Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 18:26:34 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./CsAgF3.save/ file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 98 98 26 3249 3249 464 Max 99 99 27 3254 3254 468 Sum 3557 3557 971 117049 117049 16803 bravais-lattice index = 14 lattice parameter (alat) = 11.8317 a.u. unit-cell volume = 1210.4913 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 3 number of electrons = 82.00 number of Kohn-Sham states= 98 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)= 11.831731 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.462935 celldm(5)= -0.462935 celldm(6)= -0.074129 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.074129 0.997249 0.000000 ) a(3) = ( -0.462935 -0.498624 0.732847 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.074334 0.682271 ) b(2) = ( 0.000000 1.002759 0.682271 ) b(3) = ( 0.000000 0.000000 1.364541 ) PseudoPot. # 1 for F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 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 1105 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 Ag read from file: /users/gautes/Pseudo/Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 30ab375624a706b88a092e30a79375fd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1237 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 F 7.00 18.99840 F( 1.00) Ag 11.00 107.86820 Ag( 1.00) Cs 9.00 132.90550 Cs( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) 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 [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 1 1 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.4629353 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.4986243 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( -1 -1 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) f =( -0.4629353 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.4986243 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 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 C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 275 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036364 k( 2) = ( 0.0000000 0.0000000 0.0194934), wk = 0.0036364 k( 3) = ( 0.0000000 0.0000000 0.0389869), wk = 0.0036364 k( 4) = ( 0.0000000 0.0000000 0.0584803), wk = 0.0036364 k( 5) = ( 0.0000000 0.0000000 0.0779738), wk = 0.0036364 k( 6) = ( 0.0000000 0.0000000 0.0974672), wk = 0.0036364 k( 7) = ( 0.0000000 0.0000000 0.1169607), wk = 0.0036364 k( 8) = ( 0.0000000 0.0000000 0.1364541), wk = 0.0036364 k( 9) = ( 0.0000000 0.0000000 0.1559476), wk = 0.0036364 k( 10) = ( 0.0000000 0.0000000 0.1754410), wk = 0.0036364 k( 11) = ( 0.0000000 0.0000000 0.1949345), wk = 0.0036364 k( 12) = ( 0.0000000 0.0000000 0.2144279), wk = 0.0036364 k( 13) = ( 0.0000000 0.0000000 0.2339214), wk = 0.0036364 k( 14) = ( 0.0000000 0.0000000 0.2534148), wk = 0.0036364 k( 15) = ( 0.0000000 0.0000000 0.2729083), wk = 0.0036364 k( 16) = ( 0.0000000 0.0000000 0.2924017), wk = 0.0036364 k( 17) = ( 0.0000000 0.0000000 0.3118952), wk = 0.0036364 k( 18) = ( 0.0000000 0.0000000 0.3313886), wk = 0.0036364 k( 19) = ( 0.0000000 0.0000000 0.3508821), wk = 0.0036364 k( 20) = ( 