4.7778 -4.0503 -4.0503 -3.9238 -3.9238 -2.7837 -2.7837 -2.7431 -2.7431 -2.5936 -2.5936 -2.5786 -2.5786 -1.0630 -1.0630 -0.9602 -0.9602 -0.9490 -0.9490 0.5415 0.5415 0.7331 0.7331 0.7908 0.7908 1.1691 1.1691 1.3831 1.3831 1.4420 1.4420 1.4755 1.4755 1.5200 1.5200 1.6232 1.6232 1.8413 1.8413 1.9164 1.9164 2.0872 2.0872 2.1457 2.1457 2.2692 2.2692 4.4556 4.4556 8.6280 8.6280 8.7665 8.7665 8.7712 8.7712 9.0015 9.0015 9.0033 9.0033 k = 0.2097-0.1211 0.1712 ( 21695 PWs) bands (ev): -15.1235 -15.1235 -15.0859 -15.0859 -11.9646 -11.9646 -10.9515 -10.9515 -10.9470 -10.9470 -10.9418 -10.9418 -10.5739 -10.5739 -10.5271 -10.5271 -4.7688 -4.7688 -4.0414 -4.0414 -3.9193 -3.9193 -2.7718 -2.7718 -2.7244 -2.7244 -2.5855 -2.5855 -2.5684 -2.5684 -1.0622 -1.0622 -0.9664 -0.9664 -0.9519 -0.9519 0.5172 0.5172 0.7267 0.7267 0.7825 0.7825 1.1364 1.1364 1.3821 1.3821 1.4326 1.4326 1.4720 1.4720 1.5148 1.5148 1.5909 1.5909 1.8261 1.8261 1.9026 1.9026 2.0651 2.0651 2.1240 2.1240 2.2675 2.2675 4.4978 4.4978 8.6588 8.6588 8.7988 8.7988 8.8065 8.8065 9.0594 9.0594 9.0613 9.0613 k = 0.2258-0.1304 0.1844 ( 21707 PWs) bands (ev): -15.1222 -15.1222 -15.0863 -15.0863 -11.9641 -11.9641 -10.9523 -10.9523 -10.9479 -10.9479 -10.9417 -10.9417 -10.5799 -10.5799 -10.5268 -10.5268 -4.7596 -4.7596 -4.0322 -4.0322 -3.9146 -3.9146 -2.7594 -2.7594 -2.7049 -2.7049 -2.5770 -2.5770 -2.5579 -2.5579 -1.0613 -1.0613 -0.9730 -0.9730 -0.9546 -0.9546 0.4902 0.4902 0.7220 0.7220 0.7737 0.7737 1.1027 1.1027 1.3809 1.3809 1.4231 1.4231 1.4686 1.4686 1.5099 1.5099 1.5571 1.5571 1.8116 1.8116 1.8882 1.8882 2.0424 2.0424 2.1018 2.1018 2.2659 2.2659 4.5406 4.5406 8.6904 8.6904 8.8317 8.8317 8.8436 8.8436 9.1206 9.1206 9.1220 9.1220 k = 0.2419-0.1397 0.1975 ( 21723 PWs) bands (ev): -15.1209 -15.1209 -15.0868 -15.0868 -11.9635 -11.9635 -10.9530 -10.9530 -10.9488 -10.9488 -10.9416 -10.9416 -10.5860 -10.5860 -10.5264 -10.5264 -4.7502 -4.7502 -4.0228 -4.0228 -3.9099 -3.9099 -2.7468 -2.7468 -2.6847 -2.6847 -2.5683 -2.5683 -2.5471 -2.5471 -1.0605 -1.0605 -0.9799 -0.9799 -0.9568 -0.9568 0.4611 0.4611 0.7187 0.7187 0.7647 0.7647 1.0684 1.0684 1.3795 1.3795 1.4137 1.4137 1.4653 1.4653 1.5053 1.5053 1.5226 1.5226 1.7978 1.7978 1.8734 1.8734 2.0191 2.0191 2.0792 2.0792 2.2644 2.2644 4.5837 4.5837 8.7224 8.7224 8.8647 8.8647 8.8822 8.8822 9.1848 9.1848 9.1850 9.1850 k = 0.2581-0.1490 0.2107 ( 21707 PWs) bands (ev): -15.1197 -15.1197 -15.0873 -15.0873 -11.9630 -11.9630 -10.9538 -10.9538 -10.9497 -10.9497 -10.9414 -10.9414 -10.5923 -10.5923 -10.5261 -10.5261 -4.7408 -4.7408 -4.0134 -4.0134 -3.9051 -3.9051 -2.7339 -2.7339 -2.6640 -2.6640 -2.5594 -2.5594 -2.5363 -2.5363 -1.0598 -1.0598 -0.9870 -0.9870 -0.9585 -0.9585 0.4305 0.4305 0.7164 0.7164 0.7554 0.7554 1.0337 1.0337 1.3774 1.3774 1.4048 1.4048 1.4611 1.4611 1.4887 1.4887 1.5012 1.5012 1.7847 1.7847 1.8582 1.8582 1.9955 1.9955 2.0565 2.0565 2.2630 2.2630 4.6264 4.6264 8.7544 8.7544 8.8977 8.8977 8.9222 8.9222 9.2498 9.2498 9.2517 9.2517 k = 0.2742-0.1583 0.2239 ( 21724 PWs) bands (ev): -15.1184 -15.1184 -15.0878 -15.0878 -11.9624 -11.9624 -10.9546 -10.9546 -10.9506 -10.9506 -10.9412 -10.9412 -10.5985 -10.5985 -10.5257 -10.5257 -4.7314 -4.7314 -4.0039 -4.0039 -3.9003 -3.9003 -2.7210 -2.7210 -2.6430 -2.6430 -2.5504 -2.5504 -2.5254 -2.5254 -1.0592 -1.0592 -0.9942 -0.9942 -0.9595 -0.9595 0.3989 0.3989 0.7150 0.7150 0.7459 0.7459 0.9991 0.9991 1.3742 1.3742 1.3971 1.3971 1.4456 1.4456 1.4665 1.4665 1.4975 1.4975 1.7722 1.7722 1.8429 1.8429 1.9719 1.9719 2.0339 2.0339 2.2616 2.2616 4.6686 4.6686 8.7861 8.7861 8.9301 8.9301 8.9635 8.9635 9.3158 9.3158 9.3208 9.3208 k = 0.2903-0.1676 0.2370 ( 21708 PWs) bands (ev): -15.1171 -15.1171 -15.0883 -15.0883 -11.9619 -11.9619 -10.9553 -10.9553 -10.9515 -10.9515 -10.9409 -10.9409 -10.6047 -10.6047 -10.5254 -10.5254 -4.7222 -4.7222 -3.9946 -3.9946 -3.8956 -3.8956 -2.7082 -2.7082 -2.6219 -2.6219 -2.5414 -2.5414 -2.5147 -2.5147 -1.0588 -1.0588 -1.0015 -1.0015 -0.9599 -0.9599 0.3669 0.3669 0.7144 0.7144 0.7363 0.7363 0.9648 0.9648 1.3694 1.3694 1.3913 1.3913 1.4135 1.4135 1.4620 1.4620 1.4943 1.4943 1.7603 1.7603 1.8276 1.8276 1.9485 1.9485 2.0116 2.0116 2.2603 2.2603 4.7096 4.7096 8.8170 8.8170 8.9616 8.9616 9.0060 9.0060 9.3825 9.3825 9.3918 9.3918 k = 0.3065-0.1769 0.2502 ( 21716 PWs) bands (ev): -15.1159 -15.1159 -15.0888 -15.0888 -11.9613 -11.9613 -10.9561 -10.9561 -10.9524 -10.9524 -10.9405 -10.9405 -10.6108 -10.6108 -10.5251 -10.5251 -4.7132 -4.7132 -3.9855 -3.9855 -3.8909 -3.8909 -2.6955 -2.6955 -2.6010 -2.6010 -2.5325 -2.5325 -2.5042 -2.5042 -1.0587 -1.0587 -1.0088 -1.0088 -0.9595 -0.9595 0.3350 0.3350 0.7142 0.7142 0.7267 0.7267 0.9312 0.9312 1.3627 1.3627 1.3799 1.3799 1.3876 1.3876 1.4602 1.4602 1.4917 1.4917 1.7491 1.7491 1.8125 1.8125 1.9254 1.9254 1.9898 1.9898 2.2591 2.2591 4.7493 4.7493 8.8467 8.8467 8.9919 8.9919 9.0493 9.0493 9.4491 9.4491 9.4642 9.4642 k = 0.3226-0.1862 0.2634 ( 21700 PWs) bands (ev): -15.1147 -15.1147 -15.0892 -15.0892 -11.9608 -11.9608 -10.9568 -10.9568 -10.9532 -10.9532 -10.9401 -10.9401 -10.6167 -10.6167 -10.5248 -10.5248 -4.7045 -4.7045 -3.9766 -3.9766 -3.8864 -3.8864 -2.6833 -2.6833 -2.5804 -2.5804 -2.5238 -2.5238 -2.4941 -2.4941 -1.0590 -1.0590 -1.0160 -1.0160 -0.9583 -0.9583 0.3035 0.3035 0.7144 0.7144 0.7172 0.7172 0.8987 0.8987 1.3473 1.3473 1.3550 1.3550 1.3853 1.3853 1.4593 1.4593 1.4895 1.4895 1.7385 1.7385 1.7978 1.7978 1.9030 1.9030 1.9687 1.9687 2.2579 2.2579 4.7872 4.7872 8.8751 8.8751 9.0207 9.0207 9.0933 9.0933 9.5150 9.5150 9.5375 9.5375 k = 0.3387-0.1956 0.2766 ( 21672 PWs) bands (ev): -15.1136 -15.1136 -15.0897 -15.0897 -11.9603 -11.9603 -10.9575 -10.9575 -10.9540 -10.9540 -10.9396 -10.9396 -10.6224 -10.6224 -10.5245 -10.5245 -4.6963 -4.6963 -3.9682 -3.9682 -3.8820 -3.8820 -2.6715 -2.6715 -2.5605 -2.5605 -2.5153 -2.5153 -2.4844 -2.4844 -1.0595 -1.0595 -1.0230 -1.0230 -0.9564 -0.9564 0.2730 0.2730 0.7078 0.7078 0.7150 0.7150 0.8678 0.8678 1.3161 1.3161 1.3471 1.3471 1.3837 1.3837 1.4591 1.4591 1.4879 1.4879 1.7286 1.7286 1.7836 1.7836 1.8814 1.8814 1.9484 1.9484 2.2569 2.2569 4.8229 4.8229 8.9017 8.9017 9.0476 9.0476 9.1377 9.1377 9.5794 9.5794 9.6110 9.6110 k = 0.3548-0.2049 0.2897 ( 21676 PWs) bands (ev): -15.1125 -15.1125 -15.0901 -15.0901 -11.9599 -11.9599 -10.9582 -10.9582 -10.9547 -10.9547 -10.9392 -10.9392 -10.6278 -10.6278 -10.5242 -10.5242 -4.6886 -4.6886 -3.9602 -3.9602 -3.8779 -3.8779 -2.6603 -2.6603 -2.5417 -2.5417 -2.5071 -2.5071 -2.4752 -2.4752 -1.0602 -1.0602 -1.0297 -1.0297 -0.9540 -0.9540 0.2439 0.2439 0.6986 0.6986 0.7158 0.7158 0.8386 0.8386 1.2869 1.2869 1.3393 1.3393 1.3826 1.3826 1.4593 1.4593 1.4867 1.4867 1.7195 1.7195 1.7701 1.7701 1.8607 1.8607 1.9292 1.9292 2.2559 2.2559 4.8562 4.8562 8.9263 8.9263 9.0726 9.0726 9.1819 9.1819 9.6415 9.6415 9.6840 9.6840 k = 0.3710-0.2142 0.3029 ( 21684 PWs) bands (ev): -15.1116 -15.1116 -15.0904 -15.0904 -11.9595 -11.9595 -10.9588 -10.9588 -10.9554 -10.9554 -10.9387 -10.9387 -10.6328 -10.6328 -10.5239 -10.5239 -4.6814 -4.6814 -3.9529 -3.9529 -3.8741 -3.8741 -2.6499 -2.6499 -2.5241 -2.5241 -2.4991 -2.4991 -2.4668 -2.4668 -1.0612 -1.0612 -1.0361 -1.0361 -0.9510 -0.9510 0.2165 0.2165 0.6897 0.6897 0.7167 0.7167 0.8118 0.8118 1.2599 1.2599 1.3320 1.3320 1.3818 1.3818 1.4601 1.4601 1.4860 1.4860 1.7112 1.7112 1.7576 1.7576 1.8414 1.8414 1.9112 1.9112 2.2550 2.2550 4.8868 4.8868 8.9488 8.9488 9.0953 9.0953 9.2255 9.2255 9.7005 9.7005 9.7555 9.7555 k = 0.3871-0.2235 0.3161 ( 21680 PWs) bands (ev): -15.1107 -15.1107 -15.0908 -15.0908 -11.9591 -11.9591 -10.9594 -10.9594 -10.9560 -10.9560 -10.9382 -10.9382 -10.6374 -10.6374 -10.5237 -10.5237 -4.6750 -4.6750 -3.9461 -3.9461 -3.8707 -3.8707 -2.6404 -2.6404 -2.5086 -2.5086 -2.4912 -2.4912 -2.4590 -2.4590 -1.0623 -1.0623 -1.0419 -1.0419 -0.9478 -0.9478 0.1913 0.1913 0.6810 0.6810 0.7177 0.7177 0.7876 0.7876 1.2354 1.2354 1.3252 1.3252 1.3811 1.3811 1.4612 1.4612 1.4857 1.4857 1.7037 1.7037 1.7463 1.7463 1.8234 1.8234 1.8946 1.8946 2.2541 2.2541 4.9144 4.9144 8.9688 8.9688 9.1157 9.1157 9.2676 9.2676 9.7555 9.7555 9.8246 9.8246 k = 0.4032-0.2328 0.3292 ( 21716 PWs) bands (ev): -15.1099 -15.1099 -15.0911 -15.0911 -11.9587 -11.9587 -10.9599 -10.9599 -10.9566 -10.9566 -10.9377 -10.9377 -10.6415 -10.6415 -10.5235 -10.5235 -4.6692 -4.6692 -3.9402 -3.9402 -3.8676 -3.8676 -2.6319 -2.6319 -2.4962 -2.4962 -2.4824 -2.4824 -2.4522 -2.4522 -1.0634 -1.0634 -1.0472 -1.0472 -0.9445 -0.9445 0.1686 0.1686 0.6728 0.6728 0.7187 0.7187 0.7664 0.7664 1.2136 1.2136 1.3192 1.3192 1.3806 1.3806 1.4625 1.4625 1.4856 1.4856 1.6972 1.6972 1.7361 1.7361 1.8072 1.8072 1.8797 1.8797 2.2534 2.2534 4.9388 4.9388 8.9864 8.9864 9.1335 9.1335 9.3075 9.3075 9.8056 9.8056 9.8900 9.8900 k = 0.4194-0.2421 0.3424 ( 21716 PWs) bands (ev): -15.1092 -15.1092 -15.0913 -15.0913 -11.9585 -11.9585 -10.9603 -10.9603 -10.9571 -10.9571 -10.9373 -10.9373 -10.6451 -10.6451 -10.5233 -10.5233 -4.6642 -4.6642 -3.9350 -3.9350 -3.8649 -3.8649 -2.6245 -2.6245 -2.4875 -2.4875 -2.4725 -2.4725 -2.4462 -2.4462 -1.0645 -1.0645 -1.0519 -1.0519 -0.9413 -0.9413 0.1488 0.1488 0.6651 0.6651 0.7196 0.7196 0.7484 0.7484 1.1949 1.1949 1.3139 1.3139 1.3801 1.3801 1.4641 1.4641 1.4858 1.4858 1.6916 1.6916 1.7274 1.7274 1.7928 1.7928 1.8666 1.8666 2.2528 2.2528 4.9598 4.9598 9.0014 9.0014 9.1487 9.1487 9.3442 9.3442 9.8499 9.8499 9.9503 9.9503 k = 0.4355-0.2514 0.3556 ( 21688 PWs) bands (ev): -15.1086 -15.1086 -15.0916 -15.0916 -11.9582 -11.9582 -10.9606 -10.9606 -10.9575 -10.9575 -10.9369 -10.9369 -10.6481 -10.6481 -10.5231 -10.5231 -4.6601 -4.6601 -3.9307 -3.9307 -3.8626 -3.8626 -2.6182 -2.6182 -2.4816 -2.4816 -2.4628 -2.4628 -2.4412 -2.4412 -1.0655 -1.0655 -1.0558 -1.0558 -0.9383 -0.9383 0.1321 0.1321 0.6580 0.6580 0.7204 0.7204 0.7339 0.7339 1.1793 1.1793 1.3096 1.3096 1.3798 1.3798 1.4656 1.4656 1.4861 1.4861 1.6870 1.6870 1.7202 1.7202 1.7807 1.7807 1.8555 1.8555 2.2523 2.2523 4.9772 4.9772 9.0137 9.0137 9.1613 9.1613 9.3764 9.3764 9.8875 9.8875 10.0039 10.0039 k = 0.4516-0.2607 0.3687 ( 21692 PWs) bands (ev): -15.1082 -15.1082 -15.0917 -15.0917 -11.9580 -11.9580 -10.9609 -10.9609 -10.9578 -10.9578 -10.9366 -10.9366 -10.6504 -10.6504 -10.5230 -10.5230 -4.6568 -4.6568 -3.9272 -3.9272 -3.8608 -3.8608 -2.6133 -2.6133 -2.4774 -2.4774 -2.4545 -2.4545 -2.4373 -2.4373 -1.0664 -1.0664 -1.0589 -1.0589 -0.9358 -0.9358 0.1188 0.1188 0.6519 0.6519 0.7212 0.7212 0.7229 0.7229 1.1670 1.1670 1.3061 1.3061 1.3795 1.3795 1.4671 1.4671 1.4864 1.4864 1.6835 1.6835 1.7146 1.7146 1.7709 1.7709 1.8466 1.8466 2.2519 2.2519 4.9908 4.9908 9.0234 9.0234 9.1710 9.1710 9.4031 9.4031 9.9177 9.9177 10.0488 10.0488 k = 0.4677-0.2701 0.3819 ( 21676 PWs) bands (ev): -15.1078 -15.1078 -15.0918 -15.0918 -11.9579 -11.9579 -10.9611 -10.9611 -10.9580 -10.9580 -10.9364 -10.9364 -10.6522 -10.6522 -10.5229 -10.5229 -4.6545 -4.6545 -3.9248 -3.9248 -3.8595 -3.8595 -2.6098 -2.6098 -2.4745 -2.4745 -2.4483 -2.4483 -2.4345 -2.4345 -1.0670 -1.0670 -1.0612 -1.0612 -0.9340 -0.9340 0.1092 0.1092 0.6471 0.6471 0.7153 0.7153 0.7217 0.7217 1.1581 1.1581 1.3036 1.3036 1.3794 1.3794 1.4682 1.4682 1.4866 1.4866 1.6809 1.6809 1.7105 1.7105 1.7637 1.7637 1.8401 1.8401 2.2516 2.2516 5.0007 5.0007 9.0303 9.0303 9.1781 9.1781 9.4232 9.4232 9.9398 9.9398 10.0830 10.0830 k = 0.4839-0.2794 0.3951 ( 21704 PWs) bands (ev): -15.1076 -15.1076 -15.0919 -15.0919 -11.9578 -11.9578 -10.9612 -10.9612 -10.9581 -10.9581 -10.9362 -10.9362 -10.6532 -10.6532 -10.5229 -10.5229 -4.6531 -4.6531 -3.9233 -3.9233 -3.8587 -3.8587 -2.6076 -2.6076 -2.4728 -2.4728 -2.4445 -2.4445 -2.4327 -2.4327 -1.0674 -1.0674 -1.0626 -1.0626 -0.9328 -0.9328 0.1034 0.1034 0.6441 0.6441 0.7108 0.7108 0.7220 0.7220 1.1527 1.1527 1.3021 1.3021 1.3793 1.3793 1.4689 1.4689 1.4868 1.4868 1.6794 1.6794 1.7081 1.7081 1.7593 1.7593 1.8361 1.8361 2.2514 2.2514 5.0066 5.0066 9.0344 9.0344 9.1823 9.1823 9.4356 9.4356 9.9533 9.9533 10.1045 10.1045 k = 0.5000-0.2887 0.4082 ( 21732 PWs) bands (ev): -15.1076 -15.1076 -15.0919 -15.0919 -11.9578 -11.9578 -10.9613 -10.9613 -10.9582 -10.9582 -10.9362 -10.9362 -10.6535 -10.6535 -10.5229 -10.5229 -4.6526 -4.6526 -3.9228 -3.9228 -3.8585 -3.8585 -2.6069 -2.6069 -2.4723 -2.4723 -2.4433 -2.4433 -2.4322 -2.4322 -1.0676 -1.0676 -1.0630 -1.0630 -0.9324 -0.9324 0.1014 0.1014 0.6431 0.6431 0.7093 0.7093 0.7221 0.7221 1.1509 1.1509 1.3016 1.3016 1.3792 1.3792 1.4692 1.4692 1.4869 1.4869 1.6789 1.6789 1.7073 1.7073 1.7578 1.7578 1.8348 1.8348 2.2514 2.2514 5.0086 5.0086 9.0358 9.0358 9.1837 9.1837 9.4399 9.4399 9.9578 9.9578 10.1119 10.1119 k = 0.5000-0.2887 0.4082 ( 21732 PWs) bands (ev): -15.1076 -15.1076 -15.0919 -15.0919 -11.9578 -11.9578 -10.9613 -10.9613 -10.9582 -10.9582 -10.9362 -10.9362 -10.6535 -10.6535 -10.5229 -10.5229 -4.6526 -4.6526 -3.9228 -3.9228 -3.8585 -3.8585 -2.6069 -2.6069 -2.4723 -2.4723 -2.4433 -2.4433 -2.4322 -2.4322 -1.0676 -1.0676 -1.0630 -1.0630 -0.9324 -0.9324 0.1014 0.1014 0.6431 0.6431 0.7093 0.7093 0.7221 0.7221 1.1509 1.1509 1.3016 1.3016 1.3792 1.3792 1.4692 1.4692 1.4869 1.4869 1.6789 1.6789 1.7073 1.7073 1.7578 1.7578 1.8348 1.8348 2.2514 2.2514 5.0086 5.0086 9.0358 9.0358 9.1837 9.1837 9.4399 9.4399 9.9578 9.9578 10.1119 10.1119 k = 0.5000-0.2706 0.4210 ( 21698 PWs) bands (ev): -15.1075 -15.1075 -15.0920 -15.0920 -11.9578 -11.9578 -10.9613 -10.9613 -10.9582 -10.9582 -10.9362 -10.9362 -10.6532 -10.6532 -10.5231 -10.5231 -4.6526 -4.6526 -3.9226 -3.9226 -3.8586 -3.8586 -2.6065 -2.6065 -2.4724 -2.4724 -2.4435 -2.4435 -2.4323 -2.4323 -1.0676 -1.0676 -1.0630 -1.0630 -0.9327 -0.9327 0.1024 0.1024 0.6428 0.6428 0.7096 0.7096 0.7209 0.7209 1.1533 1.1533 1.3019 1.3019 1.3755 1.3755 1.4700 1.4700 1.4881 1.4881 1.6784 1.6784 1.7068 1.7068 1.7585 1.7585 1.8354 1.8354 2.2505 2.2505 5.0088 5.0088 9.0353 9.0353 9.1831 9.1831 9.4399 9.4399 9.9590 9.9590 10.1131 10.1131 k = 0.5000-0.2526 0.4338 ( 21686 PWs) bands (ev): -15.1074 -15.1074 -15.0921 -15.0921 -11.9577 -11.9577 -10.9615 -10.9615 -10.9583 -10.9583 -10.9364 -10.9364 -10.6522 -10.6522 -10.5237 -10.5237 -4.6527 -4.6527 -3.9222 -3.9222 -3.8589 -3.8589 -2.6055 -2.6055 -2.4726 -2.4726 -2.4441 -2.4441 -2.4328 -2.4328 -1.0676 -1.0676 -1.0626 -1.0626 -0.9337 -0.9337 0.1054 0.1054 0.6414 0.6414 0.7098 0.7098 0.7185 0.7185 1.1601 1.1601 1.3026 1.3026 1.3654 1.3654 1.4710 1.4710 1.4921 1.4921 1.6768 1.6768 1.7056 1.7056 1.7606 1.7606 1.8374 1.8374 2.2480 2.2480 5.0093 5.0093 9.0336 9.0336 9.1815 9.1815 9.4401 9.4401 9.9623 9.9623 10.1167 10.1167 k = 0.5000-0.2345 0.4465 ( 21682 PWs) bands (ev): -15.1072 -15.1072 -15.0923 -15.0923 -11.9577 -11.9577 -10.9619 -10.9619 -10.9583 -10.9583 -10.9367 -10.9367 -10.6505 -10.6505 -10.5247 -10.5247 -4.6528 -4.6528 -3.9215 -3.9215 -3.8594 -3.8594 -2.6037 -2.6037 -2.4731 -2.4731 -2.4453 -2.4453 -2.4334 -2.4334 -1.0680 -1.0680 -1.0616 -1.0616 -0.9354 -0.9354 0.1104 0.1104 0.6378 0.6378 0.7071 0.7071 0.7193 0.7193 1.1710 1.1710 1.3038 1.3038 1.3508 1.3508 1.4704 1.4704 1.4991 1.4991 1.6738 1.6738 1.7040 1.7040 1.7636 1.7636 1.8410 1.8410 2.2437 2.2437 5.0101 5.0101 9.0304 9.0304 9.1796 9.1796 9.4402 9.4402 9.9676 9.9676 10.1230 10.1230 k = 0.5000-0.2165 0.4593 ( 21670 PWs) bands (ev): -15.1070 -15.1070 -15.0925 -15.0925 -11.9576 -11.9576 -10.9626 -10.9626 -10.9582 -10.9582 -10.9370 -10.9370 -10.6482 -10.6482 -10.5262 -10.5262 -4.6529 -4.6529 -3.9206 -3.9206 -3.8602 -3.8602 -2.6012 -2.6012 -2.4738 -2.4738 -2.4471 -2.4471 -2.4341 -2.4341 -1.0689 -1.0689 -1.0599 -1.0599 -0.9377 -0.9377 0.1174 0.1174 0.6300 0.6300 0.7030 0.7030 0.7242 0.7242 1.1854 1.1854 1.3054 1.3054 1.3332 1.3332 1.4679 1.4679 1.5078 1.5078 1.6691 1.6691 1.7024 1.7024 1.7671 1.7671 1.8465 1.8465 2.2378 2.2378 5.0112 5.0112 9.0251 9.0251 9.1782 9.1782 9.4400 9.4400 9.9747 9.9747 10.1327 10.1327 k = 0.5000-0.1985 0.4720 ( 21674 PWs) bands (ev): -15.1067 -15.1067 -15.0929 -15.0929 -11.9576 -11.9576 -10.9635 -10.9635 -10.9579 -10.9579 -10.9375 -10.9375 -10.6453 -10.6453 -10.5280 -10.5280 -4.6531 -4.6531 -3.9194 -3.9194 -3.8611 -3.8611 -2.5981 -2.5981 -2.4747 -2.4747 -2.4496 -2.4496 -2.4347 -2.4347 -1.0702 -1.0702 -1.0576 -1.0576 -0.9407 -0.9407 0.1262 0.1262 0.6171 0.6171 0.7004 0.7004 0.7321 0.7321 1.2024 1.2024 1.3064 1.3064 1.3147 1.3147 1.4642 1.4642 1.5168 1.5168 1.6622 1.6622 1.7012 1.7012 1.7705 1.7705 1.8544 1.8544 2.2303 2.2303 5.0125 5.0125 9.0175 9.0175 9.1784 9.1784 9.4394 9.4394 9.9832 9.9832 10.1464 10.1464 k = 0.5000-0.1804 0.4848 ( 21674 PWs) bands (ev): -15.1063 -15.1063 -15.0933 -15.0933 -11.9575 -11.9575 -10.9646 -10.9646 -10.9574 -10.9574 -10.9381 -10.9381 -10.6419 -10.6419 -10.5302 -10.5302 -4.6533 -4.6533 -3.9180 -3.9180 -3.8622 -3.8622 -2.5943 -2.5943 -2.4760 -2.4760 -2.4527 -2.4527 -2.4352 -2.4352 -1.0717 -1.0717 -1.0547 -1.0547 -0.9442 -0.9442 0.1370 0.1370 0.5993 0.5993 0.6997 0.6997 0.7427 0.7427 1.2215 1.2215 1.2908 1.2908 1.3120 1.3120 1.4595 1.4595 1.5256 1.5256 1.6533 1.6533 1.7003 1.7003 1.7733 1.7733 1.8649 1.8649 2.2211 2.2211 5.0140 5.0140 9.0074 9.0074 9.1809 9.1809 9.4380 9.4380 9.9927 9.9927 10.1648 10.1648 k = 0.5000-0.1624 0.4976 ( 21672 PWs) bands (ev): -15.1058 -15.1058 -15.0937 -15.0937 -11.9574 -11.9574 -10.9659 -10.9659 -10.9568 -10.9568 -10.9387 -10.9387 -10.6382 -10.6382 -10.5326 -10.5326 -4.6536 -4.6536 -3.9164 -3.9164 -3.8635 -3.8635 -2.5899 -2.5899 -2.4776 -2.4776 -2.4561 -2.4561 -2.4356 -2.4356 -1.0734 -1.0734 -1.0512 -1.0512 -0.9482 -0.9482 0.1496 0.1496 0.5778 0.5778 0.7001 0.7001 0.7558 0.7558 1.2410 1.2410 1.2697 1.2697 1.3155 1.3155 1.4539 1.4539 1.5338 1.5338 1.6423 1.6423 1.6999 1.6999 1.7753 1.7753 1.8779 1.8779 2.2104 2.2104 5.0156 5.0156 8.9952 8.9952 9.1858 9.1858 9.4356 9.4356 10.0031 10.0031 10.1885 10.1885 k = 0.5000-0.1443 0.5103 ( 21668 PWs) bands (ev): -15.1053 -15.1053 -15.0942 -15.0942 -11.9573 -11.9573 -10.9672 -10.9672 -10.9561 -10.9561 -10.9395 -10.9395 -10.6341 -10.6341 -10.5354 -10.5354 -4.6538 -4.6538 -3.9147 -3.9147 -3.8649 -3.8649 -2.5850 -2.5850 -2.4799 -2.4799 -2.4596 -2.4596 -2.4359 -2.4359 -1.0752 -1.0752 -1.0473 -1.0473 -0.9527 -0.9527 0.1640 0.1640 0.5537 0.5537 0.7012 0.7012 0.7712 0.7712 1.2408 1.2408 1.2682 1.2682 1.3200 1.3200 1.4475 1.4475 1.5412 1.5412 1.6297 1.6297 1.6997 1.6997 1.7765 1.7765 1.8932 1.8932 2.1982 2.1982 5.0173 5.0173 8.9815 8.9815 9.1932 9.1932 9.4318 9.4318 10.0142 10.0142 10.2180 10.2180 k = 0.5000-0.1263 0.5231 ( 21680 PWs) bands (ev): -15.1047 -15.1047 -15.0948 -15.0948 -11.9572 -11.9572 -10.9685 -10.9685 -10.9554 -10.9554 -10.9403 -10.9403 -10.6298 -10.6298 -10.5384 -10.5384 -4.6540 -4.6540 -3.9129 -3.9129 -3.8664 -3.8664 -2.5795 -2.5795 -2.4829 -2.4829 -2.4628 -2.4628 -2.4361 -2.4361 -1.0770 -1.0770 -1.0429 -1.0429 -0.9576 -0.9576 0.1802 0.1802 0.5278 0.5278 0.7025 0.7025 0.7884 0.7884 1.2181 1.2181 1.2893 1.2893 1.3255 1.3255 1.4405 1.4405 1.5475 1.5475 1.6156 1.6156 1.6997 1.6997 1.7771 1.7771 1.9105 1.9105 2.1846 2.1846 5.0191 5.0191 8.9671 8.9671 9.2026 9.2026 9.4266 9.4266 10.0261 10.0261 10.2531 10.2531 k = 0.5000-0.1083 0.5358 ( 21688 PWs) bands (ev): -15.1041 -15.1041 -15.0954 -15.0954 -11.9571 -11.9571 -10.9698 -10.9698 -10.9545 -10.9545 -10.9412 -10.9412 -10.6254 -10.6254 -10.5416 -10.5416 -4.6542 -4.6542 -3.9110 -3.9110 -3.8680 -3.8680 -2.5736 -2.5736 -2.4870 -2.4870 -2.4655 -2.4655 -2.4362 -2.4362 -1.0787 -1.0787 -1.0382 -1.0382 -0.9628 -0.9628 0.1979 0.1979 0.5008 0.5008 0.7039 0.7039 0.8070 0.8070 1.1940 1.1940 1.3114 1.3114 1.3325 1.3325 1.4330 1.4330 1.5523 1.5523 1.6006 1.6006 1.6998 1.6998 1.7772 1.7772 1.9293 1.9293 2.1697 2.1697 5.0207 5.0207 8.9529 8.9529 9.2138 9.2138 9.4200 9.4200 10.0388 10.0388 10.2428 10.2428 k = 0.5000-0.0902 0.5486 ( 21684 PWs) bands (ev): -15.1035 -15.1035 -15.0961 -15.0961 -11.9570 -11.9570 -10.9710 -10.9710 -10.9536 -10.9536 -10.9421 -10.9421 -10.6211 -10.6211 -10.5448 -10.5448 -4.6544 -4.6544 -3.9091 -3.9091 -3.8695 -3.8695 -2.5674 -2.5674 -2.4921 -2.4921 -2.4676 -2.4676 -2.4364 -2.4364 -1.0803 -1.0803 -1.0331 -1.0331 -0.9684 -0.9684 0.2172 0.2172 0.4732 0.4732 0.7052 0.7052 0.8264 0.8264 1.1699 1.1699 1.3297 1.3297 1.3443 1.3443 1.4250 1.4250 1.5543 1.5543 1.5863 1.5863 1.6999 1.6999 1.7771 1.7771 1.9492 1.9492 2.1536 2.1536 5.0223 5.0223 8.9396 8.9396 9.2260 9.2260 9.4120 9.4120 10.0526 10.0526 10.2265 10.2265 k = 0.5000-0.0722 0.5613 ( 21690 PWs) bands (ev): -15.1028 -15.1028 -15.0968 -15.0968 -11.9569 -11.9569 -10.9720 -10.9720 -10.9527 -10.9527 -10.9431 -10.9431 -10.6169 -10.6169 -10.5480 -10.5480 -4.6546 -4.6546 -3.9074 -3.9074 -3.8710 -3.8710 -2.5609 -2.5609 -2.4979 -2.4979 -2.4691 -2.4691 -2.4365 -2.4365 -1.0817 -1.0817 -1.0279 -1.0279 -0.9740 -0.9740 0.2380 0.2380 0.4453 0.4453 0.7064 0.7064 0.8457 0.8457 1.1467 1.1467 1.3403 1.3403 1.3641 1.3641 1.4170 1.4170 1.5497 1.5497 1.5768 1.5768 1.7000 1.7000 1.7768 1.7768 1.9698 1.9698 2.1363 2.1363 5.0236 5.0236 8.9279 8.9279 9.2387 9.2387 9.4031 9.4031 10.0674 10.0674 10.2092 10.2092 k = 0.5000-0.0541 0.5741 ( 21702 PWs) bands (ev): -15.1021 -15.1021 -15.0975 -15.0975 -11.9569 -11.9569 -10.9728 -10.9728 -10.9517 -10.9517 -10.9440 -10.9440 -10.6133 -10.6133 -10.5508 -10.5508 -4.6548 -4.6548 -3.9058 -3.9058 -3.8724 -3.8724 -2.5543 -2.5543 -2.5040 -2.5040 -2.4701 -2.4701 -2.4365 -2.4365 -1.0828 -1.0828 -1.0225 -1.0225 -0.9797 -0.9797 0.2600 0.2600 0.4176 0.4176 0.7073 0.7073 0.8640 0.8640 1.1256 1.1256 1.3483 1.3483 1.3859 1.3859 1.4092 1.4092 1.5363 1.5363 1.5746 1.5746 1.7001 1.7001 1.7764 1.7764 1.9908 1.9908 2.1182 2.1182 5.0247 5.0247 8.9183 8.9183 9.2510 9.2510 9.3939 9.3939 10.0833 10.0833 10.1913 10.1913 k = 0.5000-0.0361 0.5869 ( 21700 PWs) bands (ev): -15.1013 -15.1013 -15.0983 -15.0983 -11.9568 -11.9568 -10.9734 -10.9734 -10.9508 -10.9508 -10.9449 -10.9449 -10.6104 -10.6104 -10.5532 -10.5532 -4.6549 -4.6549 -3.9046 -3.9046 -3.8735 -3.8735 -2.5480 -2.5480 -2.5101 -2.5101 -2.4708 -2.4708 -2.4366 -2.4366 -1.0837 -1.0837 -1.0174 -1.0174 -0.9851 -0.9851 0.2830 0.2830 0.3904 0.3904 0.7081 0.7081 0.8797 0.8797 1.1078 1.1078 1.3556 1.3556 1.3988 1.3988 1.4097 1.4097 1.5196 1.5196 1.5751 1.5751 1.7002 1.7002 1.7761 1.7761 2.0117 2.0117 2.0994 2.0994 5.0255 5.0255 8.9111 8.9111 9.2619 9.2619 9.3853 9.3853 10.1000 10.1000 10.1729 10.1729 k = 0.5000-0.0180 0.5996 ( 21700 PWs) bands (ev): -15.1006 -15.1006 -15.0990 -15.0990 -11.9568 -11.9568 -10.9738 -10.9738 -10.9501 -10.9501 -10.9457 -10.9457 -10.6084 -10.6084 -10.5548 -10.5548 -4.6549 -4.6549 -3.9038 -3.9038 -3.8742 -3.8742 -2.5427 -2.5427 -2.5153 -2.5153 -2.4711 -2.4711 -2.4366 -2.4366 -1.0842 -1.0842 -1.0131 -1.0131 -0.9895 -0.9895 0.3062 0.3062 0.3647 0.3647 0.7085 0.7085 0.8906 0.8906 1.0957 1.0957 1.3617 1.3617 1.3936 1.3936 1.4262 1.4262 1.5042 1.5042 1.5758 1.5758 1.7002 1.7002 1.7759 1.7759 2.0315 2.0315 2.0810 2.0810 5.0260 5.0260 8.9067 8.9067 9.2696 9.2696 9.3790 9.3790 10.1176 10.1176 10.1543 10.1543 k = 0.5000-0.0000 0.6124 ( 21692 PWs) bands (ev): -15.0998 -15.0998 -15.0998 -15.0998 -11.9568 -11.9568 -10.9739 -10.9739 -10.9498 -10.9498 -10.9460 -10.9460 -10.6077 -10.6077 -10.5553 -10.5553 -4.6550 -4.6550 -3.9035 -3.9035 -3.8745 -3.8745 -2.5404 -2.5404 -2.5176 -2.5176 -2.4713 -2.4713 -2.4366 -2.4366 -1.0844 -1.0844 -1.0113 -1.0113 -0.9914 -0.9914 0.3220 0.3220 0.3481 0.3481 0.7086 0.7086 0.8946 0.8946 1.0913 1.0913 1.3645 1.3645 1.3909 1.3909 1.4340 1.4340 1.4971 1.4971 1.5761 1.5761 1.7003 1.7003 1.7759 1.7759 2.0434 2.0434 2.0695 2.0695 5.0262 5.0262 8.9052 8.9052 9.2725 9.2725 9.3766 9.3766 10.1347 10.1347 10.1369 10.1369 k = 0.5000-0.0000 0.6124 ( 21692 PWs) bands (ev): -15.0998 -15.0998 -15.0998 -15.0998 -11.9568 -11.9568 -10.9739 -10.9739 -10.9498 -10.9498 -10.9460 -10.9460 -10.6077 -10.6077 -10.5553 -10.5553 -4.6550 -4.6550 -3.9035 -3.9035 -3.8745 -3.8745 -2.5404 -2.5404 -2.5176 -2.5176 -2.4713 -2.4713 -2.4366 -2.4366 -1.0844 -1.0844 -1.0113 -1.0113 -0.9914 -0.9914 0.3220 0.3220 0.3481 0.3481 0.7086 0.7086 0.8946 0.8946 1.0913 1.0913 1.3645 1.3645 1.3909 1.3909 1.4340 1.4340 1.4971 1.4971 1.5761 1.5761 1.7003 1.7003 1.7759 1.7759 2.0434 2.0434 2.0695 2.0695 5.0262 5.0262 8.9052 8.9052 9.2725 9.2725 9.3766 9.3766 10.1347 10.1347 10.1369 10.1369 k = 0.4886 0.0197 0.6124 ( 21696 PWs) bands (ev): -15.1003 -15.1003 -15.0993 -15.0993 -11.9568 -11.9568 -10.9742 -10.9742 -10.9497 -10.9497 -10.9457 -10.9457 -10.6080 -10.6080 -10.5551 -10.5551 -4.6551 -4.6551 -3.9037 -3.9037 -3.8745 -3.8745 -2.5419 -2.5419 -2.5167 -2.5167 -2.4713 -2.4713 -2.4367 -2.4367 -1.0862 -1.0862 -1.0109 -1.0109 -0.9897 -0.9897 0.3127 0.3127 0.3585 0.3585 0.7084 0.7084 0.8930 0.8930 1.0936 1.0936 1.3629 1.3629 1.3921 1.3921 1.4299 1.4299 1.5008 1.5008 1.5761 1.5761 1.7008 1.7008 1.7766 1.7766 2.0362 2.0362 2.0766 2.0766 5.0257 5.0257 8.9021 8.9021 9.2726 9.2726 9.3791 9.3791 10.1228 10.1228 10.1464 10.1464 k = 0.4773 0.0394 0.6124 ( 21699 PWs) bands (ev): -15.1008 -15.1008 -15.0988 -15.0988 -11.9568 -11.9568 -10.9749 -10.9749 -10.9493 -10.9493 -10.9451 -10.9451 -10.6088 -10.6088 -10.5544 -10.5544 -4.6553 -4.6553 -3.9043 -3.9043 -3.8744 -3.8744 -2.5454 -2.5454 -2.5146 -2.5146 -2.4712 -2.4712 -2.4370 -2.4370 -1.0914 -1.0914 -1.0087 -1.0087 -0.9861 -0.9861 0.2978 0.2978 0.3766 0.3766 0.7077 0.7077 0.8884 0.8884 1.0999 1.0999 1.3592 1.3592 1.3948 1.3948 1.4207 1.4207 1.5091 1.5091 1.5764 1.5764 1.7026 1.7026 1.7789 1.7789 2.0228 2.0228 2.0896 2.0896 5.0242 5.0242 8.8931 8.8931 9.2747 9.2747 9.3851 9.3851 10.1111 10.1111 10.1513 10.1513 k = 0.4659 0.0590 0.6124 ( 21706 PWs) bands (ev): -15.1013 -15.1013 -15.0984 -15.0984 -11.9569 -11.9569 -10.9760 -10.9760 -10.9485 -10.9485 -10.9443 -10.9443 -10.6099 -10.6099 -10.5533 -10.5533 -4.6557 -4.6557 -3.9051 -3.9051 -3.8744 -3.8744 -2.5497 -2.5497 -2.5124 -2.5124 -2.4711 -2.4711 -2.4373 -2.4373 -1.0988 -1.0988 -1.0046 -1.0046 -0.9816 -0.9816 0.2834 0.2834 0.3958 0.3958 0.7065 0.7065 0.8817 0.8817 1.1093 1.1093 1.3545 1.3545 1.3971 1.3971 1.4103 1.4103 1.5183 1.5183 1.5769 1.5769 1.7055 1.7055 1.7827 1.7827 2.0079 2.0079 2.1035 2.1035 5.0221 5.0221 8.8790 8.8790 9.2798 9.2798 9.3930 9.3930 10.1010 10.1010 10.1508 10.1508 k = 0.4545 0.0787 0.6124 ( 21703 PWs) bands (ev): -15.1017 -15.1017 -15.0980 -15.0980 -11.9569 -11.9569 -10.9774 -10.9774 -10.9474 -10.9474 -10.9434 -10.9434 -10.6113 -10.6113 -10.5521 -10.5521 -4.6561 -4.6561 -3.9061 -3.9061 -3.8744 -3.8744 -2.5543 -2.5543 -2.5106 -2.5106 -2.4708 -2.4708 -2.4376 -2.4376 -1.1073 -1.1073 -0.9995 -0.9995 -0.9769 -0.9769 0.2704 0.2704 0.4151 0.4151 0.7046 0.7046 0.8737 0.8737 1.1206 1.1206 1.3496 1.3496 1.3945 1.3945 1.4040 1.4040 1.5268 1.5268 1.5778 1.5778 1.7093 1.7093 1.7879 1.7879 1.9926 1.9926 2.1170 2.1170 5.0195 5.0195 8.8616 8.8616 9.2877 9.2877 9.4017 9.4017 10.0926 10.0926 10.1456 10.1456 k = 0.4432 0.0984 0.6124 ( 21691 PWs) bands (ev): -15.1021 -15.1021 -15.0977 -15.0977 -11.9570 -11.9570 -10.9788 -10.9788 -10.9463 -10.9463 -10.9425 -10.9425 -10.6128 -10.6128 -10.5507 -10.5507 -4.6565 -4.6565 -3.9072 -3.9072 -3.8744 -3.8744 -2.5586 -2.5586 -2.5094 -2.5094 -2.4703 -2.4703 -2.4379 -2.4379 -1.1158 -1.1158 -0.9943 -0.9943 -0.9721 -0.9721 0.2589 0.2589 0.4336 0.4336 0.7023 0.7023 0.8654 0.8654 1.1328 1.1328 1.3449 1.3449 1.3854 1.3854 1.4042 1.4042 1.5339 1.5339 1.5790 1.5790 1.7139 1.7139 1.7944 1.7944 1.9772 1.9772 2.1295 2.1295 5.0168 5.0168 8.8427 8.8427 9.2971 9.2971 9.4108 9.4108 10.0864 10.0864 10.1366 10.1366 k = 0.4318 0.1181 0.6124 ( 21689 PWs) bands (ev): -15.1024 -15.1024 -15.0974 -15.0974 -11.9570 -11.9570 -10.9802 -10.9802 -10.9453 -10.9453 -10.9415 -10.9415 -10.6143 -10.6143 -10.5494 -10.5494 -4.6570 -4.6570 -3.9083 -3.9083 -3.8744 -3.8744 -2.5626 -2.5626 -2.5087 -2.5087 -2.4698 -2.4698 -2.4381 -2.4381 -1.1237 -1.1237 -0.9895 -0.9895 -0.9675 -0.9675 0.2491 0.2491 0.4509 0.4509 0.6995 0.6995 0.8574 0.8574 1.1448 1.1448 1.3405 1.3405 1.3762 1.3762 1.4048 1.4048 1.5395 1.5395 1.5804 1.5804 1.7188 1.7188 1.8021 1.8021 1.9621 1.9621 2.1407 2.1407 5.0140 5.0140 8.8241 8.8241 9.3067 9.3067 9.4196 9.4196 10.0826 10.0826 10.1254 10.1254 k = 0.4205 0.1378 0.6124 ( 21687 PWs) bands (ev): -15.1027 -15.1027 -15.0972 -15.0972 -11.9571 -11.9571 -10.9814 -10.9814 -10.9445 -10.9445 -10.9404 -10.9404 -10.6157 -10.6157 -10.5482 -10.5482 -4.6574 -4.6574 -3.9092 -3.9092 -3.8744 -3.8744 -2.5660 -2.5660 -2.5084 -2.5084 -2.4692 -2.4692 -2.4382 -2.4382 -1.1305 -1.1305 -0.9854 -0.9854 -0.9633 -0.9633 0.2411 0.2411 0.4664 0.4664 0.6964 0.6964 0.8502 0.8502 1.1559 1.1559 1.3368 1.3368 1.3681 1.3681 1.4049 1.4049 1.5436 1.5436 1.5819 1.5819 1.7235 1.7235 1.8105 1.8105 1.9476 1.9476 2.1503 2.1503 5.0115 5.0115 8.8070 8.8070 9.3156 9.3156 9.4280 9.4280 10.0814 10.0814 10.1135 10.1135 k = 0.4091 0.1575 0.6124 ( 21686 PWs) bands (ev): -15.1029 -15.1029 -15.0970 -15.0970 -11.9571 -11.9571 -10.9824 -10.9824 -10.9439 -10.9439 -10.9395 -10.9395 -10.6169 -10.6169 -10.5472 -10.5472 -4.6577 -4.6577 -3.9100 -3.9100 -3.8745 -3.8745 -2.5688 -2.5688 -2.5084 -2.5084 -2.4686 -2.4686 -2.4382 -2.4382 -1.1361 -1.1361 -0.9821 -0.9821 -0.9597 -0.9597 0.2348 0.2348 0.4794 0.4794 0.6934 0.6934 0.8443 0.8443 1.1654 1.1654 1.3337 1.3337 1.3617 1.3617 1.4045 1.4045 1.5466 1.5466 1.5833 1.5833 1.7277 1.7277 1.8193 1.8193 1.9341 1.9341 2.1581 2.1581 5.0093 5.0093 8.7928 8.7928 9.3231 9.3231 9.4353 9.4353 10.0829 10.0829 10.1024 10.1024 k = 0.3977 0.1771 0.6124 ( 21694 PWs) bands (ev): -15.1030 -15.1030 -15.0969 -15.0969 -11.9571 -11.9571 -10.9832 -10.9832 -10.9435 -10.9435 -10.9388 -10.9388 -10.6178 -10.6178 -10.5464 -10.5464 -4.6579 -4.6579 -3.9106 -3.9106 -3.8745 -3.8745 -2.5708 -2.5708 -2.5084 -2.5084 -2.4682 -2.4682 -2.4383 -2.4383 -1.1402 -1.1402 -0.9798 -0.9798 -0.9570 -0.9570 0.2302 0.2302 0.4893 0.4893 0.6909 0.6909 0.8398 0.8398 1.1726 1.1726 1.3314 1.3314 1.3569 1.3569 1.4039 1.4039 1.5486 1.5486 1.5844 1.5844 1.7310 1.7310 1.8276 1.8276 1.9224 1.9224 2.1637 2.1637 5.0077 5.0077 8.7820 8.7820 9.3285 9.3285 9.4410 9.4410 10.0867 10.0867 10.0941 10.0941 k = 0.3864 0.1968 0.6124 ( 21697 PWs) bands (ev): -15.1031 -15.1031 -15.0968 -15.0968 -11.9572 -11.9572 -10.9837 -10.9837 -10.9433 -10.9433 -10.9383 -10.9383 -10.6184 -10.6184 -10.5460 -10.5460 -4.6581 -4.6581 -3.9110 -3.9110 -3.8745 -3.8745 -2.5720 -2.5720 -2.5085 -2.5085 -2.4679 -2.4679 -2.4383 -2.4383 -1.1428 -1.1428 -0.9783 -0.9783 -0.9553 -0.9553 0.2275 0.2275 0.4955 0.4955 0.6891 0.6891 0.8371 0.8371 1.1772 1.1772 1.3300 1.3300 1.3541 1.3541 1.4034 1.4034 1.5497 1.5497 1.5851 1.5851 1.7331 1.7331 1.8340 1.8340 1.9141 1.9141 2.1672 2.1672 5.0066 5.0066 8.7754 8.7754 9.3319 9.3319 9.4447 9.4447 10.0863 10.0863 10.0948 10.0948 k = 0.3750 0.2165 0.6124 ( 21728 PWs) bands (ev): -15.1032 -15.1032 -15.0968 -15.0968 -11.9572 -11.9572 -10.9838 -10.9838 -10.9432 -10.9432 -10.9381 -10.9381 -10.6186 -10.6186 -10.5458 -10.5458 -4.6582 -4.6582 -3.9111 -3.9111 -3.8745 -3.8745 -2.5725 -2.5725 -2.5086 -2.5086 -2.4678 -2.4678 -2.4383 -2.4383 -1.1436 -1.1436 -0.9779 -0.9779 -0.9547 -0.9547 0.2266 0.2266 0.4976 0.4976 0.6885 0.6885 0.8361 0.8361 1.1788 1.1788 1.3295 1.3295 1.3531 1.3531 1.4032 1.4032 1.5500 1.5500 1.5853 1.5853 1.7338 1.7338 1.8365 1.8365 1.9109 1.9109 2.1683 2.1683 5.0063 5.0063 8.7732 8.7732 9.3330 9.3330 9.4460 9.4460 10.0846 10.0846 10.0982 10.0982 k = 0.3750 0.2165 0.6124 ( 21728 PWs) bands (ev): -15.1032 -15.1032 -15.0968 -15.0968 -11.9572 -11.9572 -10.9838 -10.9838 -10.9432 -10.9432 -10.9381 -10.9381 -10.6186 -10.6186 -10.5458 -10.5458 -4.6582 -4.6582 -3.9111 -3.9111 -3.8745 -3.8745 -2.5725 -2.5725 -2.5086 -2.5086 -2.4678 -2.4678 -2.4383 -2.4383 -1.1436 -1.1436 -0.9779 -0.9779 -0.9547 -0.9547 0.2266 0.2266 0.4976 0.4976 0.6885 0.6885 0.8361 0.8361 1.1788 1.1788 1.3295 1.3295 1.3531 1.3531 1.4032 1.4032 1.5500 1.5500 1.5853 1.5853 1.7338 1.7338 1.8365 1.8365 1.9109 1.9109 2.1683 2.1683 5.0063 5.0063 8.7732 8.7732 9.3330 9.3330 9.4460 9.4460 10.0846 10.0846 10.0982 10.0982 k = 0.3636 0.2099 0.5938 ( 21700 PWs) bands (ev): -15.1024 -15.1024 -15.0977 -15.0977 -11.9572 -11.9572 -10.9866 -10.9866 -10.9436 -10.9436 -10.9353 -10.9353 -10.6135 -10.6135 -10.5493 -10.5493 -4.6598 -4.6598 -3.9103 -3.9103 -3.8777 -3.8777 -2.5687 -2.5687 -2.5181 -2.5181 -2.4703 -2.4703 -2.4401 -2.4401 -1.1540 -1.1540 -0.9777 -0.9777 -0.9442 -0.9442 0.2496 0.2496 0.4773 0.4773 0.6879 0.6879 0.8597 0.8597 1.1576 1.1576 1.3354 1.3354 1.3775 1.3775 1.3946 1.3946 1.5333 1.5333 1.5895 1.5895 1.7403 1.7403 1.8488 1.8488 1.9247 1.9247 2.1575 2.1575 5.0012 5.0012 8.7323 8.7323 9.3356 9.3356 9.4640 9.4640 10.0394 10.0394 10.1171 10.1171 k = 0.3523 0.2034 0.5753 ( 21688 PWs) bands (ev): -15.1016 -15.1016 -15.0986 -15.0986 -11.9572 -11.9572 -10.9891 -10.9891 -10.9443 -10.9443 -10.9323 -10.9323 -10.6084 -10.6084 -10.5528 -10.5528 -4.6617 -4.6617 -3.9101 -3.9101 -3.8810 -3.8810 -2.5657 -2.5657 -2.5281 -2.5281 -2.4732 -2.4732 -2.4424 -2.4424 -1.1639 -1.1639 -0.9806 -0.9806 -0.9304 -0.9304 0.2741 0.2741 0.4586 0.4586 0.6877 0.6877 0.8844 0.8844 1.1375 1.1375 1.3411 1.3411 1.3819 1.3819 1.4065 1.4065 1.5158 1.5158 1.5941 1.5941 1.7473 1.7473 1.8615 1.8615 1.9392 1.9392 2.1471 2.1471 4.9943 4.9943 8.6927 8.6927 9.3277 9.3277 9.4884 9.4884 9.9913 9.9913 10.1263 10.1263 k = 0.3409 0.1968 0.5567 ( 21720 PWs) bands (ev): -15.1007 -15.1007 -15.0997 -15.0997 -11.9573 -11.9573 -10.9914 -10.9914 -10.9451 -10.9451 -10.9291 -10.9291 -10.6033 -10.6033 -10.5563 -10.5563 -4.6641 -4.6641 -3.9108 -3.9108 -3.8841 -3.8841 -2.5645 -2.5645 -2.5379 -2.5379 -2.4765 -2.4765 -2.4453 -2.4453 -1.1731 -1.1731 -0.9843 -0.9843 -0.9158 -0.9158 0.3000 0.3000 0.4420 0.4420 0.6877 0.6877 0.9099 0.9099 1.1188 1.1188 1.3467 1.3467 1.3741 1.3741 1.4300 1.4300 1.5001 1.5001 1.5981 1.5981 1.7549 1.7549 1.8747 1.8747 1.9544 1.9544 2.1374 2.1374 4.9853 4.9853 8.6548 8.6548 9.3127 9.3127 9.5147 9.5147 9.9410 9.9410 10.1293 10.1293 k = 0.3295 0.1903 0.5381 ( 21720 PWs) bands (ev): -15.1008 -15.1008 -15.0999 -15.0999 -11.9574 -11.9574 -10.9932 -10.9932 -10.9458 -10.9458 -10.9261 -10.9261 -10.5983 -10.5983 -10.5596 -10.5596 -4.6668 -4.6668 -3.9126 -3.9126 -3.8869 -3.8869 -2.5668 -2.5668 -2.5454 -2.5454 -2.4806 -2.4806 -2.4486 -2.4486 -1.1813 -1.1813 -0.9881 -0.9881 -0.9014 -0.9014 0.3271 0.3271 0.4279 0.4279 0.6880 0.6880 0.9360 0.9360 1.1020 1.1020 1.3512 1.3512 1.3677 1.3677 1.4470 1.4470 1.4923 1.4923 1.6012 1.6012 1.7632 1.7632 1.8881 1.8881 1.9702 1.9702 2.1285 2.1285 4.9741 4.9741 8.6192 8.6192 9.2926 9.2926 9.5397 9.5397 9.8890 9.8890 10.1312 10.1312 k = 0.3182 0.1837 0.5196 ( 21700 PWs) bands (ev): -15.1020 -15.1020 -15.0990 -15.0990 -11.9576 -11.9576 -10.9948 -10.9948 -10.9466 -10.9466 -10.9231 -10.9231 -10.5934 -10.5934 -10.5627 -10.5627 -4.6700 -4.6700 -3.9157 -3.9157 -3.8892 -3.8892 -2.5745 -2.5745 -2.5489 -2.5489 -2.4857 -2.4857 -2.4523 -2.4523 -1.1884 -1.1884 -0.9917 -0.9917 -0.8877 -0.8877 0.3544 0.3544 0.4172 0.4172 0.6887 0.6887 0.9625 0.9625 1.0872 1.0872 1.3516 1.3516 1.3665 1.3665 1.4465 1.4465 1.5030 1.5030 1.6033 1.6033 1.7721 1.7721 1.9019 1.9019 1.9864 1.9864 2.1207 2.1207 4.9605 4.9605 8.5862 8.5862 9.2687 9.2687 9.5609 9.5609 9.8356 9.8356 10.1334 10.1334 k = 0.3068 0.1771 0.5010 ( 21670 PWs) bands (ev): -15.1032 -15.1032 -15.0981 -15.0981 -11.9578 -11.9578 -10.9959 -10.9959 -10.9473 -10.9473 -10.9204 -10.9204 -10.5885 -10.5885 -10.5655 -10.5655 -4.6737 -4.6737 -3.9202 -3.9202 -3.8909 -3.8909 -2.5859 -2.5859 -2.5503 -2.5503 -2.4922 -2.4922 -2.4562 -2.4562 -1.1942 -1.1942 -0.9950 -0.9950 -0.8749 -0.8749 0.3793 0.3793 0.4128 0.4128 0.6898 0.6898 0.9893 0.9893 1.0749 1.0749 1.3475 1.3475 1.3709 1.3709 1.4361 1.4361 1.5251 1.5251 1.6043 1.6043 1.7818 1.7818 1.9160 1.9160 2.0029 2.0029 2.1139 2.1139 4.9443 4.9443 8.5562 8.5562 9.2417 9.2417 9.5767 9.5767 9.7811 9.7811 10.1359 10.1359 k = 0.2955 0.1706 0.4825 ( 21682 PWs) bands (ev): -15.1045 -15.1045 -15.0971 -15.0971 -11.9580 -11.9580 -10.9966 -10.9966 -10.9479 -10.9479 -10.9179 -10.9179 -10.5839 -10.5839 -10.5680 -10.5680 -4.6779 -4.6779 -3.9258 -3.9258 -3.8922 -3.8922 -2.5989 -2.5989 -2.5513 -2.5513 -2.5002 -2.5002 -2.4603 -2.4603 -1.1984 -1.1984 -0.9979 -0.9979 -0.8635 -0.8635 0.3903 0.3903 0.4258 0.4258 0.6913 0.6913 1.0163 1.0163 1.0654 1.0654 1.3428 1.3428 1.3769 1.3769 1.4250 1.4250 1.5496 1.5496 1.6044 1.6044 1.7921 1.7921 1.9302 1.9302 2.0195 2.0195 2.1084 2.1084 4.9255 4.9255 8.5294 8.5294 9.2122 9.2122 9.5857 9.5857 9.7259 9.7259 10.1387 10.1387 k = 0.2841 0.1640 0.4639 ( 21689 PWs) bands (ev): -15.1058 -15.1058 -15.0962 -15.0962 -11.9583 -11.9583 -10.9968 -10.9968 -10.9484 -10.9484 -10.9157 -10.9157 -10.5794 -10.5794 -10.5701 -10.5701 -4.6826 -4.6826 -3.9325 -3.9325 -3.8935 -3.8935 -2.6126 -2.6126 -2.5529 -2.5529 -2.5098 -2.5098 -2.4647 -2.4647 -1.2011 -1.2011 -1.0003 -1.0003 -0.8537 -0.8537 0.3910 0.3910 0.4526 0.4526 0.6932 0.6932 1.0430 1.0430 1.0592 1.0592 1.3389 1.3389 1.3831 1.3831 1.4159 1.4159 1.5741 1.5741 1.6039 1.6039 1.8032 1.8032 1.9447 1.9447 2.0361 2.0361 2.1041 2.1041 4.9041 4.9041 8.5059 8.5059 9.1805 9.1805 9.5867 9.5867 9.6700 9.6700 10.1407 10.1407 k = 0.2727 0.1575 0.4454 ( 21701 PWs) bands (ev): -15.1072 -15.1072 -15.0953 -15.0953 -11.9587 -11.9587 -10.9967 -10.9967 -10.9489 -10.9489 -10.9139 -10.9139 -10.5751 -10.5751 -10.5717 -10.5717 -4.6878 -4.6878 -3.9399 -3.9399 -3.8947 -3.8947 -2.6269 -2.6269 -2.5552 -2.5552 -2.5209 -2.5209 -2.4693 -2.4693 -1.2020 -1.2020 -1.0022 -1.0022 -0.8456 -0.8456 0.3922 0.3922 0.4821 0.4821 0.6956 0.6956 1.0547 1.0547 1.0709 1.0709 1.3360 1.3360 1.3887 1.3887 1.4104 1.4104 1.5949 1.5949 1.6062 1.6062 1.8148 1.8148 1.9592 1.9592 2.0526 2.0526 2.1014 2.1014 4.8800 4.8800 8.4859 8.4859 9.1472 9.1472 9.5788 9.5788 9.6139 9.6139 10.0891 10.0891 k = 0.2614 0.1509 0.4268 ( 21697 PWs) bands (ev): -15.1086 -15.1086 -15.0944 -15.0944 -11.9591 -11.9591 -10.9960 -10.9960 -10.9492 -10.9492 -10.9125 -10.9125 -10.5729 -10.5729 -10.5710 -10.5710 -4.6935 -4.6935 -3.9479 -3.9479 -3.8961 -3.8961 -2.6414 -2.6414 -2.5585 -2.5585 -2.5334 -2.5334 -2.4744 -2.4744 -1.2012 -1.2012 -1.0036 -1.0036 -0.8394 -0.8394 0.3958 0.3958 0.5118 0.5118 0.6985 0.6985 1.0549 1.0549 1.0973 1.0973 1.3342 1.3342 1.3925 1.3925 1.4098 1.4098 1.5972 1.5972 1.6256 1.6256 1.8270 1.8270 1.9737 1.9737 2.0688 2.0688 2.1002 2.1002 4.8533 4.8533 8.4692 8.4692 9.1124 9.1124 9.5570 9.5570 9.5620 9.5620 9.9845 9.9845 k = 0.2500 0.1443 0.4082 ( 21693 PWs) bands (ev): -15.1101 -15.1101 -15.0935 -15.0935 -11.9595 -11.9595 -10.9950 -10.9950 -10.9495 -10.9495 -10.9116 -10.9116 -10.5735 -10.5735 -10.5670 -10.5670 -4.6997 -4.6997 -3.9564 -3.9564 -3.8978 -3.8978 -2.6560 -2.6560 -2.5635 -2.5635 -2.5462 -2.5462 -2.4801 -2.4801 -1.1986 -1.1986 -1.0045 -1.0045 -0.8352 -0.8352 0.4022 0.4022 0.5409 0.5409 0.7020 0.7020 1.0582 1.0582 1.1235 1.1235 1.3336 1.3336 1.3954 1.3954 1.4140 1.4140 1.5947 1.5947 1.6487 1.6487 1.8397 1.8397 1.9881 1.9881 2.0842 2.0842 2.1011 2.1011 4.8241 4.8241 8.4559 8.4559 9.0766 9.0766 9.5011 9.5011 9.5348 9.5348 9.8818 9.8818 k = 0.2386 0.1378 0.3897 ( 21699 PWs) bands (ev): -15.1116 -15.1116 -15.0926 -15.0926 -11.9600 -11.9600 -10.9935 -10.9935 -10.9496 -10.9496 -10.9111 -10.9111 -10.5736 -10.5736 -10.5633 -10.5633 -4.7065 -4.7065 -3.9654 -3.9654 -3.8997 -3.8997 -2.6708 -2.6708 -2.5723 -2.5723 -2.5572 -2.5572 -2.4865 -2.4865 -1.1943 -1.1943 -1.0048 -1.0048 -0.8331 -0.8331 0.4113 0.4113 0.5687 0.5687 0.7063 0.7063 1.0647 1.0647 1.1492 1.1492 1.3341 1.3341 1.3999 1.3999 1.4203 1.4203 1.5913 1.5913 1.6714 1.6714 1.8526 1.8526 2.0023 2.0023 2.0964 2.0964 2.1065 2.1065 4.7927 4.7927 8.4457 8.4457 9.0400 9.0400 9.4450 9.4450 9.4989 9.4989 9.7821 9.7821 k = 0.2273 0.1312 0.3711 ( 21697 PWs) bands (ev): -15.1131 -15.1131 -15.0917 -15.0917 -11.9605 -11.9605 -10.9917 -10.9917 -10.9497 -10.9497 -10.9110 -10.9110 -10.5732 -10.5732 -10.5598 -10.5598 -4.7136 -4.7136 -3.9747 -3.9747 -3.9018 -3.9018 -2.6854 -2.6854 -2.5864 -2.5864 -2.5645 -2.5645 -2.4936 -2.4936 -1.1883 -1.1883 -1.0046 -1.0046 -0.8328 -0.8328 0.4230 0.4230 0.5947 0.5947 0.7114 0.7114 1.0743 1.0743 1.1742 1.1742 1.3360 1.3360 1.4077 1.4077 1.4276 1.4276 1.5875 1.5875 1.6933 1.6933 1.8657 1.8657 2.0162 2.0162 2.1028 2.1028 2.1190 2.1190 4.7590 4.7590 8.4385 8.4385 9.0030 9.0030 9.3891 9.3891 9.4546 9.4546 9.6859 9.6859 k = 0.2159 0.1247 0.3526 ( 21709 PWs) bands (ev): -15.1146 -15.1146 -15.0908 -15.0908 -11.9611 -11.9611 -10.9896 -10.9896 -10.9497 -10.9497 -10.9114 -10.9114 -10.5722 -10.5722 -10.5566 -10.5566 -4.7212 -4.7212 -3.9842 -3.9842 -3.9043 -3.9043 -2.7000 -2.7000 -2.6034 -2.6034 -2.5702 -2.5702 -2.5014 -2.5014 -1.1808 -1.1808 -1.0039 -1.0039 -0.8344 -0.8344 0.4370 0.4370 0.6183 0.6183 0.7176 0.7176 1.0869 1.0869 1.1982 1.1982 1.3393 1.3393 1.4190 1.4190 1.4355 1.4355 1.5835 1.5835 1.7144 1.7144 1.8787 1.8787 2.0297 2.0297 2.1089 2.1089 2.1334 2.1334 4.7235 4.7235 8.4339 8.4339 8.9658 8.9658 9.3336 9.3336 9.4031 9.4031 9.5932 9.5932 k = 0.2045 0.1181 0.3340 ( 21713 PWs) bands (ev): -15.1161 -15.1161 -15.0900 -15.0900 -11.9616 -11.9616 -10.9871 -10.9871 -10.9495 -10.9495 -10.9122 -10.9122 -10.5708 -10.5708 -10.5535 -10.5535 -4.7291 -4.7291 -3.9938 -3.9938 -3.9069 -3.9069 -2.7143 -2.7143 -2.6217 -2.6217 -2.5757 -2.5757 -2.5100 -2.5100 -1.1720 -1.1720 -1.0026 -1.0026 -0.8377 -0.8377 0.4530 0.4530 0.6392 0.6392 0.7252 0.7252 1.1021 1.1021 1.2211 1.2211 1.3442 1.3442 1.4331 1.4331 1.4447 1.4447 1.5795 1.5795 1.7346 1.7346 1.8916 1.8916 2.0427 2.0427 2.1163 2.1163 2.1476 2.1476 4.6863 4.6863 8.4318 8.4318 8.9287 8.9287 9.2786 9.2786 9.3458 9.3458 9.5039 9.5039 k = 0.1932 0.1115 0.3155 ( 21715 PWs) bands (ev): -15.1175 -15.1175 -15.0892 -15.0892 -11.9622 -11.9622 -10.9843 -10.9843 -10.9493 -10.9493 -10.9134 -10.9134 -10.5689 -10.5689 -10.5506 -10.5506 -4.7373 -4.7373 -4.0036 -4.0036 -3.9099 -3.9099 -2.7283 -2.7283 -2.6408 -2.6408 -2.5812 -2.5812 -2.5192 -2.5192 -1.1621 -1.1621 -1.0008 -1.0008 -0.8424 -0.8424 0.4704 0.4704 0.6571 0.6571 0.7341 0.7341 1.1197 1.1197 1.2424 1.2424 1.3506 1.3506 1.4456 1.4456 1.4595 1.4595 1.5756 1.5756 1.7539 1.7539 1.9041 1.9041 2.0553 2.0553 2.1254 2.1254 2.1615 2.1615 4.6477 4.6477 8.4316 8.4316 8.8920 8.8920 9.2243 9.2243 9.2843 9.2843 9.4180 9.4180 k = 0.1818 0.1050 0.2969 ( 21707 PWs) bands (ev): -15.1190 -15.1190 -15.0884 -15.0884 -11.9628 -11.9628 -10.9813 -10.9813 -10.9490 -10.9490 -10.9149 -10.9149 -10.5666 -10.5666 -10.5480 -10.5480 -4.7458 -4.7458 -4.0133 -4.0133 -3.9130 -3.9130 -2.7419 -2.7419 -2.6604 -2.6604 -2.5867 -2.5867 -2.5289 -2.5289 -1.1514 -1.1514 -0.9986 -0.9986 -0.8483 -0.8483 0.4889 0.4889 0.6724 0.6724 0.7442 0.7442 1.1391 1.1391 1.2620 1.2620 1.3586 1.3586 1.4542 1.4542 1.4814 1.4814 1.5720 1.5720 1.7723 1.7723 1.9160 1.9160 2.0677 2.0677 2.1360 2.1360 2.1748 2.1748 4.6081 4.6081 8.4331 8.4331 8.8557 8.8557 9.1708 9.1708 9.2202 9.2202 9.3353 9.3353 k = 0.1705 0.0984 0.2784 ( 21715 PWs) bands (ev): -15.1205 -15.1205 -15.0877 -15.0877 -11.9634 -11.9634 -10.9782 -10.9782 -10.9486 -10.9486 -10.9167 -10.9167 -10.5640 -10.5640 -10.5455 -10.5455 -4.7543 -4.7543 -4.0230 -4.0230 -3.9163 -3.9163 -2.7551 -2.7551 -2.6801 -2.6801 -2.5923 -2.5923 -2.5391 -2.5391 -1.1401 -1.1401 -0.9958 -0.9958 -0.8550 -0.8550 0.5079 0.5079 0.6854 0.6854 0.7551 0.7551 1.1600 1.1600 1.2797 1.2797 1.3682 1.3682 1.4616 1.4616 1.5071 1.5071 1.5690 1.5690 1.7899 1.7899 1.9273 1.9273 2.0802 2.0802 2.1478 2.1478 2.1875 2.1875 4.5678 4.5678 8.4358 8.4358 8.8202 8.8202 9.1182 9.1182 9.1549 9.1549 9.2558 9.2558 k = 0.1591 0.0919 0.2598 ( 21719 PWs) bands (ev): -15.1219 -15.1219 -15.0870 -15.0870 -11.9640 -11.9640 -10.9749 -10.9749 -10.9481 -10.9481 -10.9188 -10.9188 -10.5611 -10.5611 -10.5433 -10.5433 -4.7629 -4.7629 -4.0324 -4.0324 -3.9197 -3.9197 -2.7678 -2.7678 -2.6997 -2.6997 -2.5980 -2.5980 -2.5495 -2.5495 -1.1287 -1.1287 -0.9924 -0.9924 -0.8624 -0.8624 0.5268 0.5268 0.6973 0.6973 0.7662 0.7662 1.1819 1.1819 1.2956 1.2956 1.3793 1.3793 1.4684 1.4684 1.5340 1.5340 1.5680 1.5680 1.8067 1.8067 1.9377 1.9377 2.0930 2.0930 2.1605 2.1605 2.1996 2.1996 4.5272 4.5272 8.4394 8.4394 8.7857 8.7857 9.0669 9.0669 9.0897 9.0897 9.1796 9.1796 k = 0.1477 0.0853 0.2412 ( 21739 PWs) bands (ev): -15.1232 -15.1232 -15.0864 -15.0864 -11.9646 -11.9646 -10.9715 -10.9715 -10.9476 -10.9476 -10.9210 -10.9210 -10.5580 -10.5580 -10.5412 -10.5412 -4.7714 -4.7714 -4.0417 -4.0417 -3.9232 -3.9232 -2.7799 -2.7799 -2.7189 -2.7189 -2.6035 -2.6035 -2.5601 -2.5601 -1.1174 -1.1174 -0.9885 -0.9885 -0.8700 -0.8700 0.5450 0.5450 0.7087 0.7087 0.7770 0.7770 1.2043 1.2043 1.3097 1.3097 1.3915 1.3915 1.4748 1.4748 1.5522 1.5522 1.5779 1.5779 1.8230 1.8230 1.9473 1.9473 2.1061 2.1061 2.1736 2.1736 2.2111 2.2111 4.4866 4.4866 8.4435 8.4435 8.7525 8.7525 9.0168 9.0168 9.0255 9.0255 9.1069 9.1069 k = 0.1364 0.0787 0.2227 ( 21743 PWs) bands (ev): -15.1245 -15.1245 -15.0858 -15.0858 -11.9651 -11.9651 -10.9682 -10.9682 -10.9471 -10.9471 -10.9233 -10.9233 -10.5548 -10.5548 -10.5394 -10.5394 -4.7798 -4.7798 -4.0506 -4.0506 -3.9268 -3.9268 -2.7913 -2.7913 -2.7377 -2.7377 -2.6090 -2.6090 -2.5706 -2.5706 -1.1068 -1.1068 -0.9840 -0.9840 -0.8777 -0.8777 0.5618 0.5618 0.7203 0.7203 0.7872 0.7872 1.2269 1.2269 1.3222 1.3222 1.4046 1.4046 1.4806 1.4806 1.5546 1.5546 1.6049 1.6049 1.8389 1.8389 1.9560 1.9560 2.1194 2.1194 2.1871 2.1871 2.2220 2.2220 4.4465 4.4465 8.4476 8.4476 8.7206 8.7206 8.9630 8.9630 8.9685 8.9685 9.0382 9.0382 k = 0.1250 0.0722 0.2041 ( 21767 PWs) bands (ev): -15.1257 -15.1257 -15.0852 -15.0852 -11.9657 -11.9657 -10.9648 -10.9648 -10.9465 -10.9465 -10.9256 -10.9256 -10.5516 -10.5516 -10.5377 -10.5377 -4.7880 -4.7880 -4.0592 -4.0592 -3.9303 -3.9303 -2.8021 -2.8021 -2.7556 -2.7556 -2.6142 -2.6142 -2.5810 -2.5810 -1.0971 -1.0971 -0.9787 -0.9787 -0.8852 -0.8852 0.5769 0.5769 0.7326 0.7326 0.7965 0.7965 1.2491 1.2491 1.3332 1.3332 1.4181 1.4181 1.4859 1.4859 1.5538 1.5538 1.6354 1.6354 1.8547 1.8547 1.9639 1.9639 2.1330 2.1330 2.2005 2.2005 2.2322 2.2322 4.4073 4.4073 8.4515 8.4515 8.6905 8.6905 8.9027 8.9027 8.9220 8.9220 8.9742 8.9742 k = 0.1136 0.0656 0.1856 ( 21753 PWs) bands (ev): -15.1269 -15.1269 -15.0847 -15.0847 -11.9662 -11.9662 -10.9616 -10.9616 -10.9459 -10.9459 -10.9280 -10.9280 -10.5484 -10.5484 -10.5362 -10.5362 -4.7958 -4.7958 -4.0673 -4.0673 -3.9337 -3.9337 -2.8120 -2.8120 -2.7726 -2.7726 -2.6193 -2.6193 -2.5910 -2.5910 -1.0887 -1.0887 -0.9728 -0.9728 -0.8921 -0.8921 0.5899 0.5899 0.7458 0.7458 0.8050 0.8050 1.2707 1.2707 1.3430 1.3430 1.4316 1.4316 1.4905 1.4905 1.5530 1.5530 1.6654 1.6654 1.8708 1.8708 1.9710 1.9710 2.1465 2.1465 2.2137 2.2137 2.2418 2.2418 4.3693 4.3693 8.4546 8.4546 8.6623 8.6623 8.8450 8.8450 8.8778 8.8778 8.9154 8.9154 k = 0.1023 0.0590 0.1670 ( 21767 PWs) bands (ev): -15.1280 -15.1280 -15.0842 -15.0842 -11.9667 -11.9667 -10.9585 -10.9585 -10.9453 -10.9453 -10.9302 -10.9302 -10.5453 -10.5453 -10.5349 -10.5349 -4.8032 -4.8032 -4.0748 -4.0748 -3.9370 -3.9370 -2.8212 -2.8212 -2.7886 -2.7886 -2.6240 -2.6240 -2.6006 -2.6006 -1.0818 -1.0818 -0.9663 -0.9663 -0.8985 -0.8985 0.6007 0.6007 0.7596 0.7596 0.8125 0.8125 1.2911 1.2911 1.3517 1.3517 1.4448 1.4448 1.4945 1.4945 1.5526 1.5526 1.6933 1.6933 1.8874 1.8874 1.9774 1.9774 2.1597 2.1597 2.2265 2.2265 2.2507 2.2507 4.3330 4.3330 8.4567 8.4567 8.6365 8.6365 8.7906 8.7906 8.8361 8.8361 8.8621 8.8621 k = 0.0909 0.0525 0.1485 ( 21777 PWs) bands (ev): -15.1290 -15.1290 -15.0838 -15.0838 -11.9671 -11.9671 -10.9556 -10.9556 -10.9447 -10.9447 -10.9324 -10.9324 -10.5423 -10.5423 -10.5338 -10.5338 -4.8101 -4.8101 -4.0817 -4.0817 -3.9402 -3.9402 -2.8295 -2.8295 -2.8032 -2.8032 -2.6284 -2.6284 -2.6095 -2.6095 -1.0765 -1.0765 -0.9594 -0.9594 -0.9040 -0.9040 0.6095 0.6095 0.7738 0.7738 0.8192 0.8192 1.3102 1.3102 1.3594 1.3594 1.4571 1.4571 1.4977 1.4977 1.5529 1.5529 1.7181 1.7181 1.9046 1.9046 1.9831 1.9831 2.1722 2.1722 2.2387 2.2387 2.2589 2.2589 4.2989 4.2989 8.4573 8.4573 8.6135 8.6135 8.7400 8.7400 8.7974 8.7974 8.8145 8.8145 k = 0.0795 0.0459 0.1299 ( 21765 PWs) bands (ev): -15.1299 -15.1299 -15.0834 -15.0834 -11.9675 -11.9675 -10.9530 -10.9530 -10.9441 -10.9441 -10.9343 -10.9343 -10.5396 -10.5396 -10.5328 -10.5328 -4.8164 -4.8164 -4.0880 -4.0880 -3.9431 -3.9431 -2.8370 -2.8370 -2.8165 -2.8165 -2.6324 -2.6324 -2.6177 -2.6177 -1.0726 -1.0726 -0.9523 -0.9523 -0.9087 -0.9087 0.6164 0.6164 0.7877 0.7877 0.8249 0.8249 1.3277 1.3277 1.3662 1.3662 1.4684 1.4684 1.5003 1.5003 1.5538 1.5538 1.7394 1.7394 1.9223 1.9223 1.9881 1.9881 2.1837 2.1837 2.2502 2.2502 2.2665 2.2665 4.2675 4.2675 8.4560 8.4560 8.5937 8.5937 8.6942 8.6942 8.7620 8.7620 8.7727 8.7727 k = 0.0682 0.0394 0.1113 ( 21781 PWs) bands (ev): -15.1306 -15.1306 -15.0831 -15.0831 -11.9679 -11.9679 -10.9508 -10.9508 -10.9435 -10.9435 -10.9361 -10.9361 -10.5371 -10.5371 -10.5319 -10.5319 -4.8220 -4.8220 -4.0936 -4.0936 -3.9457 -3.9457 -2.8435 -2.8435 -2.8282 -2.8282 -2.6360 -2.6360 -2.6250 -2.6250 -1.0700 -1.0700 -0.9453 -0.9453 -0.9126 -0.9126 0.6219 0.6219 0.8010 0.8010 0.8299 0.8299 1.3433 1.3433 1.3720 1.3720 1.4784 1.4784 1.5021 1.5021 1.5554 1.5554 1.7568 1.7568 1.9402 1.9402 1.9925 1.9925 2.1940 2.1940 2.2608 2.2608 2.2733 2.2733 4.2391 4.2391 8.4524 8.4524 8.5775 8.5775 8.6539 8.6539 8.7303 8.7303 8.7365 8.7365 k = 0.0568 0.0328 0.0928 ( 21789 PWs) bands (ev): -15.1313 -15.1313 -15.0828 -15.0828 -11.9682 -11.9682 -10.9490 -10.9490 -10.9428 -10.9428 -10.9375 -10.9375 -10.5349 -10.5349 -10.5312 -10.5312 -4.8269 -4.8269 -4.0984 -4.0984 -3.9480 -3.9480 -2.8490 -2.8490 -2.8383 -2.8383 -2.6391 -2.6391 -2.6314 -2.6314 -1.0684 -1.0684 -0.9387 -0.9387 -0.9157 -0.9157 0.6260 0.6260 0.8131 0.8131 0.8340 0.8340 1.3567 1.3567 1.3770 1.3770 1.4868 1.4868 1.5035 1.5035 1.5575 1.5575 1.7705 1.7705 1.9574 1.9574 1.9962 1.9962 2.2029 2.2029 2.2703 2.2703 2.2792 2.2792 4.2141 4.2141 8.4467 8.4467 8.5651 8.5651 8.6197 8.6197 8.7027 8.7027 8.7060 8.7060 k = 0.0455 0.0262 0.0742 ( 21809 PWs) bands (ev): -15.1319 -15.1319 -15.0826 -15.0826 -11.9684 -11.9684 -10.9478 -10.9478 -10.9421 -10.9421 -10.9386 -10.9386 -10.5331 -10.5331 -10.5306 -10.5306 -4.8309 -4.8309 -4.1024 -4.1024 -3.9500 -3.9500 -2.8536 -2.8536 -2.8467 -2.8467 -2.6417 -2.6417 -2.6367 -2.6367 -1.0675 -1.0675 -0.9330 -0.9330 -0.9180 -0.9180 0.6292 0.6292 0.8235 0.8235 0.8374 0.8374 1.3679 1.3679 1.3811 1.3811 1.4937 1.4937 1.5043 1.5043 1.5598 1.5598 1.7810 1.7810 1.9731 1.9731 1.9992 1.9992 2.2103 2.2103 2.2784 2.2784 2.2843 2.2843 4.1931 4.1931 8.4395 8.4395 8.5562 8.5562 8.5920 8.5920 8.6795 8.6795 8.6811 8.6811 k = 0.0341 0.0197 0.0557 ( 21779 PWs) bands (ev): -15.1323 -15.1323 -15.0824 -15.0824 -11.9686 -11.9686 -10.9470 -10.9470 -10.9414 -10.9414 -10.9395 -10.9395 -10.5316 -10.5316 -10.5302 -10.5302 -4.8342 -4.8342 -4.1055 -4.1055 -3.9515 -3.9515 -2.8572 -2.8572 -2.8533 -2.8533 -2.6438 -2.6438 -2.6410 -2.6410 -1.0672 -1.0672 -0.9282 -0.9282 -0.9197 -0.9197 0.6314 0.6314 0.8320 0.8320 0.8400 0.8400 1.3768 1.3768 1.3842 1.3842 1.4989 1.4989 1.5049 1.5049 1.5619 1.5619 1.7885 1.7885 1.9863 1.9863 2.0016 2.0016 2.2160 2.2160 2.2850 2.2850 2.2884 2.2884 4.1763 4.1763 8.4318 8.4318 8.5503 8.5503 8.5707 8.5707 8.6610 8.6610 8.6617 8.6617 k = 0.0227 0.0131 0.0371 ( 21755 PWs) bands (ev): -15.1326 -15.1326 -15.0823 -15.0823 -11.9688 -11.9688 -10.9466 -10.9466 -10.9408 -10.9408 -10.9400 -10.9400 -10.5305 -10.5305 -10.5299 -10.5299 -4.8365 -4.8365 -4.1078 -4.1078 -3.9526 -3.9526 -2.8598 -2.8598 -2.8580 -2.8580 -2.6453 -2.6453 -2.6440 -2.6440 -1.0671 -1.0671 -0.9247 -0.9247 -0.9208 -0.9208 0.6330 0.6330 0.8382 0.8382 0.8418 0.8418 1.3832 1.3832 1.3865 1.3865 1.5026 1.5026 1.5052 1.5052 1.5638 1.5638 1.7937 1.7937 1.9963 1.9963 2.0033 2.0033 2.2201 2.2201 2.2898 2.2898 2.2914 2.2914 4.1641 4.1641 8.4251 8.4251 8.5467 8.5467 8.5558 8.5558 8.6476 8.6476 8.6478 8.6478 k = 0.0114 0.0066 0.0186 ( 21691 PWs) bands (ev): -15.1328 -15.1328 -15.0822 -15.0822 -11.9689 -11.9689 -10.9464 -10.9464 -10.9404 -10.9404 -10.9402 -10.9402 -10.5299 -10.5299 -10.5297 -10.5297 -4.8379 -4.8379 -4.1092 -4.1092 -3.9533 -3.9533 -2.8613 -2.8613 -2.8609 -2.8609 -2.6462 -2.6462 -2.6459 -2.6459 -1.0671 -1.0671 -0.9225 -0.9225 -0.9215 -0.9215 0.6339 0.6339 0.8420 0.8420 0.8429 0.8429 1.3871 1.3871 1.3879 1.3879 1.5047 1.5047 1.5054 1.5054 1.5650 1.5650 1.7966 1.7966 2.0026 2.0026 2.0044 2.0044 2.2225 2.2225 2.2928 2.2928 2.2932 2.2932 4.1566 4.1566 8.4205 8.4205 8.5448 8.5448 8.5471 8.5471 8.6395 8.6395 8.6395 8.6395 k = 0.0000 0.0000 0.0000 ( 21595 PWs) bands (ev): -15.1329 -15.1329 -15.0822 -15.0822 -11.9689 -11.9689 -10.9464 -10.9464 -10.9403 -10.9403 -10.9403 -10.9403 -10.5297 -10.5297 -10.5297 -10.5297 -4.8384 -4.8384 -4.1096 -4.1096 -3.9535 -3.9535 -2.8618 -2.8618 -2.8618 -2.8618 -2.6465 -2.6465 -2.6465 -2.6465 -1.0671 -1.0671 -0.9217 -0.9217 -0.9217 -0.9217 0.6342 0.6342 0.8433 0.8433 0.8433 0.8433 1.3883 1.3883 1.3883 1.3883 1.5054 1.5054 1.5054 1.5054 1.5654 1.5654 1.7976 1.7976 2.0047 2.0047 2.0047 2.0047 2.2234 2.2234 2.2938 2.2938 2.2938 2.2938 4.1541 4.1541 8.4189 8.4189 8.5442 8.5442 8.5442 8.5442 8.6367 8.6367 8.6367 8.6367 k = 0.0000 0.0000 0.0000 ( 21595 PWs) bands (ev): -15.1329 -15.1329 -15.0822 -15.0822 -11.9689 -11.9689 -10.9464 -10.9464 -10.9403 -10.9403 -10.9403 -10.9403 -10.5297 -10.5297 -10.5297 -10.5297 -4.8384 -4.8384 -4.1096 -4.1096 -3.9535 -3.9535 -2.8618 -2.8618 -2.8618 -2.8618 -2.6465 -2.6465 -2.6465 -2.6465 -1.0671 -1.0671 -0.9217 -0.9217 -0.9217 -0.9217 0.6342 0.6342 0.8433 0.8433 0.8433 0.8433 1.3883 1.3883 1.3883 1.3883 1.5054 1.5054 1.5054 1.5054 1.5654 1.5654 1.7976 1.7976 2.0047 2.0047 2.0047 2.0047 2.2234 2.2234 2.2938 2.2938 2.2938 2.2938 4.1541 4.1541 8.4189 8.4189 8.5442 8.5442 8.5442 8.5442 8.6367 8.6367 8.6367 8.6367 k = 0.0185 0.0107 0.0076 ( 21691 PWs) bands (ev): -15.1328 -15.1328 -15.0822 -15.0822 -11.9689 -11.9689 -10.9464 -10.9464 -10.9405 -10.9405 -10.9402 -10.9402 -10.5298 -10.5298 -10.5298 -10.5298 -4.8379 -4.8379 -4.1092 -4.1092 -3.9533 -3.9533 -2.8614 -2.8614 -2.8609 -2.8609 -2.6462 -2.6462 -2.6458 -2.6458 -1.0671 -1.0671 -0.9225 -0.9225 -0.9214 -0.9214 0.6339 0.6339 0.8420 0.8420 0.8430 0.8430 1.3875 1.3875 1.3875 1.3875 1.5047 1.5047 1.5054 1.5054 1.5650 1.5650 1.7967 1.7967 2.0025 2.0025 2.0045 2.0045 2.2225 2.2225 2.2929 2.2929 2.2931 2.2931 4.1566 4.1566 8.4205 8.4205 8.5446 8.5446 8.5472 8.5472 8.6395 8.6395 8.6395 8.6395 k = 0.0370 0.0214 0.0151 ( 21775 PWs) bands (ev): -15.1326 -15.1326 -15.0823 -15.0823 -11.9688 -11.9688 -10.9466 -10.9466 -10.9408 -10.9408 -10.9399 -10.9399 -10.5302 -10.5302 -10.5302 -10.5302 -4.8365 -4.8365 -4.1078 -4.1078 -3.9526 -3.9526 -2.8599 -2.8599 -2.8580 -2.8580 -2.6454 -2.6454 -2.6439 -2.6439 -1.0671 -1.0671 -0.9249 -0.9249 -0.9206 -0.9206 0.6330 0.6330 0.8382 0.8382 0.8419 0.8419 1.3848 1.3848 1.3849 1.3849 1.5024 1.5024 1.5053 1.5053 1.5638 1.5638 1.7937 1.7937 1.9961 1.9961 2.0037 2.0037 2.2201 2.2201 2.2902 2.2902 2.2910 2.2910 4.1640 4.1640 8.4249 8.4249 8.5463 8.5463 8.5563 8.5563 8.6476 8.6476 8.6477 8.6477 k = 0.0556 0.0321 0.0227 ( 21793 PWs) bands (ev): -15.1323 -15.1323 -15.0824 -15.0824 -11.9686 -11.9686 -10.9471 -10.9471 -10.9413 -10.9413 -10.9395 -10.9395 -10.5309 -10.5309 -10.5309 -10.5309 -4.8342 -4.8342 -4.1055 -4.1055 -3.9515 -3.9515 -2.8574 -2.8574 -2.8531 -2.8531 -2.6440 -2.6440 -2.6408 -2.6408 -1.0673 -1.0673 -0.9286 -0.9286 -0.9192 -0.9192 0.6315 0.6315 0.8320 0.8320 0.8401 0.8401 1.3804 1.3804 1.3807 1.3807 1.4987 1.4987 1.5049 1.5049 1.5621 1.5621 1.7885 1.7885 1.9858 1.9858 2.0024 2.0024 2.2161 2.2161 2.2859 2.2859 2.2875 2.2875 4.1762 4.1762 8.4310 8.4310 8.5502 8.5502 8.5714 8.5714 8.6611 8.6611 8.6614 8.6614 k = 0.0741 0.0428 0.0302 ( 21808 PWs) bands (ev): -15.1319 -15.1319 -15.0826 -15.0826 -11.9684 -11.9684 -10.9483 -10.9483 -10.9414 -10.9414 -10.9388 -10.9388 -10.5319 -10.5319 -10.5318 -10.5318 -4.8310 -4.8310 -4.1024 -4.1024 -3.9500 -3.9500 -2.8540 -2.8540 -2.8464 -2.8464 -2.6422 -2.6422 -2.6364 -2.6364 -1.0678 -1.0678 -0.9334 -0.9334 -0.9172 -0.9172 0.6292 0.6292 0.8234 0.8234 0.8376 0.8376 1.3743 1.3743 1.3748 1.3748 1.4936 1.4936 1.5039 1.5039 1.5603 1.5603 1.7807 1.7807 1.9723 1.9723 2.0005 2.0005 2.2106 2.2106 2.2799 2.2799 2.2827 2.2827 4.1929 4.1929 8.4366 8.4366 8.5583 8.5583 8.5923 8.5923 8.6798 8.6798 8.6803 8.6803 k = 0.0926 0.0535 0.0378 ( 21799 PWs) bands (ev): -15.1313 -15.1313 -15.0828 -15.0828 -11.9682 -11.9682 -10.9502 -10.9502 -10.9411 -10.9411 -10.9380 -10.9380 -10.5331 -10.5331 -10.5330 -10.5330 -4.8269 -4.8269 -4.0984 -4.0984 -3.9481 -3.9481 -2.8497 -2.8497 -2.8378 -2.8378 -2.6398 -2.6398 -2.6309 -2.6309 -1.0692 -1.0692 -0.9388 -0.9388 -0.9147 -0.9147 0.6262 0.6262 0.8128 0.8128 0.8344 0.8344 1.3665 1.3665 1.3673 1.3673 1.4872 1.4872 1.5018 1.5018 1.5589 1.5589 1.7698 1.7698 1.9566 1.9566 1.9982 1.9982 2.2036 2.2036 2.2726 2.2726 2.2768 2.2768 4.2138 4.2138 8.4395 8.4395 8.5725 8.5725 8.6186 8.6186 8.7036 8.7036 8.7044 8.7044 k = 0.1111 0.0642 0.0454 ( 21787 PWs) bands (ev): -15.1306 -15.1306 -15.0831 -15.0831 -11.9679 -11.9679 -10.9528 -10.9528 -10.9405 -10.9405 -10.9370 -10.9370 -10.5345 -10.5345 -10.5345 -10.5345 -4.8221 -4.8221 -4.0937 -4.0937 -3.9458 -3.9458 -2.8444 -2.8444 -2.8275 -2.8275 -2.6371 -2.6371 -2.6242 -2.6242 -1.0719 -1.0719 -0.9442 -0.9442 -0.9116 -0.9116 0.6221 0.6221 0.8006 0.8006 0.8306 0.8306 1.3572 1.3572 1.3582 1.3582 1.4797 1.4797 1.4980 1.4980 1.5585 1.5585 1.7552 1.7552 1.9397 1.9397 1.9953 1.9953 2.1952 2.1952 2.2640 2.2640 2.2699 2.2699 4.2385 4.2385 8.4379 8.4379 8.5942 8.5942 8.6501 8.6501 8.7324 8.7324 8.7334 8.7334 k = 0.1296 0.0748 0.0529 ( 21772 PWs) bands (ev): -15.1299 -15.1299 -15.0834 -15.0834 -11.9675 -11.9675 -10.9560 -10.9560 -10.9395 -10.9395 -10.9359 -10.9359 -10.5362 -10.5362 -10.5361 -10.5361 -4.8165 -4.8165 -4.0881 -4.0881 -3.9433 -3.9433 -2.8383 -2.8383 -2.8155 -2.8155 -2.6341 -2.6341 -2.6165 -2.6165 -1.0764 -1.0764 -0.9488 -0.9488 -0.9081 -0.9081 0.6168 0.6168 0.7870 0.7870 0.8261 0.8261 1.3463 1.3463 1.3476 1.3476 1.4711 1.4711 1.4922 1.4922 1.5596 1.5596 1.7362 1.7362 1.9230 1.9230 1.9920 1.9920 2.1857 2.1857 2.2544 2.2544 2.2620 2.2620 4.2665 4.2665 8.4317 8.4317 8.6233 8.6233 8.6864 8.6864 8.7659 8.7659 8.7670 8.7670 k = 0.1481 0.0855 0.0605 ( 21761 PWs) bands (ev): -15.1290 -15.1290 -15.0838 -15.0838 -11.9671 -11.9671 -10.9596 -10.9596 -10.9384 -10.9384 -10.9346 -10.9346 -10.5380 -10.5380 -10.5380 -10.5380 -4.8103 -4.8103 -4.0819 -4.0819 -3.9405 -3.9405 -2.8313 -2.8313 -2.8019 -2.8019 -2.6308 -2.6308 -2.6079 -2.6079 -1.0833 -1.0833 -0.9520 -0.9520 -0.9041 -0.9041 0.6099 0.6099 0.7726 0.7726 0.8210 0.8210 1.3340 1.3340 1.3355 1.3355 1.4616 1.4616 1.4845 1.4845 1.5622 1.5622 1.7124 1.7124 1.9072 1.9072 1.9882 1.9882 2.1751 2.1751 2.2440 2.2440 2.2534 2.2534 4.2976 4.2976 8.4213 8.4213 8.6588 8.6588 8.7269 8.7269 8.8039 8.8039 8.8051 8.8051 k = 0.1667 0.0962 0.0680 ( 21752 PWs) bands (ev): -15.1280 -15.1280 -15.0842 -15.0842 -11.9667 -11.9667 -10.9636 -10.9636 -10.9371 -10.9371 -10.9332 -10.9332 -10.5401 -10.5401 -10.5400 -10.5400 -4.8035 -4.8035 -4.0750 -4.0750 -3.9375 -3.9375 -2.8236 -2.8236 -2.7868 -2.7868 -2.6273 -2.6273 -2.5984 -2.5984 -1.0930 -1.0930 -0.9533 -0.9533 -0.8996 -0.8996 0.6012 0.6012 0.7581 0.7581 0.8153 0.8153 1.3203 1.3203 1.3222 1.3222 1.4514 1.4514 1.4751 1.4751 1.5662 1.5662 1.6839 1.6839 1.8931 1.8931 1.9840 1.9840 2.1637 2.1637 2.2331 2.2331 2.2440 2.2440 4.3311 4.3311 8.4074 8.4074 8.6995 8.6995 8.7710 8.7710 8.8463 8.8463 8.8474 8.8474 k = 0.1852 0.1069 0.0756 ( 21740 PWs) bands (ev): -15.1269 -15.1269 -15.0847 -15.0847 -11.9662 -11.9662 -10.9679 -10.9679 -10.9356 -10.9356 -10.9317 -10.9317 -10.5423 -10.5423 -10.5422 -10.5422 -4.7963 -4.7963 -4.0675 -4.0675 -3.9344 -3.9344 -2.8151 -2.8151 -2.7703 -2.7703 -2.6237 -2.6237 -2.5881 -2.5881 -1.1053 -1.1053 -0.9525 -0.9525 -0.8948 -0.8948 0.5902 0.5902 0.7441 0.7441 0.8091 0.8091 1.3055 1.3055 1.3076 1.3076 1.4406 1.4406 1.4644 1.4644 1.5714 1.5714 1.6512 1.6512 1.8807 1.8807 1.9793 1.9793 2.1518 2.1518 2.2218 2.2218 2.2340 2.2340 4.3665 4.3665 8.3906 8.3906 8.7445 8.7445 8.8182 8.8182 8.8928 8.8928 8.8934 8.8934 k = 0.2037 0.1176 0.0832 ( 21737 PWs) bands (ev): -15.1257 -15.1257 -15.0853 -15.0853 -11.9657 -11.9657 -10.9725 -10.9725 -10.9341 -10.9341 -10.9301 -10.9301 -10.5446 -10.5446 -10.5445 -10.5445 -4.7886 -4.7886 -4.0595 -4.0595 -3.9313 -3.9313 -2.8060 -2.8060 -2.7526 -2.7526 -2.6201 -2.6201 -2.5773 -2.5773 -1.1201 -1.1201 -0.9498 -0.9498 -0.8896 -0.8896 0.5766 0.5766 0.7312 0.7312 0.8025 0.8025 1.2896 1.2896 1.2919 1.2919 1.4295 1.4295 1.4525 1.4525 1.5775 1.5775 1.6151 1.6151 1.8698 1.8698 1.9744 1.9744 2.1395 2.1395 2.2105 2.2105 2.2235 2.2235 4.4035 4.4035 8.3713 8.3713 8.7930 8.7930 8.8678 8.8678 8.9429 8.9429 8.9432 8.9432 k = 0.2222 0.1283 0.0907 ( 21716 PWs) bands (ev): -15.1245 -15.1245 -15.0859 -15.0859 -11.9651 -11.9651 -10.9772 -10.9772 -10.9324 -10.9324 -10.9284 -10.9284 -10.5471 -10.5471 -10.5469 -10.5469 -4.7807 -4.7807 -4.0511 -4.0511 -3.9282 -3.9282 -2.7963 -2.7963 -2.7339 -2.7339 -2.6166 -2.6166 -2.5660 -2.5660 -1.1369 -1.1369 -0.9455 -0.9455 -0.8840 -0.8840 0.5604 0.5604 0.7198 0.7198 0.7955 0.7955 1.2729 1.2729 1.2753 1.2753 1.4181 1.4181 1.4400 1.4400 1.5755 1.5755 1.5855 1.5855 1.8602 1.8602 1.9691 1.9691 2.1272 2.1272 2.1993 2.1993 2.2126 2.2126 4.4414 4.4414 8.3500 8.3500 8.8441 8.8441 8.9192 8.9192 8.9954 8.9954 8.9971 8.9971 k = 0.2407 0.1390 0.0983 ( 21716 PWs) bands (ev): -15.1231 -15.1231 -15.0865 -15.0865 -11.9646 -11.9646 -10.9820 -10.9820 -10.9307 -10.9307 -10.9266 -10.9266 -10.5496 -10.5496 -10.5494 -10.5494 -4.7726 -4.7726 -4.0424 -4.0424 -3.9251 -3.9251 -2.7861 -2.7861 -2.7143 -2.7143 -2.6133 -2.6133 -2.5544 -2.5544 -1.1550 -1.1550 -0.9399 -0.9399 -0.8782 -0.8782 0.5417 0.5417 0.7100 0.7100 0.7882 0.7882 1.2554 1.2554 1.2579 1.2579 1.4068 1.4068 1.4270 1.4270 1.5360 1.5360 1.5925 1.5925 1.8516 1.8516 1.9636 1.9636 2.1149 2.1149 2.1884 2.1884 2.2013 2.2013 4.4799 4.4799 8.3270 8.3270 8.8972 8.8972 8.9720 8.9720 9.0506 9.0506 9.0540 9.0540 k = 0.2593 0.1497 0.1058 ( 21701 PWs) bands (ev): -15.1218 -15.1218 -15.0873 -15.0873 -11.9640 -11.9640 -10.9869 -10.9869 -10.9290 -10.9290 -10.9248 -10.9248 -10.5522 -10.5522 -10.5520 -10.5520 -4.7644 -4.7644 -4.0333 -4.0333 -3.9223 -3.9223 -2.7755 -2.7755 -2.6940 -2.6940 -2.6103 -2.6103 -2.5427 -2.5427 -1.1741 -1.1741 -0.9333 -0.9333 -0.8723 -0.8723 0.5208 0.5208 0.7020 0.7020 0.7807 0.7807 1.2374 1.2374 1.2400 1.2400 1.3956 1.3956 1.4138 1.4138 1.4952 1.4952 1.6007 1.6007 1.8438 1.8438 1.9580 1.9580 2.1030 2.1030 2.1779 2.1779 2.1897 2.1897 4.5185 4.5185 8.3027 8.3027 8.9517 8.9517 9.0258 9.0258 9.1078 9.1078 9.1131 9.1131 k = 0.2778 0.1604 0.1134 ( 21707 PWs) bands (ev): -15.1203 -15.1203 -15.0880 -15.0880 -11.9634 -11.9634 -10.9917 -10.9917 -10.9272 -10.9272 -10.9230 -10.9230 -10.5547 -10.5547 -10.5545 -10.5545 -4.7563 -4.7563 -4.0241 -4.0241 -3.9197 -3.9197 -2.7645 -2.7645 -2.6733 -2.6733 -2.6077 -2.6077 -2.5310 -2.5310 -1.1937 -1.1937 -0.9260 -0.9260 -0.8662 -0.8662 0.4985 0.4985 0.6954 0.6954 0.7732 0.7732 1.2192 1.2192 1.2217 1.2217 1.3847 1.3847 1.4006 1.4006 1.4544 1.4544 1.6093 1.6093 1.8366 1.8366 1.9524 1.9524 2.0915 2.0915 2.1680 2.1680 2.1781 2.1781 4.5566 4.5566 8.2776 8.2776 9.0069 9.0069 9.0802 9.0802 9.1666 9.1666 9.1738 9.1738 k = 0.2963 0.1711 0.1210 ( 21698 PWs) bands (ev): -15.1188 -15.1188 -15.0889 -15.0889 -11.9629 -11.9629 -10.9965 -10.9965 -10.9255 -10.9255 -10.9212 -10.9212 -10.5573 -10.5573 -10.5570 -10.5570 -4.7483 -4.7483 -4.0148 -4.0148 -3.9174 -3.9174 -2.7532 -2.7532 -2.6524 -2.6524 -2.6056 -2.6056 -2.5196 -2.5196 -1.2134 -1.2134 -0.9182 -0.9182 -0.8601 -0.8601 0.4752 0.4752 0.6901 0.6901 0.7656 0.7656 1.2010 1.2010 1.2035 1.2035 1.3742 1.3742 1.3875 1.3875 1.4145 1.4145 1.6182 1.6182 1.8299 1.8299 1.9468 1.9468 2.0807 2.0807 2.1587 2.1587 2.1664 2.1664 4.5939 4.5939 8.2521 8.2521 9.0623 9.0623 9.1352 9.1352 9.2263 9.2263 9.2351 9.2351 k = 0.3148 0.1818 0.1285 ( 21674 PWs) bands (ev): -15.1173 -15.1173 -15.0898 -15.0898 -11.9623 -11.9623 -11.0011 -11.0011 -10.9238 -10.9238 -10.9195 -10.9195 -10.5597 -10.5597 -10.5595 -10.5595 -4.7405 -4.7405 -4.0055 -4.0055 -3.9155 -3.9155 -2.7418 -2.7418 -2.6315 -2.6315 -2.6041 -2.6041 -2.5087 -2.5087 -1.2328 -1.2328 -0.9103 -0.9103 -0.8540 -0.8540 0.4517 0.4517 0.6858 0.6858 0.7582 0.7582 1.1830 1.1830 1.1854 1.1854 1.3643 1.3643 1.3710 1.3710 1.3798 1.3798 1.6272 1.6272 1.8237 1.8237 1.9414 1.9414 2.0706 2.0706 2.1502 2.1502 2.1548 2.1548 4.6298 4.6298 8.2267 8.2267 9.1175 9.1175 9.1903 9.1903 9.2861 9.2861 9.2961 9.2961 k = 0.3333 0.1925 0.1361 ( 21641 PWs) bands (ev): -15.1158 -15.1158 -15.0907 -15.0907 -11.9618 -11.9618 -11.0055 -11.0055 -10.9221 -10.9221 -10.9178 -10.9178 -10.5621 -10.5621 -10.5618 -10.5618 -4.7331 -4.7331 -3.9962 -3.9962 -3.9141 -3.9141 -2.7304 -2.7304 -2.6109 -2.6109 -2.6032 -2.6032 -2.4984 -2.4984 -1.2515 -1.2515 -0.9024 -0.9024 -0.8481 -0.8481 0.4284 0.4284 0.6823 0.6823 0.7510 0.7510 1.1656 1.1656 1.1679 1.1679 1.3372 1.3372 1.3551 1.3551 1.3649 1.3649 1.6362 1.6362 1.8180 1.8180 1.9362 1.9362 2.0613 2.0613 2.1424 2.1424 2.1434 2.1434 4.6639 4.6639 8.2018 8.2018 9.1718 9.1718 9.2454 9.2454 9.3453 9.3453 9.3557 9.3557 k = 0.3519 0.2031 0.1436 ( 21674 PWs) bands (ev): -15.1142 -15.1142 -15.0917 -15.0917 -11.9613 -11.9613 -11.0096 -11.0096 -10.9205 -10.9205 -10.9162 -10.9162 -10.5643 -10.5643 -10.5641 -10.5641 -4.7262 -4.7262 -3.9871 -3.9871 -3.9132 -3.9132 -2.7190 -2.7190 -2.6030 -2.6030 -2.5909 -2.5909 -2.4891 -2.4891 -1.2692 -1.2692 -0.8947 -0.8947 -0.8424 -0.8424 0.4060 0.4060 0.6796 0.6796 0.7442 0.7442 1.1490 1.1490 1.1512 1.1512 1.3029 1.3029 1.3466 1.3466 1.3538 1.3538 1.6450 1.6450 1.8129 1.8129 1.9314 1.9314 2.0528 2.0528 2.1325 2.1325 2.1355 2.1355 4.6959 4.6959 8.1779 8.1779 9.2247 9.2247 9.3000 9.3000 9.4031 9.4031 9.4131 9.4131 k = 0.3704 0.2138 0.1512 ( 21674 PWs) bands (ev): -15.1126 -15.1126 -15.0928 -15.0928 -11.9608 -11.9608 -11.0133 -11.0133 -10.9191 -10.9191 -10.9147 -10.9147 -10.5664 -10.5664 -10.5661 -10.5661 -4.7199 -4.7199 -3.9783 -3.9783 -3.9129 -3.9129 -2.7078 -2.7078 -2.6037 -2.6037 -2.5717 -2.5717 -2.4809 -2.4809 -1.2856 -1.2856 -0.8874 -0.8874 -0.8371 -0.8371 0.3849 0.3849 0.6774 0.6774 0.7379 0.7379 1.1335 1.1335 1.1356 1.1356 1.2712 1.2712 1.3389 1.3389 1.3437 1.3437 1.6534 1.6534 1.8082 1.8082 1.9270 1.9270 2.0453 2.0453 2.1222 2.1222 2.1293 2.1293 4.7253 4.7253 8.1555 8.1555 9.2755 9.2755 9.3537 9.3537 9.4586 9.4586 9.4671 9.4671 k = 0.3889 0.2245 0.1588 ( 21683 PWs) bands (ev): -15.1110 -15.1110 -15.0939 -15.0939 -11.9604 -11.9604 -11.0167 -11.0167 -10.9178 -10.9178 -10.9134 -10.9134 -10.5683 -10.5683 -10.5680 -10.5680 -4.7142 -4.7142 -3.9698 -3.9698 -3.9131 -3.9131 -2.6969 -2.6969 -2.6051 -2.6051 -2.5536 -2.5536 -2.4740 -2.4740 -1.3005 -1.3005 -0.8807 -0.8807 -0.8322 -0.8322 0.3657 0.3657 0.6757 0.6757 0.7321 0.7321 1.1195 1.1195 1.1214 1.1214 1.2428 1.2428 1.3321 1.3321 1.3349 1.3349 1.6613 1.6613 1.8041 1.8041 1.9230 1.9230 2.0387 2.0387 2.1128 2.1128 2.1239 2.1239 4.7516 4.7516 8.1351 8.1351 9.3233 9.3233 9.4059 9.4059 9.5111 9.5111 9.5166 9.5166 k = 0.4074 0.2352 0.1663 ( 21680 PWs) bands (ev): -15.1095 -15.1095 -15.0951 -15.0951 -11.9600 -11.9600 -11.0196 -11.0196 -10.9166 -10.9166 -10.9122 -10.9122 -10.5699 -10.5699 -10.5696 -10.5696 -4.7092 -4.7092 -3.9617 -3.9617 -3.9141 -3.9141 -2.6864 -2.6864 -2.6072 -2.6072 -2.5370 -2.5370 -2.4686 -2.4686 -1.3135 -1.3135 -0.8747 -0.8747 -0.8279 -0.8279 0.3486 0.3486 0.6744 0.6744 0.7271 0.7271 1.1070 1.1070 1.1089 1.1089 1.2180 1.2180 1.3263 1.3263 1.3272 1.3272 1.6685 1.6685 1.8005 1.8005 1.9196 1.9196 2.0331 2.0331 2.1043 2.1043 2.1194 2.1194 4.7746 4.7746 8.1169 8.1169 9.3672 9.3672 9.4557 9.4557 9.5595 9.5595 9.5607 9.5607 k = 0.4259 0.2459 0.1739 ( 21674 PWs) bands (ev): -15.1079 -15.1079 -15.0963 -15.0963 -11.9597 -11.9597 -11.0220 -11.0220 -10.9156 -10.9156 -10.9112 -10.9112 -10.5713 -10.5713 -10.5710 -10.5710 -4.7051 -4.7051 -3.9541 -3.9541 -3.9157 -3.9157 -2.6765 -2.6765 -2.6102 -2.6102 -2.5221 -2.5221 -2.4648 -2.4648 -1.3246 -1.3246 -0.8695 -0.8695 -0.8242 -0.8242 0.3342 0.3342 0.6735 0.6735 0.7228 0.7228 1.0965 1.0965 1.0983 1.0983 1.1972 1.1972 1.3208 1.3208 1.3215 1.3215 1.6747 1.6747 1.7976 1.7976 1.9167 1.9167 2.0285 2.0285 2.0970 2.0970 2.1157 2.1157 4.7939 4.7939 8.1015 8.1015 9.4058 9.4058 9.5019 9.5019 9.5982 9.5982 9.6030 9.6030 k = 0.4444 0.2566 0.1814 ( 21662 PWs) bands (ev): -15.1063 -15.1063 -15.0976 -15.0976 -11.9594 -11.9594 -11.0240 -11.0240 -10.9149 -10.9149 -10.9104 -10.9104 -10.5724 -10.5724 -10.5720 -10.5720 -4.7018 -4.7018 -3.9470 -3.9470 -3.9180 -3.9180 -2.6675 -2.6675 -2.6137 -2.6137 -2.5093 -2.5093 -2.4627 -2.4627 -1.3333 -1.3333 -0.8654 -0.8654 -0.8213 -0.8213 0.3226 0.3226 0.6729 0.6729 0.7194 0.7194 1.0881 1.0881 1.0899 1.0899 1.1807 1.1807 1.3158 1.3158 1.3177 1.3177 1.6798 1.6798 1.7953 1.7953 1.9144 1.9144 2.0248 2.0248 2.0911 2.0911 2.1129 2.1129 4.8092 4.8092 8.0892 8.0892 9.4379 9.4379 9.5426 9.5426 9.6283 9.6283 9.6403 9.6403 k = 0.4630 0.2673 0.1890 ( 21650 PWs) bands (ev): -15.1048 -15.1048 -15.0989 -15.0989 -11.9592 -11.9592 -11.0254 -11.0254 -10.9143 -10.9143 -10.9098 -10.9098 -10.5732 -10.5732 -10.5728 -10.5728 -4.6994 -4.6994 -3.9406 -3.9406 -3.9211 -3.9211 -2.6598 -2.6598 -2.6174 -2.6174 -2.4989 -2.4989 -2.4621 -2.4621 -1.3397 -1.3397 -0.8624 -0.8624 -0.8191 -0.8191 0.3141 0.3141 0.6725 0.6725 0.7170 0.7170 1.0820 1.0820 1.0837 1.0837 1.1687 1.1687 1.3122 1.3122 1.3150 1.3150 1.6836 1.6836 1.7936 1.7936 1.9128 1.9128 2.0222 2.0222 2.0868 2.0868 2.1108 2.1108 4.8203 4.8203 8.0802 8.0802 9.4621 9.4621 9.5753 9.5753 9.6502 9.6502 9.6695 9.6695 k = 0.4815 0.2780 0.1966 ( 21677 PWs) bands (ev): -15.1033 -15.1033 -15.1003 -15.1003 -11.9591 -11.9591 -11.0262 -11.0262 -10.9139 -10.9139 -10.9095 -10.9095 -10.5736 -10.5736 -10.5733 -10.5733 -4.6979 -4.6979 -3.9348 -3.9348 -3.9248 -3.9248 -2.6541 -2.6541 -2.6207 -2.6207 -2.4919 -2.4919 -2.4624 -2.4624 -1.3436 -1.3436 -0.8605 -0.8605 -0.8178 -0.8178 0.3089 0.3089 0.6722 0.6722 0.7155 0.7155 1.0782 1.0782 1.0799 1.0799 1.1615 1.1615 1.3100 1.3100 1.3133 1.3133 1.6859 1.6859 1.7926 1.7926 1.9118 1.9118 2.0206 2.0206 2.0841 2.0841 2.1096 2.1096 4.8270 4.8270 8.0747 8.0747 9.4772 9.4772 9.5970 9.5970 9.6634 9.6634 9.6885 9.6885 k = 0.5000 0.2887 0.2041 ( 21668 PWs) bands (ev): -15.1022 -15.1022 -15.1014 -15.1014 -11.9591 -11.9591 -11.0265 -11.0265 -10.9138 -10.9138 -10.9094 -10.9094 -10.5738 -10.5738 -10.5735 -10.5735 -4.6974 -4.6974 -3.9306 -3.9306 -3.9282 -3.9282 -2.6519 -2.6519 -2.6221 -2.6221 -2.4893 -2.4893 -2.4628 -2.4628 -1.3449 -1.3449 -0.8599 -0.8599 -0.8174 -0.8174 0.3072 0.3072 0.6722 0.6722 0.7149 0.7149 1.0770 1.0770 1.0787 1.0787 1.1590 1.1590 1.3092 1.3092 1.3128 1.3128 1.6867 1.6867 1.7923 1.7923 1.9115 1.9115 2.0201 2.0201 2.0832 2.0832 2.1092 2.1092 4.8293 4.8293 8.0728 8.0728 9.4823 9.4823 9.6047 9.6047 9.6677 9.6677 9.6951 9.6951 k = 0.5000 0.2887 0.2041 ( 21668 PWs) bands (ev): -15.1022 -15.1022 -15.1014 -15.1014 -11.9591 -11.9591 -11.0265 -11.0265 -10.9138 -10.9138 -10.9094 -10.9094 -10.5738 -10.5738 -10.5735 -10.5735 -4.6974 -4.6974 -3.9306 -3.9306 -3.9282 -3.9282 -2.6519 -2.6519 -2.6221 -2.6221 -2.4893 -2.4893 -2.4628 -2.4628 -1.3449 -1.3449 -0.8599 -0.8599 -0.8174 -0.8174 0.3072 0.3072 0.6722 0.6722 0.7149 0.7149 1.0770 1.0770 1.0787 1.0787 1.1590 1.1590 1.3092 1.3092 1.3128 1.3128 1.6867 1.6867 1.7923 1.7923 1.9115 1.9115 2.0201 2.0201 2.0832 2.0832 2.1092 2.1092 4.8293 4.8293 8.0728 8.0728 9.4823 9.4823 9.6047 9.6047 9.6677 9.6677 9.6951 9.6951 k = 0.5066 0.2697 0.2149 ( 21679 PWs) bands (ev): -15.1022 -15.1022 -15.1013 -15.1013 -11.9591 -11.9591 -11.0263 -11.0263 -10.9140 -10.9140 -10.9095 -10.9095 -10.5739 -10.5739 -10.5735 -10.5735 -4.6972 -4.6972 -3.9309 -3.9309 -3.9275 -3.9275 -2.6513 -2.6513 -2.6215 -2.6215 -2.4892 -2.4892 -2.4627 -2.4627 -1.3440 -1.3440 -0.8605 -0.8605 -0.8181 -0.8181 0.3074 0.3074 0.6711 0.6711 0.7136 0.7136 1.0762 1.0762 1.0783 1.0783 1.1613 1.1613 1.3097 1.3097 1.3131 1.3131 1.6860 1.6860 1.7910 1.7910 1.9098 1.9098 2.0197 2.0197 2.0829 2.0829 2.1085 2.1085 4.8303 4.8303 8.0761 8.0761 9.4815 9.4815 9.6040 9.6040 9.6699 9.6699 9.6974 9.6974 k = 0.5132 0.2507 0.2256 ( 21662 PWs) bands (ev): -15.1022 -15.1022 -15.1013 -15.1013 -11.9590 -11.9590 -11.0258 -11.0258 -10.9145 -10.9145 -10.9100 -10.9100 -10.5743 -10.5743 -10.5732 -10.5732 -4.6966 -4.6966 -3.9312 -3.9312 -3.9259 -3.9259 -2.6496 -2.6496 -2.6200 -2.6200 -2.4890 -2.4890 -2.4626 -2.4626 -1.3413 -1.3413 -0.8623 -0.8623 -0.8201 -0.8201 0.3078 0.3078 0.6677 0.6677 0.7099 0.7099 1.0729 1.0729 1.0783 1.0783 1.1680 1.1680 1.3110 1.3110 1.3141 1.3141 1.6839 1.6839 1.7873 1.7873 1.9048 1.9048 2.0185 2.0185 2.0819 2.0819 2.1068 2.1068 4.8335 4.8335 8.0860 8.0860 9.4792 9.4792 9.6019 9.6019 9.6761 9.6761 9.7047 9.7047 k = 0.5197 0.2317 0.2364 ( 21670 PWs) bands (ev): -15.1021 -15.1021 -15.1013 -15.1013 -11.9590 -11.9590 -11.0249 -11.0249 -10.9152 -10.9152 -10.9107 -10.9107 -10.5751 -10.5751 -10.5727 -10.5727 -4.6956 -4.6956 -3.9312 -3.9312 -3.9238 -3.9238 -2.6469 -2.6469 -2.6174 -2.6174 -2.4885 -2.4885 -2.4623 -2.4623 -1.3368 -1.3368 -0.8652 -0.8652 -0.8235 -0.8235 0.3085 0.3085 0.6611 0.6611 0.7051 0.7051 1.0674 1.0674 1.0789 1.0789 1.1782 1.1782 1.3131 1.3131 1.3158 1.3158 1.6805 1.6805 1.7811 1.7811 1.8969 1.8969 2.0161 2.0161 2.0801 2.0801 2.1044 2.1044 4.8386 4.8386 8.1022 8.1022 9.4754 9.4754 9.5986 9.5986 9.6851 9.6851 9.7178 9.7178 k = 0.5263 0.2127 0.2471 ( 21681 PWs) bands (ev): -15.1021 -15.1021 -15.1012 -15.1012 -11.9589 -11.9589 -11.0236 -11.0236 -10.9163 -10.9163 -10.9117 -10.9117 -10.5763 -10.5763 -10.5719 -10.5719 -4.6941 -4.6941 -3.9309 -3.9309 -3.9214 -3.9214 -2.6430 -2.6430 -2.6139 -2.6139 -2.4879 -2.4879 -2.4619 -2.4619 -1.3306 -1.3306 -0.8694 -0.8694 -0.8281 -0.8281 0.3095 0.3095 0.6503 0.6503 0.7008 0.7008 1.0601 1.0601 1.0798 1.0798 1.1913 1.1913 1.3159 1.3159 1.3181 1.3181 1.6759 1.6759 1.7723 1.7723 1.8866 1.8866 2.0121 2.0121 2.0768 2.0768 2.1023 2.1023 4.8456 4.8456 8.1247 8.1247 9.4700 9.4700 9.5944 9.5944 9.6961 9.6961 9.7373 9.7373 k = 0.5329 0.1937 0.2578 ( 21672 PWs) bands (ev): -15.1019 -15.1019 -15.1012 -15.1012 -11.9588 -11.9588 -11.0220 -11.0220 -10.9178 -10.9178 -10.9129 -10.9129 -10.5777 -10.5777 -10.5710 -10.5710 -4.6924 -4.6924 -3.9302 -3.9302 -3.9185 -3.9185 -2.6383 -2.6383 -2.6095 -2.6095 -2.4871 -2.4871 -2.4614 -2.4614 -1.3227 -1.3227 -0.8747 -0.8747 -0.8338 -0.8338 0.3107 0.3107 0.6353 0.6353 0.6975 0.6975 1.0513 1.0513 1.0812 1.0812 1.2065 1.2065 1.3193 1.3193 1.3211 1.3211 1.6703 1.6703 1.7609 1.7609 1.8744 1.8744 2.0062 2.0062 2.0715 2.0715 2.1014 2.1014 4.8544 4.8544 8.1530 8.1530 9.4630 9.4630 9.5893 9.5893 9.7089 9.7089 9.7630 9.7630 k = 0.5395 0.1747 0.2686 ( 21656 PWs) bands (ev): -15.1018 -15.1018 -15.1011 -15.1011 -11.9587 -11.9587 -11.0200 -11.0200 -10.9195 -10.9195 -10.9143 -10.9143 -10.5795 -10.5795 -10.5699 -10.5699 -4.6903 -4.6903 -3.9291 -3.9291 -3.9154 -3.9154 -2.6326 -2.6326 -2.6043 -2.6043 -2.4862 -2.4862 -2.4608 -2.4608 -1.3132 -1.3132 -0.8811 -0.8811 -0.8405 -0.8405 0.3120 0.3120 0.6170 0.6170 0.6952 0.6952 1.0410 1.0410 1.0831 1.0831 1.2233 1.2233 1.3231 1.3231 1.3247 1.3247 1.6637 1.6637 1.7469 1.7469 1.8611 1.8611 1.9983 1.9983 2.0640 2.0640 2.1022 2.1022 4.8647 4.8647 8.1868 8.1868 9.4546 9.4546 9.5835 9.5835 9.7238 9.7238 9.7939 9.7939 k = 0.5461 0.1557 0.2793 ( 21679 PWs) bands (ev): -15.1017 -15.1017 -15.1010 -15.1010 -11.9585 -11.9585 -11.0178 -11.0178 -10.9216 -10.9216 -10.9158 -10.9158 -10.5815 -10.5815 -10.5686 -10.5686 -4.6879 -4.6879 -3.9278 -3.9278 -3.9121 -3.9121 -2.6262 -2.6262 -2.5983 -2.5983 -2.4852 -2.4852 -2.4599 -2.4599 -1.3023 -1.3023 -0.8885 -0.8885 -0.8480 -0.8480 0.3134 0.3134 0.5964 0.5964 0.6936 0.6936 1.0294 1.0294 1.0856 1.0856 1.2411 1.2411 1.3271 1.3271 1.3291 1.3291 1.6564 1.6564 1.7304 1.7304 1.8473 1.8473 1.9884 1.9884 2.0545 2.0545 2.1044 2.1044 4.8762 4.8762 8.2257 8.2257 9.4447 9.4447 9.5770 9.5770 9.7410 9.7410 9.8291 9.8291 k = 0.5526 0.1367 0.2901 ( 21689 PWs) bands (ev): -15.1016 -15.1016 -15.1008 -15.1008 -11.9584 -11.9584 -11.0152 -11.0152 -10.9238 -10.9238 -10.9175 -10.9175 -10.5838 -10.5838 -10.5671 -10.5671 -4.6853 -4.6853 -3.9261 -3.9261 -3.9086 -3.9086 -2.6192 -2.6192 -2.5918 -2.5918 -2.4841 -2.4841 -2.4589 -2.4589 -1.2900 -1.2900 -0.8970 -0.8970 -0.8562 -0.8562 0.3146 0.3146 0.5745 0.5745 0.6925 0.6925 1.0164 1.0164 1.0888 1.0888 1.2594 1.2594 1.3310 1.3310 1.3342 1.3342 1.6487 1.6487 1.7113 1.7113 1.8335 1.8335 1.9768 1.9768 2.0436 2.0436 2.1077 2.1077 4.8888 4.8888 8.2689 8.2689 9.4335 9.4335 9.5698 9.5698 9.7607 9.7607 9.8676 9.8676 k = 0.5592 0.1177 0.3008 ( 21695 PWs) bands (ev): -15.1015 -15.1015 -15.1006 -15.1006 -11.9582 -11.9582 -11.0125 -11.0125 -10.9263 -10.9263 -10.9192 -10.9192 -10.5864 -10.5864 -10.5656 -10.5656 -4.6825 -4.6825 -3.9243 -3.9243 -3.9050 -3.9050 -2.6117 -2.6117 -2.5847 -2.5847 -2.4829 -2.4829 -2.4577 -2.4577 -1.2765 -1.2765 -0.9062 -0.9062 -0.8649 -0.8649 0.3154 0.3154 0.5523 0.5523 0.6915 0.6915 1.0022 1.0022 1.0928 1.0928 1.2778 1.2778 1.3348 1.3348 1.3401 1.3401 1.6407 1.6407 1.6900 1.6900 1.8200 1.8200 1.9637 1.9637 2.0316 2.0316 2.1117 2.1117 4.9020 4.9020 8.3160 8.3160 9.4214 9.4214 9.5618 9.5618 9.7828 9.7828 9.9079 9.9079 k = 0.5658 0.0988 0.3116 ( 21696 PWs) bands (ev): -15.1015 -15.1015 -15.1004 -15.1004 -11.9581 -11.9581 -11.0095 -11.0095 -10.9288 -10.9288 -10.9210 -10.9210 -10.5892 -10.5892 -10.5638 -10.5638 -4.6795 -4.6795 -3.9223 -3.9223 -3.9014 -3.9014 -2.6041 -2.6041 -2.5772 -2.5772 -2.4817 -2.4817 -2.4562 -2.4562 -1.2620 -1.2620 -0.9160 -0.9160 -0.8740 -0.8740 0.3154 0.3154 0.5308 0.5308 0.6907 0.6907 0.9869 0.9869 1.0975 1.0975 1.2957 1.2957 1.3382 1.3382 1.3469 1.3469 1.6326 1.6326 1.6670 1.6670 1.8072 1.8072 1.9497 1.9497 2.0189 2.0189 2.1163 2.1163 4.9157 4.9157 8.3660 8.3660 9.4086 9.4086 9.5530 9.5530 9.8072 9.8072 9.9486 9.9486 k = 0.5724 0.0798 0.3223 ( 21696 PWs) bands (ev): -15.1015 -15.1015 -15.1001 -15.1001 -11.9579 -11.9579 -11.0063 -11.0063 -10.9314 -10.9314 -10.9229 -10.9229 -10.5922 -10.5922 -10.5620 -10.5620 -4.6765 -4.6765 -3.9203 -3.9203 -3.8977 -3.8977 -2.5966 -2.5966 -2.5695 -2.5695 -2.4804 -2.4804 -2.4545 -2.4545 -1.2469 -1.2469 -0.9262 -0.9262 -0.8835 -0.8835 0.3140 0.3140 0.5110 0.5110 0.6901 0.6901 0.9707 0.9707 1.1031 1.1031 1.3124 1.3124 1.3413 1.3413 1.3545 1.3545 1.6246 1.6246 1.6430 1.6430 1.7953 1.7953 1.9350 1.9350 2.0057 2.0057 2.1213 2.1213 4.9295 4.9295 8.4182 8.4182 9.3955 9.3955 9.5433 9.5433 9.8338 9.8338 9.9882 9.9882 k = 0.5789 0.0608 0.3330 ( 21683 PWs) bands (ev): -15.1015 -15.1015 -15.0998 -15.0998 -11.9578 -11.9578 -11.0031 -11.0031 -10.9339 -10.9339 -10.9249 -10.9249 -10.5954 -10.5954 -10.5601 -10.5601 -4.6735 -4.6735 -3.9183 -3.9183 -3.8941 -3.8941 -2.5895 -2.5895 -2.5614 -2.5614 -2.4791 -2.4791 -2.4526 -2.4526 -1.2312 -1.2312 -0.9363 -0.9363 -0.8931 -0.8931 0.3106 0.3106 0.4942 0.4942 0.6895 0.6895 0.9536 0.9536 1.1096 1.1096 1.3267 1.3267 1.3445 1.3445 1.3632 1.3632 1.6152 1.6152 1.6206 1.6206 1.7842 1.7842 1.9200 1.9200 1.9922 1.9922 2.1266 2.1266 4.9431 4.9431 8.4715 8.4715 9.3827 9.3827 9.5326 9.5326 9.8624 9.8624 10.0247 10.0247 k = 0.5855 0.0418 0.3438 ( 21687 PWs) bands (ev): -15.1016 -15.1016 -15.0994 -15.0994 -11.9576 -11.9576 -10.9998 -10.9998 -10.9363 -10.9363 -10.9268 -10.9268 -10.5987 -10.5987 -10.5581 -10.5581 -4.6706 -4.6706 -3.9163 -3.9163 -3.8907 -3.8907 -2.5832 -2.5832 -2.5532 -2.5532 -2.4777 -2.4777 -2.4505 -2.4505 -1.2155 -1.2155 -0.9462 -0.9462 -0.9029 -0.9029 0.3045 0.3045 0.4815 0.4815 0.6890 0.6890 0.9361 0.9361 1.1169 1.1169 1.3359 1.3359 1.3497 1.3497 1.3726 1.3726 1.5939 1.5939 1.6114 1.6114 1.7740 1.7740 1.9052 1.9052 1.9787 1.9787 2.1321 2.1321 4.9562 4.9562 8.5248 8.5248 9.3706 9.3706 9.5210 9.5210 9.8926 9.8926 10.0565 10.0565 k = 0.5921 0.0228 0.3545 ( 21694 PWs) bands (ev): -15.1017 -15.1017 -15.0990 -15.0990 -11.9575 -11.9575 -10.9966 -10.9966 -10.9384 -10.9384 -10.9288 -10.9288 -10.6021 -10.6021 -10.5561 -10.5561 -4.6678 -4.6678 -3.9145 -3.9145 -3.8874 -3.8874 -2.5779 -2.5779 -2.5449 -2.5449 -2.4761 -2.4761 -2.4482 -2.4482 -1.2000 -1.2000 -0.9552 -0.9552 -0.9127 -0.9127 0.2953 0.2953 0.4736 0.4736 0.6886 0.6886 0.9182 0.9182 1.1252 1.1252 1.3391 1.3391 1.3578 1.3578 1.3818 1.3818 1.5725 1.5725 1.6051 1.6051 1.7648 1.7648 1.8908 1.8908 1.9654 1.9654 2.1378 2.1378 4.9684 4.9684 8.5769 8.5769 9.3600 9.3600 9.5084 9.5084 9.9242 9.9242 10.0819 10.0819 k = 0.5987 0.0038 0.3653 ( 21693 PWs) bands (ev): -15.1019 -15.1019 -15.0986 -15.0986 -11.9574 -11.9574 -10.9934 -10.9934 -10.9403 -10.9403 -10.9308 -10.9308 -10.6055 -10.6055 -10.5541 -10.5541 -4.6651 -4.6651 -3.9130 -3.9130 -3.8842 -3.8842 -2.5740 -2.5740 -2.5367 -2.5367 -2.4745 -2.4745 -2.4458 -2.4458 -1.1853 -1.1853 -0.9631 -0.9631 -0.9225 -0.9225 0.2834 0.2834 0.4708 0.4708 0.6883 0.6883 0.9003 0.9003 1.1343 1.1343 1.3392 1.3392 1.3658 1.3658 1.3891 1.3891 1.5549 1.5549 1.5997 1.5997 1.7566 1.7566 1.8773 1.8773 1.9526 1.9526 2.1437 2.1437 4.9794 4.9794 8.6263 8.6263 9.3512 9.3512 9.4952 9.4952 9.9568 9.9568 10.0997 10.0997 k = 0.6053-0.0152 0.3760 ( 21689 PWs) bands (ev): -15.1021 -15.1021 -15.0982 -15.0982 -11.9573 -11.9573 -10.9905 -10.9905 -10.9417 -10.9417 -10.9328 -10.9328 -10.6090 -10.6090 -10.5520 -10.5520 -4.6628 -4.6628 -3.9119 -3.9119 -3.8814 -3.8814 -2.5714 -2.5714 -2.5287 -2.5287 -2.4728 -2.4728 -2.4434 -2.4434 -1.1719 -1.1719 -0.9693 -0.9693 -0.9319 -0.9319 0.2695 0.2695 0.4725 0.4725 0.6881 0.6881 0.8828 0.8828 1.1443 1.1443 1.3379 1.3379 1.3718 1.3718 1.3929 1.3929 1.5435 1.5435 1.5950 1.5950 1.7493 1.7493 1.8649 1.8649 1.9405 1.9405 2.1496 2.1496 4.9890 4.9890 8.6717 8.6717 9.3446 9.3446 9.4815 9.4815 9.9900 9.9900 10.1094 10.1094 k = 0.6118-0.0342 0.3868 ( 21694 PWs) bands (ev): -15.1024 -15.1024 -15.0977 -15.0977 -11.9572 -11.9572 -10.9879 -10.9879 -10.9427 -10.9427 -10.9347 -10.9347 -10.6123 -10.6123 -10.5499 -10.5499 -4.6608 -4.6608 -3.9111 -3.9111 -3.8788 -3.8788 -2.5704 -2.5704 -2.5212 -2.5212 -2.4710 -2.4710 -2.4413 -2.4413 -1.1603 -1.1603 -0.9737 -0.9737 -0.9409 -0.9409 0.2548 0.2548 0.4780 0.4780 0.6881 0.6881 0.8660 0.8660 1.1550 1.1550 1.3357 1.3357 1.3730 1.3730 1.3945 1.3945 1.5395 1.5395 1.5910 1.5910 1.7431 1.7431 1.8539 1.8539 1.9294 1.9294 2.1558 2.1558 4.9968 4.9968 8.7119 8.7119 9.3401 9.3401 9.4680 9.4680 10.0233 10.0233 10.1119 10.1119 k = 0.6184-0.0532 0.3975 ( 21705 PWs) bands (ev): -15.1028 -15.1028 -15.0973 -15.0973 -11.9572 -11.9572 -10.9857 -10.9857 -10.9431 -10.9431 -10.9365 -10.9365 -10.6155 -10.6155 -10.5478 -10.5478 -4.6593 -4.6593 -3.9108 -3.9108 -3.8765 -3.8765 -2.5707 -2.5707 -2.5144 -2.5144 -2.4693 -2.4693 -2.4395 -2.4395 -1.1508 -1.1508 -0.9762 -0.9762 -0.9489 -0.9489 0.2402 0.2402 0.4866 0.4866 0.6882 0.6882 0.8503 0.8503 1.1666 1.1666 1.3329 1.3329 1.3660 1.3660 1.3979 1.3979 1.5425 1.5425 1.5877 1.5877 1.7379 1.7379 1.8443 1.8443 1.9194 1.9194 2.1620 2.1620 5.0026 5.0026 8.7459 8.7459 9.3369 9.3369 9.4557 9.4557 10.0556 10.0556 10.1080 10.1080 k = 0.6250-0.0722 0.4082 ( 21728 PWs) bands (ev): -15.1032 -15.1032 -15.0968 -15.0968 -11.9572 -11.9572 -10.9838 -10.9838 -10.9432 -10.9432 -10.9381 -10.9381 -10.6186 -10.6186 -10.5458 -10.5458 -4.6582 -4.6582 -3.9111 -3.9111 -3.8745 -3.8745 -2.5725 -2.5725 -2.5086 -2.5086 -2.4678 -2.4678 -2.4383 -2.4383 -1.1436 -1.1436 -0.9779 -0.9779 -0.9547 -0.9547 0.2266 0.2266 0.4976 0.4976 0.6885 0.6885 0.8361 0.8361 1.1788 1.1788 1.3295 1.3295 1.3531 1.3531 1.4032 1.4032 1.5500 1.5500 1.5853 1.5853 1.7338 1.7338 1.8365 1.8365 1.9109 1.9109 2.1683 2.1683 5.0063 5.0063 8.7732 8.7732 9.3330 9.3330 9.4460 9.4460 10.0846 10.0846 10.0982 10.0982 k = 0.6250-0.0722 0.4082 ( 21728 PWs) bands (ev): -15.1032 -15.1032 -15.0968 -15.0968 -11.9572 -11.9572 -10.9838 -10.9838 -10.9432 -10.9432 -10.9381 -10.9381 -10.6186 -10.6186 -10.5458 -10.5458 -4.6582 -4.6582 -3.9111 -3.9111 -3.8745 -3.8745 -2.5725 -2.5725 -2.5086 -2.5086 -2.4678 -2.4678 -2.4383 -2.4383 -1.1436 -1.1436 -0.9779 -0.9779 -0.9547 -0.9547 0.2266 0.2266 0.4976 0.4976 0.6885 0.6885 0.8361 0.8361 1.1788 1.1788 1.3295 1.3295 1.3531 1.3531 1.4032 1.4032 1.5500 1.5500 1.5853 1.5853 1.7338 1.7338 1.8365 1.8365 1.9109 1.9109 2.1683 2.1683 5.0063 5.0063 8.7732 8.7732 9.3330 9.3330 9.4460 9.4460 10.0846 10.0846 10.0982 10.0982 k = 0.6136-0.0656 0.4268 ( 21697 PWs) bands (ev): -15.1031 -15.1031 -15.0968 -15.0968 -11.9572 -11.9572 -10.9837 -10.9837 -10.9433 -10.9433 -10.9383 -10.9383 -10.6184 -10.6184 -10.5460 -10.5460 -4.6581 -4.6581 -3.9110 -3.9110 -3.8745 -3.8745 -2.5720 -2.5720 -2.5085 -2.5085 -2.4679 -2.4679 -2.4383 -2.4383 -1.1428 -1.1428 -0.9783 -0.9783 -0.9553 -0.9553 0.2275 0.2275 0.4955 0.4955 0.6891 0.6891 0.8371 0.8371 1.1772 1.1772 1.3300 1.3300 1.3541 1.3541 1.4034 1.4034 1.5497 1.5497 1.5851 1.5851 1.7331 1.7331 1.8340 1.8340 1.9141 1.9141 2.1672 2.1672 5.0066 5.0066 8.7754 8.7754 9.3319 9.3319 9.4447 9.4447 10.0863 10.0863 10.0948 10.0948 k = 0.6023-0.0590 0.4454 ( 21694 PWs) bands (ev): -15.1030 -15.1030 -15.0969 -15.0969 -11.9571 -11.9571 -10.9832 -10.9832 -10.9435 -10.9435 -10.9388 -10.9388 -10.6178 -10.6178 -10.5464 -10.5464 -4.6579 -4.6579 -3.9106 -3.9106 -3.8745 -3.8745 -2.5708 -2.5708 -2.5084 -2.5084 -2.4682 -2.4682 -2.4383 -2.4383 -1.1402 -1.1402 -0.9798 -0.9798 -0.9570 -0.9570 0.2302 0.2302 0.4893 0.4893 0.6909 0.6909 0.8398 0.8398 1.1726 1.1726 1.3314 1.3314 1.3569 1.3569 1.4039 1.4039 1.5486 1.5486 1.5844 1.5844 1.7310 1.7310 1.8276 1.8276 1.9224 1.9224 2.1637 2.1637 5.0077 5.0077 8.7820 8.7820 9.3285 9.3285 9.4410 9.4410 10.0867 10.0867 10.0940 10.0940 k = 0.5909-0.0525 0.4639 ( 21686 PWs) bands (ev): -15.1029 -15.1029 -15.0970 -15.0970 -11.9571 -11.9571 -10.9824 -10.9824 -10.9439 -10.9439 -10.9395 -10.9395 -10.6169 -10.6169 -10.5472 -10.5472 -4.6577 -4.6577 -3.9100 -3.9100 -3.8745 -3.8745 -2.5688 -2.5688 -2.5084 -2.5084 -2.4686 -2.4686 -2.4382 -2.4382 -1.1361 -1.1361 -0.9821 -0.9821 -0.9597 -0.9597 0.2348 0.2348 0.4794 0.4794 0.6934 0.6934 0.8443 0.8443 1.1654 1.1654 1.3337 1.3337 1.3617 1.3617 1.4045 1.4045 1.5466 1.5466 1.5833 1.5833 1.7277 1.7277 1.8193 1.8193 1.9341 1.9341 2.1581 2.1581 5.0093 5.0093 8.7928 8.7928 9.3231 9.3231 9.4353 9.4353 10.0829 10.0829 10.1024 10.1024 k = 0.5795-0.0459 0.4825 ( 21687 PWs) bands (ev): -15.1027 -15.1027 -15.0972 -15.0972 -11.9571 -11.9571 -10.9814 -10.9814 -10.9445 -10.9445 -10.9404 -10.9404 -10.6157 -10.6157 -10.5482 -10.5482 -4.6574 -4.6574 -3.9092 -3.9092 -3.8744 -3.8744 -2.5660 -2.5660 -2.5084 -2.5084 -2.4692 -2.4692 -2.4382 -2.4382 -1.1305 -1.1305 -0.9854 -0.9854 -0.9633 -0.9633 0.2411 0.2411 0.4664 0.4664 0.6964 0.6964 0.8502 0.8502 1.1559 1.1559 1.3368 1.3368 1.3681 1.3681 1.4049 1.4049 1.5436 1.5436 1.5819 1.5819 1.7235 1.7235 1.8105 1.8105 1.9476 1.9476 2.1503 2.1503 5.0115 5.0115 8.8070 8.8070 9.3156 9.3156 9.4280 9.4280 10.0814 10.0814 10.1135 10.1135 k = 0.5682-0.0394 0.5010 ( 21689 PWs) bands (ev): -15.1024 -15.1024 -15.0974 -15.0974 -11.9570 -11.9570 -10.9802 -10.9802 -10.9453 -10.9453 -10.9415 -10.9415 -10.6143 -10.6143 -10.5494 -10.5494 -4.6570 -4.6570 -3.9083 -3.9083 -3.8744 -3.8744 -2.5626 -2.5626 -2.5087 -2.5087 -2.4698 -2.4698 -2.4381 -2.4381 -1.1237 -1.1237 -0.9895 -0.9895 -0.9675 -0.9675 0.2491 0.2491 0.4509 0.4509 0.6995 0.6995 0.8574 0.8574 1.1448 1.1448 1.3405 1.3405 1.3762 1.3762 1.4048 1.4048 1.5395 1.5395 1.5804 1.5804 1.7188 1.7188 1.8021 1.8021 1.9621 1.9621 2.1407 2.1407 5.0140 5.0140 8.8241 8.8241 9.3067 9.3067 9.4196 9.4196 10.0826 10.0826 10.1254 10.1254 k = 0.5568-0.0328 0.5196 ( 21691 PWs) bands (ev): -15.1021 -15.1021 -15.0977 -15.0977 -11.9570 -11.9570 -10.9788 -10.9788 -10.9463 -10.9463 -10.9425 -10.9425 -10.6128 -10.6128 -10.5507 -10.5507 -4.6565 -4.6565 -3.9072 -3.9072 -3.8744 -3.8744 -2.5586 -2.5586 -2.5094 -2.5094 -2.4703 -2.4703 -2.4379 -2.4379 -1.1158 -1.1158 -0.9943 -0.9943 -0.9721 -0.9721 0.2589 0.2589 0.4336 0.4336 0.7023 0.7023 0.8654 0.8654 1.1328 1.1328 1.3449 1.3449 1.3854 1.3854 1.4042 1.4042 1.5339 1.5339 1.5790 1.5790 1.7139 1.7139 1.7944 1.7944 1.9772 1.9772 2.1295 2.1295 5.0168 5.0168 8.8427 8.8427 9.2971 9.2971 9.4108 9.4108 10.0864 10.0864 10.1366 10.1366 k = 0.5455-0.0262 0.5381 ( 21703 PWs) bands (ev): -15.1017 -15.1017 -15.0980 -15.0980 -11.9569 -11.9569 -10.9774 -10.9774 -10.9474 -10.9474 -10.9434 -10.9434 -10.6113 -10.6113 -10.5521 -10.5521 -4.6561 -4.6561 -3.9061 -3.9061 -3.8744 -3.8744 -2.5543 -2.5543 -2.5106 -2.5106 -2.4708 -2.4708 -2.4376 -2.4376 -1.1073 -1.1073 -0.9995 -0.9995 -0.9769 -0.9769 0.2704 0.2704 0.4151 0.4151 0.7046 0.7046 0.8737 0.8737 1.1206 1.1206 1.3496 1.3496 1.3945 1.3945 1.4040 1.4040 1.5268 1.5268 1.5778 1.5778 1.7093 1.7093 1.7879 1.7879 1.9926 1.9926 2.1170 2.1170 5.0195 5.0195 8.8616 8.8616 9.2877 9.2877 9.4017 9.4017 10.0926 10.0926 10.1456 10.1456 k = 0.5341-0.0197 0.5567 ( 21706 PWs) bands (ev): -15.1013 -15.1013 -15.0984 -15.0984 -11.9569 -11.9569 -10.9760 -10.9760 -10.9485 -10.9485 -10.9443 -10.9443 -10.6099 -10.6099 -10.5533 -10.5533 -4.6557 -4.6557 -3.9051 -3.9051 -3.8744 -3.8744 -2.5497 -2.5497 -2.5124 -2.5124 -2.4711 -2.4711 -2.4373 -2.4373 -1.0988 -1.0988 -1.0046 -1.0046 -0.9816 -0.9816 0.2834 0.2834 0.3958 0.3958 0.7065 0.7065 0.8817 0.8817 1.1093 1.1093 1.3545 1.3545 1.3971 1.3971 1.4103 1.4103 1.5183 1.5183 1.5769 1.5769 1.7055 1.7055 1.7827 1.7827 2.0079 2.0079 2.1035 2.1035 5.0221 5.0221 8.8790 8.8790 9.2798 9.2798 9.3930 9.3930 10.1010 10.1010 10.1508 10.1508 k = 0.5227-0.0131 0.5753 ( 21699 PWs) bands (ev): -15.1008 -15.1008 -15.0988 -15.0988 -11.9568 -11.9568 -10.9749 -10.9749 -10.9493 -10.9493 -10.9451 -10.9451 -10.6088 -10.6088 -10.5544 -10.5544 -4.6553 -4.6553 -3.9043 -3.9043 -3.8744 -3.8744 -2.5454 -2.5454 -2.5146 -2.5146 -2.4712 -2.4712 -2.4370 -2.4370 -1.0914 -1.0914 -1.0087 -1.0087 -0.9861 -0.9861 0.2978 0.2978 0.3766 0.3766 0.7077 0.7077 0.8884 0.8884 1.0999 1.0999 1.3592 1.3592 1.3948 1.3948 1.4207 1.4207 1.5091 1.5091 1.5764 1.5764 1.7026 1.7026 1.7789 1.7789 2.0228 2.0228 2.0896 2.0896 5.0242 5.0242 8.8931 8.8931 9.2747 9.2747 9.3851 9.3851 10.1111 10.1111 10.1513 10.1513 k = 0.5114-0.0066 0.5938 ( 21696 PWs) bands (ev): -15.1003 -15.1003 -15.0993 -15.0993 -11.9568 -11.9568 -10.9742 -10.9742 -10.9497 -10.9497 -10.9457 -10.9457 -10.6080 -10.6080 -10.5551 -10.5551 -4.6551 -4.6551 -3.9037 -3.9037 -3.8745 -3.8745 -2.5419 -2.5419 -2.5167 -2.5167 -2.4713 -2.4713 -2.4367 -2.4367 -1.0862 -1.0862 -1.0109 -1.0109 -0.9897 -0.9897 0.3127 0.3127 0.3585 0.3585 0.7084 0.7084 0.8930 0.8930 1.0936 1.0936 1.3629 1.3629 1.3921 1.3921 1.4299 1.4299 1.5008 1.5008 1.5761 1.5761 1.7008 1.7008 1.7766 1.7766 2.0362 2.0362 2.0766 2.0766 5.0257 5.0257 8.9021 8.9021 9.2726 9.2726 9.3791 9.3791 10.1228 10.1228 10.1464 10.1464 k = 0.5000-0.0000 0.6124 ( 21692 PWs) bands (ev): -15.0998 -15.0998 -15.0998 -15.0998 -11.9568 -11.9568 -10.9739 -10.9739 -10.9498 -10.9498 -10.9460 -10.9460 -10.6077 -10.6077 -10.5553 -10.5553 -4.6550 -4.6550 -3.9035 -3.9035 -3.8745 -3.8745 -2.5404 -2.5404 -2.5176 -2.5176 -2.4713 -2.4713 -2.4366 -2.4366 -1.0844 -1.0844 -1.0113 -1.0113 -0.9914 -0.9914 0.3220 0.3220 0.3481 0.3481 0.7086 0.7086 0.8946 0.8946 1.0913 1.0913 1.3645 1.3645 1.3909 1.3909 1.4340 1.4340 1.4971 1.4971 1.5761 1.5761 1.7003 1.7003 1.7759 1.7759 2.0434 2.0434 2.0695 2.0695 5.0262 5.0262 8.9052 8.9052 9.2725 9.2725 9.3766 9.3766 10.1347 10.1347 10.1369 10.1369 k = 0.5000-0.0000 0.6124 ( 21692 PWs) bands (ev): -15.0998 -15.0998 -15.0998 -15.0998 -11.9568 -11.9568 -10.9739 -10.9739 -10.9498 -10.9498 -10.9460 -10.9460 -10.6077 -10.6077 -10.5553 -10.5553 -4.6550 -4.6550 -3.9035 -3.9035 -3.8745 -3.8745 -2.5404 -2.5404 -2.5176 -2.5176 -2.4713 -2.4713 -2.4366 -2.4366 -1.0844 -1.0844 -1.0113 -1.0113 -0.9914 -0.9914 0.3220 0.3220 0.3481 0.3481 0.7086 0.7086 0.8946 0.8946 1.0913 1.0913 1.3645 1.3645 1.3909 1.3909 1.4340 1.4340 1.4971 1.4971 1.5761 1.5761 1.7003 1.7003 1.7759 1.7759 2.0434 2.0434 2.0695 2.0695 5.0262 5.0262 8.9052 8.9052 9.2725 9.2725 9.3766 9.3766 10.1347 10.1347 10.1369 10.1369 k = 0.5000 0.0131 0.5938 ( 21690 PWs) bands (ev): -15.0998 -15.0998 -15.0998 -15.0998 -11.9568 -11.9568 -10.9745 -10.9745 -10.9494 -10.9494 -10.9456 -10.9456 -10.6076 -10.6076 -10.5554 -10.5554 -4.6552 -4.6552 -3.9036 -3.9036 -3.8747 -3.8747 -2.5409 -2.5409 -2.5181 -2.5181 -2.4714 -2.4714 -2.4369 -2.4369 -1.0880 -1.0880 -1.0094 -1.0094 -0.9894 -0.9894 0.3226 0.3226 0.3489 0.3489 0.7084 0.7084 0.8956 0.8956 1.0913 1.0913 1.3643 1.3643 1.3904 1.3904 1.4341 1.4341 1.4971 1.4971 1.5764 1.5764 1.7014 1.7014 1.7773 1.7773 2.0436 2.0436 2.0697 2.0697 5.0252 5.0252 8.8977 8.8977 9.2747 9.2747 9.3797 9.3797 10.1313 10.1313 10.1352 10.1352 k = 0.5000 0.0262 0.5753 ( 21698 PWs) bands (ev): -15.0998 -15.0998 -15.0998 -15.0998 -11.9568 -11.9568 -10.9762 -10.9762 -10.9486 -10.9486 -10.9446 -10.9446 -10.6070 -10.6070 -10.5556 -10.5556 -4.6559 -4.6559 -3.9042 -3.9042 -3.8754 -3.8754 -2.5425 -2.5425 -2.5196 -2.5196 -2.4719 -2.4719 -2.4376 -2.4376 -1.0975 -1.0975 -1.0050 -1.0050 -0.9835 -0.9835 0.3243 0.3243 0.3516 0.3516 0.7077 0.7077 0.8985 0.8985 1.0911 1.0911 1.3639 1.3639 1.3892 1.3892 1.4340 1.4340 1.4980 1.4980 1.5776 1.5776 1.7047 1.7047 1.7816 1.7816 2.0442 2.0442 2.0703 2.0703 5.0224 5.0224 8.8763 8.8763 9.2809 9.2809 9.3887 9.3887 10.1202 10.1202 10.1311 10.1311 k = 0.5000 0.0394 0.5567 ( 21702 PWs) bands (ev): -15.0999 -15.0999 -15.0999 -15.0999 -11.9569 -11.9569 -10.9787 -10.9787 -10.9474 -10.9474 -10.9429 -10.9429 -10.6061 -10.6061 -10.5560 -10.5560 -4.6570 -4.6570 -3.9050 -3.9050 -3.8765 -3.8765 -2.5451 -2.5451 -2.5221 -2.5221 -2.4726 -2.4726 -2.4389 -2.4389 -1.1107 -1.1107 -0.9994 -0.9994 -0.9745 -0.9745 0.3261 0.3261 0.3571 0.3571 0.7066 0.7066 0.9032 0.9032 1.0908 1.0908 1.3631 1.3631 1.3870 1.3870 1.4321 1.4321 1.5013 1.5013 1.5795 1.5795 1.7099 1.7099 1.7888 1.7888 2.0451 2.0451 2.0712 2.0712 5.0176 5.0176 8.8433 8.8433 9.2897 9.2897 9.4026 9.4026 10.1022 10.1022 10.1246 10.1246 k = 0.5000 0.0525 0.5381 ( 21716 PWs) bands (ev): -15.1000 -15.1000 -15.0999 -15.0999 -11.9570 -11.9570 -10.9817 -10.9817 -10.9460 -10.9460 -10.9407 -10.9407 -10.6049 -10.6049 -10.5566 -10.5566 -4.6585 -4.6585 -3.9062 -3.9062 -3.8780 -3.8780 -2.5487 -2.5487 -2.5256 -2.5256 -2.4735 -2.4735 -2.4405 -2.4405 -1.1261 -1.1261 -0.9929 -0.9929 -0.9636 -0.9636 0.3273 0.3273 0.3658 0.3658 0.7051 0.7051 0.9097 0.9097 1.0905 1.0905 1.3619 1.3619 1.3840 1.3840 1.4269 1.4269 1.5089 1.5089 1.5823 1.5823 1.7165 1.7165 1.7987 1.7987 2.0463 2.0463 2.0725 2.0725 5.0111 5.0111 8.8017 8.8017 9.3001 9.3001 9.4198 9.4198 10.0785 10.0785 10.1154 10.1154 k = 0.5000 0.0656 0.5196 ( 21708 PWs) bands (ev): -15.1001 -15.1001 -15.1000 -15.1000 -11.9571 -11.9571 -10.9850 -10.9850 -10.9444 -10.9444 -10.9383 -10.9383 -10.6033 -10.6033 -10.5573 -10.5573 -4.6603 -4.6603 -3.9076 -3.9076 -3.8800 -3.8800 -2.5532 -2.5532 -2.5300 -2.5300 -2.4745 -2.4745 -2.4424 -2.4424 -1.1427 -1.1427 -0.9855 -0.9855 -0.9520 -0.9520 0.3277 0.3277 0.3779 0.3779 0.7035 0.7035 0.9176 0.9176 1.0900 1.0900 1.3603 1.3603 1.3802 1.3802 1.4182 1.4182 1.5210 1.5210 1.5859 1.5859 1.7243 1.7243 1.8111 1.8111 2.0478 2.0478 2.0740 2.0740 5.0029 5.0029 8.7538 8.7538 9.3117 9.3117 9.4388 9.4388 10.0503 10.0503 10.1034 10.1034 k = 0.5000 0.0787 0.5010 ( 21702 PWs) bands (ev): -15.1002 -15.1002 -15.1001 -15.1001 -11.9572 -11.9572 -10.9885 -10.9885 -10.9426 -10.9426 -10.9358 -10.9358 -10.6015 -10.6015 -10.5581 -10.5581 -4.6625 -4.6625 -3.9094 -3.9094 -3.8823 -3.8823 -2.5587 -2.5587 -2.5353 -2.5353 -2.4755 -2.4755 -2.4445 -2.4445 -1.1599 -1.1599 -0.9771 -0.9771 -0.9402 -0.9402 0.3274 0.3274 0.3931 0.3931 0.7017 0.7017 0.9269 0.9269 1.0895 1.0895 1.3582 1.3582 1.3754 1.3754 1.4067 1.4067 1.5370 1.5370 1.5905 1.5905 1.7330 1.7330 1.8256 1.8256 2.0496 2.0496 2.0758 2.0758 4.9933 4.9933 8.7015 8.7015 9.3241 9.3241 9.4581 9.4581 10.0189 10.0189 10.0884 10.0884 k = 0.5000 0.0919 0.4825 ( 21690 PWs) bands (ev): -15.1004 -15.1004 -15.1001 -15.1001 -11.9573 -11.9573 -10.9921 -10.9921 -10.9406 -10.9406 -10.9332 -10.9332 -10.5995 -10.5995 -10.5591 -10.5591 -4.6650 -4.6650 -3.9113 -3.9113 -3.8849 -3.8849 -2.5650 -2.5650 -2.5414 -2.5414 -2.4766 -2.4766 -2.4467 -2.4467 -1.1775 -1.1775 -0.9679 -0.9679 -0.9284 -0.9284 0.3266 0.3266 0.4109 0.4109 0.7000 0.7000 0.9374 0.9374 1.0889 1.0889 1.3556 1.3556 1.3695 1.3695 1.3937 1.3937 1.5561 1.5561 1.5959 1.5959 1.7427 1.7427 1.8420 1.8420 2.0515 2.0515 2.0778 2.0778 4.9823 4.9823 8.6464 8.6464 9.3373 9.3373 9.4769 9.4769 9.9855 9.9855 10.0702 10.0702 k = 0.5000 0.1050 0.4639 ( 21686 PWs) bands (ev): -15.1005 -15.1005 -15.1002 -15.1002 -11.9574 -11.9574 -10.9957 -10.9957 -10.9384 -10.9384 -10.9307 -10.9307 -10.5973 -10.5973 -10.5601 -10.5601 -4.6677 -4.6677 -3.9133 -3.9133 -3.8879 -3.8879 -2.5720 -2.5720 -2.5481 -2.5481 -2.4776 -2.4776 -2.4489 -2.4489 -1.1952 -1.1952 -0.9580 -0.9580 -0.9169 -0.9169 0.3255 0.3255 0.4308 0.4308 0.6983 0.6983 0.9487 0.9487 1.0883 1.0883 1.3523 1.3523 1.3618 1.3618 1.3805 1.3805 1.5773 1.5773 1.6021 1.6021 1.7532 1.7532 1.8597 1.8597 2.0535 2.0535 2.0799 2.0799 4.9702 4.9702 8.5897 8.5897 9.3511 9.3511 9.4944 9.4944 9.9513 9.9513 10.0486 10.0486 k = 0.5000 0.1181 0.4454 ( 21688 PWs) bands (ev): -15.1007 -15.1007 -15.1004 -15.1004 -11.9576 -11.9576 -10.9993 -10.9993 -10.9360 -10.9360 -10.9282 -10.9282 -10.5950 -10.5950 -10.5613 -10.5613 -4.6706 -4.6706 -3.9155 -3.9155 -3.8911 -3.8911 -2.5795 -2.5795 -2.5552 -2.5552 -2.4787 -2.4787 -2.4510 -2.4510 -1.2127 -1.2127 -0.9476 -0.9476 -0.9057 -0.9057 0.3241 0.3241 0.4525 0.4525 0.6968 0.6968 0.9606 0.9606 1.0876 1.0876 1.3467 1.3467 1.3523 1.3523 1.3694 1.3694 1.5996 1.5996 1.6094 1.6094 1.7646 1.7646 1.8783 1.8783 2.0555 2.0555 2.0820 2.0820 4.9573 4.9573 8.5325 8.5325 9.3653 9.3653 9.5105 9.5105 9.9170 9.9170 10.0234 10.0234 k = 0.5000 0.1312 0.4268 ( 21688 PWs) bands (ev): -15.1008 -15.1008 -15.1005 -15.1005 -11.9578 -11.9578 -11.0028 -11.0028 -10.9336 -10.9336 -10.9259 -10.9259 -10.5926 -10.5926 -10.5625 -10.5625 -4.6735 -4.6735 -3.9178 -3.9178 -3.8944 -3.8944 -2.5874 -2.5874 -2.5626 -2.5626 -2.4797 -2.4797 -2.4530 -2.4530 -1.2297 -1.2297 -0.9370 -0.9370 -0.8949 -0.8949 0.3225 0.3225 0.4756 0.4756 0.6956 0.6956 0.9729 0.9729 1.0868 1.0868 1.3331 1.3331 1.3468 1.3468 1.3609 1.3609 1.6154 1.6154 1.6246 1.6246 1.7768 1.7768 1.8975 1.8975 2.0576 2.0576 2.0841 2.0841 4.9437 4.9437 8.4757 8.4757 9.3797 9.3797 9.5250 9.5250 9.8837 9.8837 9.9947 9.9947 k = 0.5000 0.1443 0.4082 ( 21682 PWs) bands (ev): -15.1010 -15.1010 -15.1006 -15.1006 -11.9579 -11.9579 -11.0062 -11.0062 -10.9310 -10.9310 -10.9236 -10.9236 -10.5902 -10.5902 -10.5638 -10.5638 -4.6766 -4.6766 -3.9200 -3.9200 -3.8980 -3.8980 -2.5955 -2.5955 -2.5702 -2.5702 -2.4808 -2.4808 -2.4548 -2.4548 -1.2462 -1.2462 -0.9263 -0.9263 -0.8845 -0.8845 0.3208 0.3208 0.4996 0.4996 0.6946 0.6946 0.9854 0.9854 1.0860 1.0860 1.3159 1.3159 1.3425 1.3425 1.3538 1.3538 1.6238 1.6238 1.6477 1.6477 1.7898 1.7898 1.9167 1.9167 2.0598 2.0598 2.0862 2.0862 4.9297 4.9297 8.4201 8.4201 9.3940 9.3940 9.5379 9.5379 9.8517 9.8517 9.9628 9.9628 k = 0.5000 0.1575 0.3897 ( 21672 PWs) bands (ev): -15.1012 -15.1012 -15.1007 -15.1007 -11.9581 -11.9581 -11.0095 -11.0095 -10.9285 -10.9285 -10.9215 -10.9215 -10.5878 -10.5878 -10.5651 -10.5651 -4.6796 -4.6796 -3.9222 -3.9222 -3.9015 -3.9015 -2.6037 -2.6037 -2.5777 -2.5777 -2.4819 -2.4819 -2.4564 -2.4564 -1.2618 -1.2618 -0.9160 -0.9160 -0.8746 -0.8746 0.3190 0.3190 0.5241 0.5241 0.6940 0.6940 0.9978 0.9978 1.0851 1.0851 1.2975 1.2975 1.3383 1.3383 1.3473 1.3473 1.6321 1.6321 1.6707 1.6707 1.8034 1.8034 1.9355 1.9355 2.0620 2.0620 2.0883 2.0883 4.9157 4.9157 8.3666 8.3666 9.4080 9.4080 9.5493 9.5493 9.8217 9.8217 9.9284 9.9284 k = 0.5000 0.1706 0.3711 ( 21680 PWs) bands (ev): -15.1014 -15.1014 -15.1008 -15.1008 -11.9582 -11.9582 -11.0125 -11.0125 -10.9260 -10.9260 -10.9195 -10.9195 -10.5854 -10.5854 -10.5664 -10.5664 -4.6825 -4.6825 -3.9242 -3.9242 -3.9052 -3.9052 -2.6116 -2.6116 -2.5850 -2.5850 -2.4831 -2.4831 -2.4578 -2.4578 -1.2765 -1.2765 -0.9060 -0.9060 -0.8651 -0.8651 0.3172 0.3172 0.5486 0.5486 0.6938 0.6938 1.0099 1.0099 1.0841 1.0841 1.2786 1.2786 1.3341 1.3341 1.3411 1.3411 1.6405 1.6405 1.6926 1.6926 1.8175 1.8175 1.9533 1.9533 2.0642 2.0642 2.0903 2.0903 4.9019 4.9019 8.3158 8.3158 9.4212 9.4212 9.5593 9.5593 9.7940 9.7940 9.8927 9.8927 k = 0.5000 0.1837 0.3526 ( 21686 PWs) bands (ev): -15.1015 -15.1015 -15.1009 -15.1009 -11.9584 -11.9584 -11.0153 -11.0153 -10.9237 -10.9237 -10.9176 -10.9176 -10.5832 -10.5832 -10.5677 -10.5677 -4.6853 -4.6853 -3.9261 -3.9261 -3.9087 -3.9087 -2.6192 -2.6192 -2.5920 -2.5920 -2.4842 -2.4842 -2.4590 -2.4590 -1.2901 -1.2901 -0.8968 -0.8968 -0.8562 -0.8562 0.3154 0.3154 0.5727 0.5727 0.6939 0.6939 1.0216 1.0216 1.0831 1.0831 1.2597 1.2597 1.3300 1.3300 1.3354 1.3354 1.6486 1.6486 1.7130 1.7130 1.8321 1.8321 1.9698 1.9698 2.0666 2.0666 2.0923 2.0923 4.8886 4.8886 8.2685 8.2685 9.4336 9.4336 9.5682 9.5682 9.7689 9.7689 9.8568 9.8568 k = 0.5000 0.1968 0.3340 ( 21688 PWs) bands (ev): -15.1017 -15.1017 -15.1010 -15.1010 -11.9585 -11.9585 -11.0178 -11.0178 -10.9214 -10.9214 -10.9159 -10.9159 -10.5811 -10.5811 -10.5689 -10.5689 -4.6879 -4.6879 -3.9278 -3.9278 -3.9122 -3.9122 -2.6263 -2.6263 -2.5985 -2.5985 -2.4852 -2.4852 -2.4600 -2.4600 -1.3024 -1.3024 -0.8884 -0.8884 -0.8480 -0.8480 0.3137 0.3137 0.5956 0.5956 0.6945 0.6945 1.0327 1.0327 1.0821 1.0821 1.2411 1.2411 1.3261 1.3261 1.3301 1.3301 1.6565 1.6565 1.7314 1.7314 1.8467 1.8467 1.9842 1.9842 2.0693 2.0693 2.0943 2.0943 4.8760 4.8760 8.2251 8.2251 9.4448 9.4448 9.5760 9.5760 9.7466 9.7466 9.8220 9.8220 k = 0.5000 0.2099 0.3155 ( 21664 PWs) bands (ev): -15.1018 -15.1018 -15.1011 -15.1011 -11.9587 -11.9587 -11.0201 -11.0201 -10.9195 -10.9195 -10.9143 -10.9143 -10.5792 -10.5792 -10.5701 -10.5701 -4.6903 -4.6903 -3.9291 -3.9291 -3.9155 -3.9155 -2.6327 -2.6327 -2.6044 -2.6044 -2.4862 -2.4862 -2.4608 -2.4608 -1.3133 -1.3133 -0.8810 -0.8810 -0.8405 -0.8405 0.3121 0.3121 0.6168 0.6168 0.6957 0.6957 1.0430 1.0430 1.0811 1.0811 1.2232 1.2232 1.3224 1.3224 1.3253 1.3253 1.6638 1.6638 1.7475 1.7475 1.8609 1.8609 1.9962 1.9962 2.0722 2.0722 2.0964 2.0964 4.8645 4.8645 8.1863 8.1863 9.4547 9.4547 9.5829 9.5829 9.7272 9.7272 9.7896 9.7896 k = 0.5000 0.2231 0.2969 ( 21668 PWs) bands (ev): -15.1019 -15.1019 -15.1012 -15.1012 -11.9588 -11.9588 -11.0220 -11.0220 -10.9177 -10.9177 -10.9129 -10.9129 -10.5776 -10.5776 -10.5711 -10.5711 -4.6924 -4.6924 -3.9302 -3.9302 -3.9186 -3.9186 -2.6383 -2.6383 -2.6096 -2.6096 -2.4871 -2.4871 -2.4614 -2.4614 -1.3228 -1.3228 -0.8746 -0.8746 -0.8338 -0.8338 0.3107 0.3107 0.6353 0.6353 0.6977 0.6977 1.0523 1.0523 1.0802 1.0802 1.2064 1.2064 1.3190 1.3190 1.3213 1.3213 1.6703 1.6703 1.7612 1.7612 1.8745 1.8745 2.0054 2.0054 2.0752 2.0752 2.0988 2.0988 4.8543 4.8543 8.1526 8.1526 9.4631 9.4631 9.5890 9.5890 9.7107 9.7107 9.7606 9.7606 k = 0.5000 0.2362 0.2784 ( 21662 PWs) bands (ev): -15.1021 -15.1021 -15.1012 -15.1012 -11.9589 -11.9589 -11.0236 -11.0236 -10.9163 -10.9163 -10.9117 -10.9117 -10.5762 -10.5762 -10.5720 -10.5720 -4.6942 -4.6942 -3.9309 -3.9309 -3.9214 -3.9214 -2.6431 -2.6431 -2.6140 -2.6140 -2.4879 -2.4879 -2.4619 -2.4619 -1.3306 -1.3306 -0.8693 -0.8693 -0.8281 -0.8281 0.3095 0.3095 0.6503 0.6503 0.7009 0.7009 1.0606 1.0606 1.0794 1.0794 1.1912 1.1912 1.3158 1.3158 1.3181 1.3181 1.6760 1.6760 1.7724 1.7724 1.8867 1.8867 2.0119 2.0119 2.0780 2.0780 2.1015 2.1015 4.8455 4.8455 8.1244 8.1244 9.4701 9.4701 9.5943 9.5943 9.6968 9.6968 9.7363 9.7363 k = 0.5000 0.2493 0.2598 ( 21656 PWs) bands (ev): -15.1021 -15.1021 -15.1013 -15.1013 -11.9590 -11.9590 -11.0249 -11.0249 -10.9152 -10.9152 -10.9107 -10.9107 -10.5751 -10.5751 -10.5727 -10.5727 -4.6956 -4.6956 -3.9312 -3.9312 -3.9239 -3.9239 -2.6469 -2.6469 -2.6175 -2.6175 -2.4885 -2.4885 -2.4623 -2.4623 -1.3368 -1.3368 -0.8652 -0.8652 -0.8235 -0.8235 0.3085 0.3085 0.6611 0.6611 0.7052 0.7052 1.0676 1.0676 1.0787 1.0787 1.1781 1.1781 1.3131 1.3131 1.3158 1.3158 1.6806 1.6806 1.7811 1.7811 1.8970 1.8970 2.0161 2.0161 2.0803 2.0803 2.1043 2.1043 4.8385 4.8385 8.1021 8.1021 9.4754 9.4754 9.5986 9.5986 9.6852 9.6852 9.7174 9.7174 k = 0.5000 0.2624 0.2412 ( 21662 PWs) bands (ev): -15.1022 -15.1022 -15.1013 -15.1013 -11.9590 -11.9590 -11.0258 -11.0258 -10.9144 -10.9144 -10.9100 -10.9100 -10.5743 -10.5743 -10.5732 -10.5732 -4.6966 -4.6966 -3.9312 -3.9312 -3.9259 -3.9259 -2.6496 -2.6496 -2.6200 -2.6200 -2.4890 -2.4890 -2.4626 -2.4626 -1.3413 -1.3413 -0.8623 -0.8623 -0.8201 -0.8201 0.3078 0.3078 0.6678 0.6678 0.7099 0.7099 1.0730 1.0730 1.0783 1.0783 1.1679 1.1679 1.3110 1.3110 1.3141 1.3141 1.6839 1.6839 1.7873 1.7873 1.9048 1.9048 2.0185 2.0185 2.0820 2.0820 2.1068 2.1068 4.8334 4.8334 8.0859 8.0859 9.4792 9.4792 9.6019 9.6019 9.6761 9.6761 9.7046 9.7046 k = 0.5000 0.2756 0.2227 ( 21678 PWs) bands (ev): -15.1022 -15.1022 -15.1013 -15.1013 -11.9591 -11.9591 -11.0263 -11.0263 -10.9140 -10.9140 -10.9095 -10.9095 -10.5739 -10.5739 -10.5735 -10.5735 -4.6972 -4.6972 -3.9309 -3.9309 -3.9275 -3.9275 -2.6513 -2.6513 -2.6215 -2.6215 -2.4892 -2.4892 -2.4627 -2.4627 -1.3440 -1.3440 -0.8605 -0.8605 -0.8181 -0.8181 0.3074 0.3074 0.6711 0.6711 0.7136 0.7136 1.0762 1.0762 1.0783 1.0783 1.1613 1.1613 1.3097 1.3097 1.3131 1.3131 1.6860 1.6860 1.7911 1.7911 1.9098 1.9098 2.0197 2.0197 2.0829 2.0829 2.1085 2.1085 4.8303 4.8303 8.0761 8.0761 9.4815 9.4815 9.6040 9.6040 9.6699 9.6699 9.6974 9.6974 k = 0.5000 0.2887 0.2041 ( 21668 PWs) bands (ev): -15.1022 -15.1022 -15.1014 -15.1014 -11.9591 -11.9591 -11.0265 -11.0265 -10.9138 -10.9138 -10.9094 -10.9094 -10.5738 -10.5738 -10.5735 -10.5735 -4.6974 -4.6974 -3.9306 -3.9306 -3.9282 -3.9282 -2.6519 -2.6519 -2.6221 -2.6221 -2.4893 -2.4893 -2.4628 -2.4628 -1.3449 -1.3449 -0.8599 -0.8599 -0.8174 -0.8174 0.3072 0.3072 0.6722 0.6722 0.7149 0.7149 1.0770 1.0770 1.0787 1.0787 1.1590 1.1590 1.3092 1.3092 1.3128 1.3128 1.6867 1.6867 1.7923 1.7923 1.9115 1.9115 2.0201 2.0201 2.0832 2.0832 2.1092 2.1092 4.8293 4.8293 8.0728 8.0728 9.4823 9.4823 9.6047 9.6047 9.6677 9.6677 9.6951 9.6951 k = 0.5000 0.2887 0.2041 ( 21668 PWs) bands (ev): -15.1022 -15.1022 -15.1014 -15.1014 -11.9591 -11.9591 -11.0265 -11.0265 -10.9138 -10.9138 -10.9094 -10.9094 -10.5738 -10.5738 -10.5735 -10.5735 -4.6974 -4.6974 -3.9306 -3.9306 -3.9282 -3.9282 -2.6519 -2.6519 -2.6221 -2.6221 -2.4893 -2.4893 -2.4628 -2.4628 -1.3449 -1.3449 -0.8599 -0.8599 -0.8174 -0.8174 0.3072 0.3072 0.6722 0.6722 0.7149 0.7149 1.0770 1.0770 1.0787 1.0787 1.1590 1.1590 1.3092 1.3092 1.3128 1.3128 1.6867 1.6867 1.7923 1.7923 1.9115 1.9115 2.0201 2.0201 2.0832 2.0832 2.1092 2.1092 4.8293 4.8293 8.0728 8.0728 9.4823 9.4823 9.6047 9.6047 9.6677 9.6677 9.6951 9.6951 k = 0.4934 0.2849 0.2256 ( 21679 PWs) bands (ev): -15.1022 -15.1022 -15.1013 -15.1013 -11.9591 -11.9591 -11.0263 -11.0263 -10.9140 -10.9140 -10.9095 -10.9095 -10.5739 -10.5739 -10.5735 -10.5735 -4.6972 -4.6972 -3.9309 -3.9309 -3.9275 -3.9275 -2.6513 -2.6513 -2.6215 -2.6215 -2.4892 -2.4892 -2.4627 -2.4627 -1.3440 -1.3440 -0.8605 -0.8605 -0.8181 -0.8181 0.3074 0.3074 0.6711 0.6711 0.7136 0.7136 1.0762 1.0762 1.0783 1.0783 1.1613 1.1613 1.3097 1.3097 1.3131 1.3131 1.6860 1.6860 1.7910 1.7910 1.9098 1.9098 2.0197 2.0197 2.0829 2.0829 2.1085 2.1085 4.8303 4.8303 8.0761 8.0761 9.4815 9.4815 9.6040 9.6040 9.6699 9.6699 9.6974 9.6974 k = 0.4868 0.2811 0.2471 ( 21662 PWs) bands (ev): -15.1022 -15.1022 -15.1013 -15.1013 -11.9590 -11.9590 -11.0258 -11.0258 -10.9145 -10.9145 -10.9100 -10.9100 -10.5743 -10.5743 -10.5732 -10.5732 -4.6966 -4.6966 -3.9312 -3.9312 -3.9259 -3.9259 -2.6496 -2.6496 -2.6200 -2.6200 -2.4890 -2.4890 -2.4626 -2.4626 -1.3413 -1.3413 -0.8623 -0.8623 -0.8201 -0.8201 0.3078 0.3078 0.6677 0.6677 0.7099 0.7099 1.0729 1.0729 1.0783 1.0783 1.1680 1.1680 1.3110 1.3110 1.3141 1.3141 1.6839 1.6839 1.7873 1.7873 1.9048 1.9048 2.0185 2.0185 2.0819 2.0819 2.1068 2.1068 4.8335 4.8335 8.0860 8.0860 9.4792 9.4792 9.6019 9.6019 9.6761 9.6761 9.7047 9.7047 k = 0.4803 0.2773 0.2686 ( 21670 PWs) bands (ev): -15.1021 -15.1021 -15.1013 -15.1013 -11.9590 -11.9590 -11.0249 -11.0249 -10.9152 -10.9152 -10.9107 -10.9107 -10.5751 -10.5751 -10.5727 -10.5727 -4.6956 -4.6956 -3.9312 -3.9312 -3.9238 -3.9238 -2.6469 -2.6469 -2.6174 -2.6174 -2.4885 -2.4885 -2.4623 -2.4623 -1.3368 -1.3368 -0.8652 -0.8652 -0.8235 -0.8235 0.3085 0.3085 0.6611 0.6611 0.7051 0.7051 1.0674 1.0674 1.0788 1.0788 1.1782 1.1782 1.3131 1.3131 1.3158 1.3158 1.6805 1.6805 1.7811 1.7811 1.8969 1.8969 2.0161 2.0161 2.0801 2.0801 2.1044 2.1044 4.8386 4.8386 8.1022 8.1022 9.4754 9.4754 9.5986 9.5986 9.6851 9.6851 9.7178 9.7178 k = 0.4737 0.2735 0.2901 ( 21681 PWs) bands (ev): -15.1021 -15.1021 -15.1012 -15.1012 -11.9589 -11.9589 -11.0236 -11.0236 -10.9163 -10.9163 -10.9117 -10.9117 -10.5763 -10.5763 -10.5719 -10.5719 -4.6941 -4.6941 -3.9309 -3.9309 -3.9214 -3.9214 -2.6430 -2.6430 -2.6139 -2.6139 -2.4879 -2.4879 -2.4619 -2.4619 -1.3306 -1.3306 -0.8694 -0.8694 -0.8281 -0.8281 0.3095 0.3095 0.6503 0.6503 0.7008 0.7008 1.0601 1.0601 1.0798 1.0798 1.1913 1.1913 1.3159 1.3159 1.3181 1.3181 1.6759 1.6759 1.7723 1.7723 1.8866 1.8866 2.0121 2.0121 2.0768 2.0768 2.1023 2.1023 4.8456 4.8456 8.1247 8.1247 9.4700 9.4700 9.5944 9.5944 9.6961 9.6961 9.7373 9.7373 k = 0.4671 0.2697 0.3116 ( 21672 PWs) bands (ev): -15.1019 -15.1019 -15.1012 -15.1012 -11.9588 -11.9588 -11.0220 -11.0220 -10.9178 -10.9178 -10.9129 -10.9129 -10.5777 -10.5777 -10.5710 -10.5710 -4.6924 -4.6924 -3.9302 -3.9302 -3.9185 -3.9185 -2.6383 -2.6383 -2.6095 -2.6095 -2.4871 -2.4871 -2.4614 -2.4614 -1.3227 -1.3227 -0.8747 -0.8747 -0.8338 -0.8338 0.3107 0.3107 0.6353 0.6353 0.6975 0.6975 1.0513 1.0513 1.0812 1.0812 1.2065 1.2065 1.3193 1.3193 1.3211 1.3211 1.6703 1.6703 1.7609 1.7609 1.8744 1.8744 2.0062 2.0062 2.0715 2.0715 2.1014 2.1014 4.8544 4.8544 8.1530 8.1530 9.4630 9.4630 9.5893 9.5893 9.7089 9.7089 9.7629 9.7629 k = 0.4605 0.2659 0.3330 ( 21656 PWs) bands (ev): -15.1018 -15.1018 -15.1011 -15.1011 -11.9587 -11.9587 -11.0200 -11.0200 -10.9195 -10.9195 -10.9143 -10.9143 -10.5795 -10.5795 -10.5699 -10.5699 -4.6903 -4.6903 -3.9291 -3.9291 -3.9154 -3.9154 -2.6326 -2.6326 -2.6043 -2.6043 -2.4862 -2.4862 -2.4608 -2.4608 -1.3132 -1.3132 -0.8811 -0.8811 -0.8405 -0.8405 0.3120 0.3120 0.6170 0.6170 0.6952 0.6952 1.0410 1.0410 1.0831 1.0831 1.2233 1.2233 1.3231 1.3231 1.3247 1.3247 1.6637 1.6637 1.7469 1.7469 1.8611 1.8611 1.9983 1.9983 2.0640 2.0640 2.1022 2.1022 4.8647 4.8647 8.1868 8.1868 9.4546 9.4546 9.5835 9.5835 9.7238 9.7238 9.7939 9.7939 k = 0.4539 0.2621 0.3545 ( 21679 PWs) bands (ev): -15.1017 -15.1017 -15.1010 -15.1010 -11.9585 -11.9585 -11.0178 -11.0178 -10.9216 -10.9216 -10.9158 -10.9158 -10.5815 -10.5815 -10.5686 -10.5686 -4.6879 -4.6879 -3.9278 -3.9278 -3.9121 -3.9121 -2.6262 -2.6262 -2.5983 -2.5983 -2.4852 -2.4852 -2.4599 -2.4599 -1.3023 -1.3023 -0.8885 -0.8885 -0.8480 -0.8480 0.3134 0.3134 0.5964 0.5964 0.6936 0.6936 1.0294 1.0294 1.0856 1.0856 1.2411 1.2411 1.3271 1.3271 1.3291 1.3291 1.6564 1.6564 1.7304 1.7304 1.8473 1.8473 1.9884 1.9884 2.0545 2.0545 2.1044 2.1044 4.8762 4.8762 8.2257 8.2257 9.4447 9.4447 9.5770 9.5770 9.7410 9.7410 9.8291 9.8291 k = 0.4474 0.2583 0.3760 ( 21689 PWs) bands (ev): -15.1016 -15.1016 -15.1008 -15.1008 -11.9584 -11.9584 -11.0152 -11.0152 -10.9238 -10.9238 -10.9175 -10.9175 -10.5838 -10.5838 -10.5671 -10.5671 -4.6853 -4.6853 -3.9261 -3.9261 -3.9086 -3.9086 -2.6192 -2.6192 -2.5918 -2.5918 -2.4841 -2.4841 -2.4589 -2.4589 -1.2900 -1.2900 -0.8970 -0.8970 -0.8562 -0.8562 0.3146 0.3146 0.5745 0.5745 0.6925 0.6925 1.0164 1.0164 1.0888 1.0888 1.2594 1.2594 1.3310 1.3310 1.3342 1.3342 1.6487 1.6487 1.7113 1.7113 1.8335 1.8335 1.9768 1.9768 2.0436 2.0436 2.1077 2.1077 4.8888 4.8888 8.2689 8.2689 9.4335 9.4335 9.5698 9.5698 9.7607 9.7607 9.8675 9.8675 k = 0.4408 0.2545 0.3975 ( 21695 PWs) bands (ev): -15.1015 -15.1015 -15.1006 -15.1006 -11.9582 -11.9582 -11.0125 -11.0125 -10.9263 -10.9263 -10.9192 -10.9192 -10.5864 -10.5864 -10.5656 -10.5656 -4.6825 -4.6825 -3.9243 -3.9243 -3.9050 -3.9050 -2.6117 -2.6117 -2.5847 -2.5847 -2.4829 -2.4829 -2.4577 -2.4577 -1.2765 -1.2765 -0.9062 -0.9062 -0.8649 -0.8649 0.3154 0.3154 0.5523 0.5523 0.6915 0.6915 1.0022 1.0022 1.0928 1.0928 1.2778 1.2778 1.3348 1.3348 1.3401 1.3401 1.6407 1.6407 1.6900 1.6900 1.8200 1.8200 1.9637 1.9637 2.0316 2.0316 2.1117 2.1117 4.9020 4.9020 8.3160 8.3160 9.4214 9.4214 9.5618 9.5618 9.7828 9.7828 9.9079 9.9079 k = 0.4342 0.2507 0.4190 ( 21696 PWs) bands (ev): -15.1015 -15.1015 -15.1004 -15.1004 -11.9581 -11.9581 -11.0095 -11.0095 -10.9288 -10.9288 -10.9210 -10.9210 -10.5892 -10.5892 -10.5638 -10.5638 -4.6795 -4.6795 -3.9223 -3.9223 -3.9014 -3.9014 -2.6041 -2.6041 -2.5772 -2.5772 -2.4817 -2.4817 -2.4562 -2.4562 -1.2620 -1.2620 -0.9160 -0.9160 -0.8740 -0.8740 0.3154 0.3154 0.5308 0.5308 0.6907 0.6907 0.9869 0.9869 1.0975 1.0975 1.2957 1.2957 1.3382 1.3382 1.3469 1.3469 1.6326 1.6326 1.6670 1.6670 1.8072 1.8072 1.9497 1.9497 2.0189 2.0189 2.1163 2.1163 4.9157 4.9157 8.3660 8.3660 9.4086 9.4086 9.5530 9.5530 9.8072 9.8072 9.9486 9.9486 k = 0.4276 0.2469 0.4405 ( 21696 PWs) bands (ev): -15.1015 -15.1015 -15.1001 -15.1001 -11.9579 -11.9579 -11.0063 -11.0063 -10.9314 -10.9314 -10.9229 -10.9229 -10.5922 -10.5922 -10.5620 -10.5620 -4.6765 -4.6765 -3.9203 -3.9203 -3.8977 -3.8977 -2.5966 -2.5966 -2.5695 -2.5695 -2.4804 -2.4804 -2.4545 -2.4545 -1.2469 -1.2469 -0.9262 -0.9262 -0.8835 -0.8835 0.3140 0.3140 0.5110 0.5110 0.6901 0.6901 0.9707 0.9707 1.1031 1.1031 1.3124 1.3124 1.3413 1.3413 1.3545 1.3545 1.6246 1.6246 1.6430 1.6430 1.7953 1.7953 1.9350 1.9350 2.0057 2.0057 2.1213 2.1213 4.9296 4.9296 8.4182 8.4182 9.3955 9.3955 9.5433 9.5433 9.8338 9.8338 9.9882 9.9882 k = 0.4211 0.2431 0.4620 ( 21683 PWs) bands (ev): -15.1015 -15.1015 -15.0998 -15.0998 -11.9578 -11.9578 -11.0031 -11.0031 -10.9339 -10.9339 -10.9249 -10.9249 -10.5954 -10.5954 -10.5601 -10.5601 -4.6735 -4.6735 -3.9183 -3.9183 -3.8941 -3.8941 -2.5895 -2.5895 -2.5614 -2.5614 -2.4791 -2.4791 -2.4526 -2.4526 -1.2312 -1.2312 -0.9363 -0.9363 -0.8931 -0.8931 0.3106 0.3106 0.4942 0.4942 0.6895 0.6895 0.9536 0.9536 1.1096 1.1096 1.3267 1.3267 1.3445 1.3445 1.3632 1.3632 1.6152 1.6152 1.6206 1.6206 1.7842 1.7842 1.9200 1.9200 1.9922 1.9922 2.1266 2.1266 4.9431 4.9431 8.4715 8.4715 9.3827 9.3827 9.5326 9.5326 9.8624 9.8624 10.0247 10.0247 k = 0.4145 0.2393 0.4835 ( 21687 PWs) bands (ev): -15.1016 -15.1016 -15.0994 -15.0994 -11.9576 -11.9576 -10.9998 -10.9998 -10.9363 -10.9363 -10.9268 -10.9268 -10.5987 -10.5987 -10.5581 -10.5581 -4.6706 -4.6706 -3.9163 -3.9163 -3.8907 -3.8907 -2.5832 -2.5832 -2.5532 -2.5532 -2.4777 -2.4777 -2.4505 -2.4505 -1.2155 -1.2155 -0.9462 -0.9462 -0.9029 -0.9029 0.3045 0.3045 0.4815 0.4815 0.6890 0.6890 0.9361 0.9361 1.1169 1.1169 1.3359 1.3359 1.3497 1.3497 1.3726 1.3726 1.5939 1.5939 1.6114 1.6114 1.7740 1.7740 1.9051 1.9051 1.9787 1.9787 2.1321 2.1321 4.9562 4.9562 8.5248 8.5248 9.3706 9.3706 9.5210 9.5210 9.8926 9.8926 10.0565 10.0565 k = 0.4079 0.2355 0.5049 ( 21694 PWs) bands (ev): -15.1017 -15.1017 -15.0990 -15.0990 -11.9575 -11.9575 -10.9966 -10.9966 -10.9384 -10.9384 -10.9288 -10.9288 -10.6021 -10.6021 -10.5561 -10.5561 -4.6678 -4.6678 -3.9145 -3.9145 -3.8874 -3.8874 -2.5779 -2.5779 -2.5449 -2.5449 -2.4761 -2.4761 -2.4482 -2.4482 -1.2000 -1.2000 -0.9552 -0.9552 -0.9127 -0.9127 0.2953 0.2953 0.4736 0.4736 0.6886 0.6886 0.9182 0.9182 1.1252 1.1252 1.3391 1.3391 1.3578 1.3578 1.3818 1.3818 1.5725 1.5725 1.6051 1.6051 1.7648 1.7648 1.8908 1.8908 1.9654 1.9654 2.1378 2.1378 4.9684 4.9684 8.5769 8.5769 9.3600 9.3600 9.5085 9.5085 9.9242 9.9242 10.0819 10.0819 k = 0.4013 0.2317 0.5264 ( 21693 PWs) bands (ev): -15.1019 -15.1019 -15.0986 -15.0986 -11.9574 -11.9574 -10.9934 -10.9934 -10.9403 -10.9403 -10.9308 -10.9308 -10.6055 -10.6055 -10.5541 -10.5541 -4.6651 -4.6651 -3.9130 -3.9130 -3.8842 -3.8842 -2.5740 -2.5740 -2.5367 -2.5367 -2.4745 -2.4745 -2.4458 -2.4458 -1.1853 -1.1853 -0.9631 -0.9631 -0.9224 -0.9224 0.2834 0.2834 0.4708 0.4708 0.6883 0.6883 0.9003 0.9003 1.1343 1.1343 1.3392 1.3392 1.3658 1.3658 1.3891 1.3891 1.5549 1.5549 1.5997 1.5997 1.7566 1.7566 1.8773 1.8773 1.9526 1.9526 2.1437 2.1437 4.9794 4.9794 8.6263 8.6263 9.3512 9.3512 9.4952 9.4952 9.9568 9.9568 10.0997 10.0997 k = 0.3947 0.2279 0.5479 ( 21689 PWs) bands (ev): -15.1021 -15.1021 -15.0982 -15.0982 -11.9573 -11.9573 -10.9905 -10.9905 -10.9417 -10.9417 -10.9328 -10.9328 -10.6090 -10.6090 -10.5520 -10.5520 -4.6628 -4.6628 -3.9119 -3.9119 -3.8814 -3.8814 -2.5714 -2.5714 -2.5287 -2.5287 -2.4728 -2.4728 -2.4434 -2.4434 -1.1719 -1.1719 -0.9693 -0.9693 -0.9319 -0.9319 0.2695 0.2695 0.4725 0.4725 0.6881 0.6881 0.8828 0.8828 1.1443 1.1443 1.3379 1.3379 1.3718 1.3718 1.3928 1.3928 1.5435 1.5435 1.5950 1.5950 1.7493 1.7493 1.8649 1.8649 1.9405 1.9405 2.1496 2.1496 4.9890 4.9890 8.6717 8.6717 9.3446 9.3446 9.4815 9.4815 9.9900 9.9900 10.1094 10.1094 k = 0.3882 0.2241 0.5694 ( 21694 PWs) bands (ev): -15.1024 -15.1024 -15.0977 -15.0977 -11.9572 -11.9572 -10.9879 -10.9879 -10.9427 -10.9427 -10.9347 -10.9347 -10.6123 -10.6123 -10.5499 -10.5499 -4.6608 -4.6608 -3.9111 -3.9111 -3.8788 -3.8788 -2.5704 -2.5704 -2.5212 -2.5212 -2.4710 -2.4710 -2.4413 -2.4413 -1.1603 -1.1603 -0.9737 -0.9737 -0.9409 -0.9409 0.2548 0.2548 0.4780 0.4780 0.6881 0.6881 0.8660 0.8660 1.1550 1.1550 1.3357 1.3357 1.3730 1.3730 1.3945 1.3945 1.5395 1.5395 1.5910 1.5910 1.7431 1.7431 1.8539 1.8539 1.9294 1.9294 2.1558 2.1558 4.9968 4.9968 8.7119 8.7119 9.3401 9.3401 9.4680 9.4680 10.0233 10.0233 10.1119 10.1119 k = 0.3816 0.2203 0.5909 ( 21705 PWs) bands (ev): -15.1028 -15.1028 -15.0973 -15.0973 -11.9572 -11.9572 -10.9857 -10.9857 -10.9431 -10.9431 -10.9365 -10.9365 -10.6155 -10.6155 -10.5478 -10.5478 -4.6593 -4.6593 -3.9108 -3.9108 -3.8765 -3.8765 -2.5707 -2.5707 -2.5144 -2.5144 -2.4693 -2.4693 -2.4395 -2.4395 -1.1508 -1.1508 -0.9762 -0.9762 -0.9489 -0.9489 0.2402 0.2402 0.4866 0.4866 0.6882 0.6882 0.8503 0.8503 1.1666 1.1666 1.3329 1.3329 1.3660 1.3660 1.3979 1.3979 1.5425 1.5425 1.5877 1.5877 1.7379 1.7379 1.8443 1.8443 1.9194 1.9194 2.1620 2.1620 5.0027 5.0027 8.7459 8.7459 9.3369 9.3369 9.4557 9.4557 10.0556 10.0556 10.1080 10.1080 k = 0.3750 0.2165 0.6124 ( 21728 PWs) bands (ev): -15.1032 -15.1032 -15.0968 -15.0968 -11.9572 -11.9572 -10.9838 -10.9838 -10.9432 -10.9432 -10.9381 -10.9381 -10.6186 -10.6186 -10.5458 -10.5458 -4.6582 -4.6582 -3.9111 -3.9111 -3.8745 -3.8745 -2.5725 -2.5725 -2.5086 -2.5086 -2.4678 -2.4678 -2.4383 -2.4383 -1.1436 -1.1436 -0.9779 -0.9779 -0.9547 -0.9547 0.2266 0.2266 0.4976 0.4976 0.6885 0.6885 0.8361 0.8361 1.1788 1.1788 1.3295 1.3295 1.3531 1.3531 1.4032 1.4032 1.5500 1.5500 1.5853 1.5853 1.7338 1.7338 1.8365 1.8365 1.9109 1.9109 2.1683 2.1683 5.0063 5.0063 8.7732 8.7732 9.3330 9.3330 9.4460 9.4460 10.0846 10.0846 10.0982 10.0982 k = 0.6250-0.0722 0.4082 ( 21728 PWs) bands (ev): -15.1032 -15.1032 -15.0968 -15.0968 -11.9572 -11.9572 -10.9838 -10.9838 -10.9432 -10.9432 -10.9381 -10.9381 -10.6186 -10.6186 -10.5458 -10.5458 -4.6582 -4.6582 -3.9111 -3.9111 -3.8745 -3.8745 -2.5725 -2.5725 -2.5086 -2.5086 -2.4678 -2.4678 -2.4383 -2.4383 -1.1436 -1.1436 -0.9779 -0.9779 -0.9547 -0.9547 0.2266 0.2266 0.4976 0.4976 0.6885 0.6885 0.8361 0.8361 1.1788 1.1788 1.3295 1.3295 1.3531 1.3531 1.4032 1.4032 1.5500 1.5500 1.5853 1.5853 1.7338 1.7338 1.8365 1.8365 1.9109 1.9109 2.1683 2.1683 5.0063 5.0063 8.7732 8.7732 9.3330 9.3330 9.4460 9.4460 10.0846 10.0846 10.0982 10.0982 k = 0.6136-0.0919 0.4082 ( 21692 PWs) bands (ev): -15.1039 -15.1039 -15.0959 -15.0959 -11.9572 -11.9572 -10.9809 -10.9809 -10.9438 -10.9438 -10.9398 -10.9398 -10.6236 -10.6236 -10.5424 -10.5424 -4.6568 -4.6568 -3.9122 -3.9122 -3.8716 -3.8716 -2.5767 -2.5767 -2.4999 -2.4999 -2.4653 -2.4653 -2.4370 -2.4370 -1.1330 -1.1330 -0.9853 -0.9853 -0.9575 -0.9575 0.2054 0.2054 0.5190 0.5190 0.6893 0.6893 0.8138 0.8138 1.2007 1.2007 1.3200 1.3200 1.3316 1.3316 1.4131 1.4131 1.5607 1.5607 1.5864 1.5864 1.7278 1.7278 1.8247 1.8247 1.8982 1.8982 2.1794 2.1794 5.0098 5.0098 8.8144 8.8144 9.3183 9.3183 9.4371 9.4371 10.0753 10.0753 10.1270 10.1270 k = 0.6023-0.1115 0.4082 ( 21678 PWs) bands (ev): -15.1045 -15.1045 -15.0952 -15.0952 -11.9572 -11.9572 -10.9779 -10.9779 -10.9458 -10.9458 -10.9398 -10.9398 -10.6284 -10.6284 -10.5391 -10.5391 -4.6557 -4.6557 -3.9136 -3.9136 -3.8689 -3.8689 -2.5812 -2.5812 -2.4923 -2.4923 -2.4628 -2.4628 -2.4360 -2.4360 -1.1224 -1.1224 -0.9972 -0.9972 -0.9553 -0.9553 0.1860 0.1860 0.5410 0.5410 0.6903 0.6903 0.7931 0.7931 1.2229 1.2229 1.2984 1.2984 1.3231 1.3231 1.4230 1.4230 1.5592 1.5592 1.5982 1.5982 1.7223 1.7223 1.8134 1.8134 1.8864 1.8864 2.1906 2.1906 5.0119 5.0119 8.8553 8.8553 9.2951 9.2951 9.4352 9.4352 10.0538 10.0538 10.1405 10.1405 k = 0.5909-0.1312 0.4082 ( 21668 PWs) bands (ev): -15.1052 -15.1052 -15.0945 -15.0945 -11.9573 -11.9573 -10.9748 -10.9748 -10.9483 -10.9483 -10.9393 -10.9393 -10.6330 -10.6330 -10.5360 -10.5360 -4.6549 -4.6549 -3.9150 -3.9150 -3.8666 -3.8666 -2.5858 -2.5858 -2.4862 -2.4862 -2.4599 -2.4599 -2.4354 -2.4354 -1.1121 -1.1121 -1.0097 -1.0097 -0.9518 -0.9518 0.1685 0.1685 0.5628 0.5628 0.6916 0.6916 0.7741 0.7741 1.2445 1.2445 1.2748 1.2748 1.3183 1.3183 1.4327 1.4327 1.5521 1.5521 1.6140 1.6140 1.7174 1.7174 1.8029 1.8029 1.8758 1.8758 2.2014 2.2014 5.0129 5.0129 8.8949 8.8949 9.2687 9.2687 9.4362 9.4362 10.0340 10.0340 10.1406 10.1406 k = 0.5795-0.1509 0.4082 ( 21676 PWs) bands (ev): -15.1057 -15.1057 -15.0939 -15.0939 -11.9574 -11.9574 -10.9719 -10.9719 -10.9508 -10.9508 -10.9387 -10.9387 -10.6374 -10.6374 -10.5331 -10.5331 -4.6542 -4.6542 -3.9165 -3.9165 -3.8646 -3.8646 -2.5901 -2.5901 -2.4814 -2.4814 -2.4568 -2.4568 -2.4350 -2.4350 -1.1023 -1.1023 -1.0217 -1.0217 -0.9479 -0.9479 0.1529 0.1529 0.5837 0.5837 0.6932 0.6932 0.7574 0.7574 1.2474 1.2474 1.2704 1.2704 1.3145 1.3145 1.4419 1.4419 1.5431 1.5431 1.6296 1.6296 1.7131 1.7131 1.7932 1.7932 1.8663 1.8663 2.2118 2.2118 5.0131 5.0131 8.9319 8.9319 9.2427 9.2427 9.4378 9.4378 10.0163 10.0163 10.1394 10.1394 k = 0.5682-0.1706 0.4082 ( 21672 PWs) bands (ev): -15.1062 -15.1062 -15.0934 -15.0934 -11.9575 -11.9575 -10.9691 -10.9691 -10.9529 -10.9529 -10.9381 -10.9381 -10.6413 -10.6413 -10.5305 -10.5305 -4.6537 -4.6537 -3.9180 -3.9180 -3.8629 -3.8629 -2.5942 -2.5942 -2.4780 -2.4780 -2.4535 -2.4535 -2.4347 -2.4347 -1.0933 -1.0933 -1.0326 -1.0326 -0.9442 -0.9442 0.1393 0.1393 0.6028 0.6028 0.6954 0.6954 0.7431 0.7431 1.2262 1.2262 1.2906 1.2906 1.3115 1.3115 1.4503 1.4503 1.5331 1.5331 1.6438 1.6438 1.7095 1.7095 1.7843 1.7843 1.8580 1.8580 2.2214 2.2214 5.0127 5.0127 8.9649 8.9649 9.2196 9.2196 9.4392 9.4392 10.0009 10.0009 10.1366 10.1366 k = 0.5568-0.1903 0.4082 ( 21674 PWs) bands (ev): -15.1066 -15.1066 -15.0929 -15.0929 -11.9576 -11.9576 -10.9665 -10.9665 -10.9548 -10.9548 -10.9375 -10.9375 -10.6449 -10.6449 -10.5282 -10.5282 -4.6533 -4.6533 -3.9193 -3.9193 -3.8615 -3.8615 -2.5979 -2.5979 -2.4757 -2.4757 -2.4503 -2.4503 -2.4344 -2.4344 -1.0853 -1.0853 -1.0422 -1.0422 -0.9408 -0.9408 0.1278 0.1278 0.6188 0.6188 0.6986 0.6986 0.7316 0.7316 1.2057 1.2057 1.3062 1.3062 1.3139 1.3139 1.4577 1.4577 1.5225 1.5225 1.6560 1.6560 1.7068 1.7068 1.7766 1.7766 1.8510 1.8510 2.2301 2.2301 5.0119 5.0119 8.9924 8.9924 9.2013 9.2013 9.4400 9.4400 9.9878 9.9878 10.1324 10.1324 k = 0.5455-0.2099 0.4082 ( 21666 PWs) bands (ev): -15.1070 -15.1070 -15.0926 -15.0926 -11.9576 -11.9576 -10.9644 -10.9644 -10.9564 -10.9564 -10.9371 -10.9371 -10.6479 -10.6479 -10.5263 -10.5263 -4.6530 -4.6530 -3.9205 -3.9205 -3.8604 -3.8604 -2.6010 -2.6010 -2.4742 -2.4742 -2.4476 -2.4476 -2.4340 -2.4340 -1.0785 -1.0785 -1.0502 -1.0502 -0.9379 -0.9379 0.1183 0.1183 0.6306 0.6306 0.7029 0.7029 0.7232 0.7232 1.1875 1.1875 1.3054 1.3054 1.3322 1.3322 1.4638 1.4638 1.5117 1.5117 1.6657 1.6657 1.7052 1.7052 1.7700 1.7700 1.8452 1.8452 2.2375 2.2375 5.0110 5.0110 9.0130 9.0130 9.1892 9.1892 9.4403 9.4403 9.9770 9.9770 10.1271 10.1271 k = 0.5341-0.2296 0.4082 ( 21686 PWs) bands (ev): -15.1072 -15.1072 -15.0923 -15.0923 -11.9577 -11.9577 -10.9627 -10.9627 -10.9575 -10.9575 -10.9367 -10.9367 -10.6503 -10.6503 -10.5248 -10.5248 -4.6528 -4.6528 -3.9215 -3.9215 -3.8595 -3.8595 -2.6035 -2.6035 -2.4733 -2.4733 -2.4455 -2.4455 -2.4334 -2.4334 -1.0731 -1.0731 -1.0565 -1.0565 -0.9356 -0.9356 0.1109 0.1109 0.6378 0.6378 0.7078 0.7078 0.7181 0.7181 1.1722 1.1722 1.3038 1.3038 1.3499 1.3499 1.4682 1.4682 1.5014 1.5014 1.6725 1.6725 1.7050 1.7050 1.7648 1.7648 1.8407 1.8407 2.2434 2.2434 5.0100 5.0100 9.0260 9.0260 9.1833 9.1833 9.4403 9.4403 9.9686 9.9686 10.1214 10.1214 k = 0.5227-0.2493 0.4082 ( 21688 PWs) bands (ev): -15.1074 -15.1074 -15.0921 -15.0921 -11.9577 -11.9577 -10.9617 -10.9617 -10.9581 -10.9581 -10.9364 -10.9364 -10.6521 -10.6521 -10.5237 -10.5237 -4.6527 -4.6527 -3.9222 -3.9222 -3.8589 -3.8589 -2.6054 -2.6054 -2.4727 -2.4727 -2.4442 -2.4442 -2.4328 -2.4328 -1.0693 -1.0693 -1.0608 -1.0608 -0.9338 -0.9338 0.1057 0.1057 0.6414 0.6414 0.7102 0.7102 0.7178 0.7178 1.1607 1.1607 1.3026 1.3026 1.3648 1.3648 1.4704 1.4704 1.4930 1.4930 1.6765 1.6765 1.7058 1.7058 1.7609 1.7609 1.8374 1.8374 2.2478 2.2478 5.0093 5.0093 9.0326 9.0326 9.1822 9.1822 9.4401 9.4401 9.9626 9.9626 10.1165 10.1165 k = 0.5114-0.2690 0.4082 ( 21688 PWs) bands (ev): -15.1075 -15.1075 -15.0920 -15.0920 -11.9578 -11.9578 -10.9614 -10.9614 -10.9582 -10.9582 -10.9362 -10.9362 -10.6532 -10.6532 -10.5231 -10.5231 -4.6526 -4.6526 -3.9226 -3.9226 -3.8586 -3.8586 -2.6065 -2.6065 -2.4724 -2.4724 -2.4435 -2.4435 -2.4323 -2.4323 -1.0677 -1.0677 -1.0628 -1.0628 -0.9327 -0.9327 0.1025 0.1025 0.6427 0.6427 0.7097 0.7097 0.7208 0.7208 1.1534 1.1534 1.3019 1.3019 1.3753 1.3753 1.4700 1.4700 1.4882 1.4882 1.6784 1.6784 1.7068 1.7068 1.7586 1.7586 1.8355 1.8355 2.2505 2.2505 5.0088 5.0088 9.0352 9.0352 9.1831 9.1831 9.4399 9.4399 9.9590 9.9590 10.1131 10.1131 k = 0.5000-0.2887 0.4082 ( 21732 PWs) bands (ev): -15.1076 -15.1076 -15.0919 -15.0919 -11.9578 -11.9578 -10.9613 -10.9613 -10.9582 -10.9582 -10.9362 -10.9362 -10.6535 -10.6535 -10.5229 -10.5229 -4.6526 -4.6526 -3.9228 -3.9228 -3.8585 -3.8585 -2.6069 -2.6069 -2.4723 -2.4723 -2.4433 -2.4433 -2.4322 -2.4322 -1.0676 -1.0676 -1.0630 -1.0630 -0.9324 -0.9324 0.1014 0.1014 0.6431 0.6431 0.7093 0.7093 0.7221 0.7221 1.1509 1.1509 1.3016 1.3016 1.3792 1.3792 1.4692 1.4692 1.4869 1.4869 1.6789 1.6789 1.7073 1.7073 1.7578 1.7578 1.8348 1.8348 2.2514 2.2514 5.0086 5.0086 9.0358 9.0358 9.1837 9.1837 9.4399 9.4399 9.9578 9.9578 10.1119 10.1119 Writing output data file Cs2GeCl6.save init_run : 0.68s CPU 1.21s WALL ( 1 calls) electrons : 738.29s CPU 743.27s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.08s WALL ( 1 calls) potinit : 0.05s CPU 0.37s WALL ( 1 calls) Called by electrons: c_bands : 738.28s CPU 743.25s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.24s CPU 0.28s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.14s CPU 0.24s WALL ( 210 calls) cegterg : 686.84s CPU 690.92s WALL ( 456 calls) Called by sum_band: Called by *egterg: h_psi : 476.00s CPU 479.73s WALL ( 7333 calls) s_psi : 19.07s CPU 19.19s WALL ( 7333 calls) g_psi : 0.65s CPU 0.67s WALL ( 6667 calls) cdiaghg : 156.40s CPU 156.41s WALL ( 6877 calls) cegterg:over : 27.86s CPU 27.99s WALL ( 6667 calls) cegterg:upda : 21.87s CPU 22.11s WALL ( 6667 calls) cegterg:last : 12.78s CPU 12.92s WALL ( 1022 calls) cdiaghg:chol : 6.55s CPU 6.61s WALL ( 6877 calls) cdiaghg:inve : 5.09s CPU 4.89s WALL ( 6877 calls) cdiaghg:para : 10.24s CPU 10.18s WALL ( 13754 calls) Called by h_psi: h_psi:vloc : 419.25s CPU 422.92s WALL ( 7333 calls) h_psi:vnl : 56.03s CPU 56.03s WALL ( 7333 calls) add_vuspsi : 30.80s CPU 30.68s WALL ( 7333 calls) General routines calbec : 25.18s CPU 25.33s WALL ( 7333 calls) fft : 0.02s CPU 0.02s WALL ( 15 calls) fftw : 403.73s CPU 407.55s WALL ( 881376 calls) davcio : 0.24s CPU 0.53s WALL ( 420 calls) Parallel routines fft_scatter : 221.42s CPU 224.15s WALL ( 881391 calls) PWSCF : 13m29.56s CPU 13m54.09s WALL This run was terminated on: 8:14:39 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=