0.0000000 0.0000000 0.3703755), wk = 0.0036364 k( 21) = ( 0.0000000 0.0000000 0.3898689), wk = 0.0036364 k( 22) = ( 0.0000000 0.0000000 0.4093624), wk = 0.0036364 k( 23) = ( 0.0000000 0.0000000 0.4288558), wk = 0.0036364 k( 24) = ( 0.0000000 0.0000000 0.4483493), wk = 0.0036364 k( 25) = ( 0.0000000 0.0000000 0.4678427), wk = 0.0036364 k( 26) = ( 0.0000000 0.0000000 0.4873362), wk = 0.0036364 k( 27) = ( 0.0000000 0.0000000 0.5068296), wk = 0.0036364 k( 28) = ( 0.0000000 0.0000000 0.5263231), wk = 0.0036364 k( 29) = ( 0.0000000 0.0000000 0.5458165), wk = 0.0036364 k( 30) = ( 0.0000000 0.0000000 0.5653100), wk = 0.0036364 k( 31) = ( 0.0000000 0.0000000 0.5848034), wk = 0.0036364 k( 32) = ( 0.0000000 0.0000000 0.6042969), wk = 0.0036364 k( 33) = ( 0.0000000 0.0000000 0.6237903), wk = 0.0036364 k( 34) = ( 0.0000000 0.0000000 0.6432838), wk = 0.0036364 k( 35) = ( 0.0000000 0.0000000 0.6627772), wk = 0.0036364 k( 36) = ( 0.0000000 0.0000000 0.6822707), wk = 0.0036364 k( 37) = ( 0.0000000 0.0000000 0.6822707), wk = 0.0036364 k( 38) = ( -0.0145016 0.0134637 0.6822707), wk = 0.0036364 k( 39) = ( -0.0290032 0.0269273 0.6822707), wk = 0.0036364 k( 40) = ( -0.0435048 0.0403910 0.6822707), wk = 0.0036364 k( 41) = ( -0.0580065 0.0538546 0.6822707), wk = 0.0036364 k( 42) = ( -0.0725081 0.0673183 0.6822707), wk = 0.0036364 k( 43) = ( -0.0870097 0.0807820 0.6822707), wk = 0.0036364 k( 44) = ( -0.1015113 0.0942456 0.6822707), wk = 0.0036364 k( 45) = ( -0.1160129 0.1077093 0.6822707), wk = 0.0036364 k( 46) = ( -0.1305145 0.1211730 0.6822707), wk = 0.0036364 k( 47) = ( -0.1450162 0.1346366 0.6822707), wk = 0.0036364 k( 48) = ( -0.1595178 0.1481003 0.6822707), wk = 0.0036364 k( 49) = ( -0.1740194 0.1615639 0.6822707), wk = 0.0036364 k( 50) = ( -0.1885210 0.1750276 0.6822707), wk = 0.0036364 k( 51) = ( -0.2030226 0.1884913 0.6822707), wk = 0.0036364 k( 52) = ( -0.2175242 0.2019549 0.6822707), wk = 0.0036364 k( 53) = ( -0.2320258 0.2154186 0.6822707), wk = 0.0036364 k( 54) = ( -0.2465275 0.2288822 0.6822707), wk = 0.0036364 k( 55) = ( -0.2610291 0.2423459 0.6822707), wk = 0.0036364 k( 56) = ( -0.2755307 0.2558096 0.6822707), wk = 0.0036364 k( 57) = ( -0.2900323 0.2692732 0.6822707), wk = 0.0036364 k( 58) = ( -0.2900323 0.2692732 0.6822707), wk = 0.0036364 k( 59) = ( -0.2995763 0.2781341 0.6692475), wk = 0.0036364 k( 60) = ( -0.3091203 0.2869950 0.6562243), wk = 0.0036364 k( 61) = ( -0.3186643 0.2958559 0.6432012), wk = 0.0036364 k( 62) = ( -0.3282082 0.3047167 0.6301780), wk = 0.0036364 k( 63) = ( -0.3377522 0.3135776 0.6171548), wk = 0.0036364 k( 64) = ( -0.3472962 0.3224385 0.6041317), wk = 0.0036364 k( 65) = ( -0.3568402 0.3312994 0.5911085), wk = 0.0036364 k( 66) = ( -0.3663842 0.3401602 0.5780853), wk = 0.0036364 k( 67) = ( -0.3759282 0.3490211 0.5650622), wk = 0.0036364 k( 68) = ( -0.3854722 0.3578820 0.5520390), wk = 0.0036364 k( 69) = ( -0.3950162 0.3667429 0.5390159), wk = 0.0036364 k( 70) = ( -0.3950162 0.3667429 0.5390159), wk = 0.0036364 k( 71) = ( -0.3848875 0.3573392 0.5251949), wk = 0.0036364 k( 72) = ( -0.3747589 0.3479355 0.5113740), wk = 0.0036364 k( 73) = ( -0.3646303 0.3385319 0.4975531), wk = 0.0036364 k( 74) = ( -0.3545017 0.3291282 0.4837322), wk = 0.0036364 k( 75) = ( -0.3443731 0.3197245 0.4699113), wk = 0.0036364 k( 76) = ( -0.3342444 0.3103209 0.4560903), wk = 0.0036364 k( 77) = ( -0.3241158 0.3009172 0.4422694), wk = 0.0036364 k( 78) = ( -0.3139872 0.2915136 0.4284485), wk = 0.0036364 k( 79) = ( -0.3038586 0.2821099 0.4146276), wk = 0.0036364 k( 80) = ( -0.2937300 0.2727062 0.4008067), wk = 0.0036364 k( 81) = ( -0.2836013 0.2633026 0.3869857), wk = 0.0036364 k( 82) = ( -0.2734727 0.2538989 0.3731648), wk = 0.0036364 k( 83) = ( -0.2633441 0.2444952 0.3593439), wk = 0.0036364 k( 84) = ( -0.2532155 0.2350916 0.3455230), wk = 0.0036364 k( 85) = ( -0.2430869 0.2256879 0.3317021), wk = 0.0036364 k( 86) = ( -0.2329582 0.2162843 0.3178811), wk = 0.0036364 k( 87) = ( -0.2228296 0.2068806 0.3040602), wk = 0.0036364 k( 88) = ( -0.2127010 0.1974769 0.2902393), wk = 0.0036364 k( 89) = ( -0.2025724 0.1880733 0.2764184), wk = 0.0036364 k( 90) = ( -0.1924438 0.1786696 0.2625975), wk = 0.0036364 k( 91) = ( -0.1823152 0.1692659 0.2487766), wk = 0.0036364 k( 92) = ( -0.1721865 0.1598623 0.2349556), wk = 0.0036364 k( 93) = ( -0.1620579 0.1504586 0.2211347), wk = 0.0036364 k( 94) = ( -0.1519293 0.1410549 0.2073138), wk = 0.0036364 k( 95) = ( -0.1418007 0.1316513 0.1934929), wk = 0.0036364 k( 96) = ( -0.1316721 0.1222476 0.1796720), wk = 0.0036364 k( 97) = ( -0.1215434 0.1128440 0.1658510), wk = 0.0036364 k( 98) = ( -0.1114148 0.1034403 0.1520301), wk = 0.0036364 k( 99) = ( -0.1012862 0.0940366 0.1382092), wk = 0.0036364 k( 100) = ( -0.0911576 0.0846330 0.1243883), wk = 0.0036364 k( 101) = ( -0.0810290 0.0752293 0.1105673), wk = 0.0036364 k( 102) = ( -0.0709003 0.0658256 0.0967464), wk = 0.0036364 k( 103) = ( -0.0607717 0.0564220 0.0829255), wk = 0.0036364 k( 104) = ( -0.0506431 0.0470183 0.0691046), wk = 0.0036364 k( 105) = ( -0.0405145 0.0376147 0.0552837), wk = 0.0036364 k( 106) = ( -0.0303859 0.0282110 0.0414628), wk = 0.0036364 k( 107) = ( -0.0202572 0.0188073 0.0276418), wk = 0.0036364 k( 108) = ( -0.0101286 0.0094037 0.0138209), wk = 0.0036364 k( 109) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036364 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036364 k( 111) = ( 0.0135135 0.0145553 0.0000000), wk = 0.0036364 k( 112) = ( 0.0270270 0.0291106 0.0000000), wk = 0.0036364 k( 113) = ( 0.0405405 0.0436659 0.0000000), wk = 0.0036364 k( 114) = ( 0.0540540 0.0582212 -0.0000000), wk = 0.0036364 k( 115) = ( 0.0675676 0.0727766 -0.0000000), wk = 0.0036364 k( 116) = ( 0.0810811 0.0873319 0.0000000), wk = 0.0036364 k( 117) = ( 0.0945946 0.1018872 -0.0000000), wk = 0.0036364 k( 118) = ( 0.1081081 0.1164425 -0.0000000), wk = 0.0036364 k( 119) = ( 0.1216216 0.1309978 0.0000000), wk = 0.0036364 k( 120) = ( 0.1351351 0.1455531 -0.0000000), wk = 0.0036364 k( 121) = ( 0.1486486 0.1601084 0.0000000), wk = 0.0036364 k( 122) = ( 0.1621622 0.1746637 0.0000000), wk = 0.0036364 k( 123) = ( 0.1756757 0.1892190 0.0000000), wk = 0.0036364 k( 124) = ( 0.1891892 0.2037743 -0.0000000), wk = 0.0036364 k( 125) = ( 0.2027027 0.2183296 -0.0000000), wk = 0.0036364 k( 126) = ( 0.2162162 0.2328850 -0.0000000), wk = 0.0036364 k( 127) = ( 0.2297297 0.2474403 0.0000000), wk = 0.0036364 k( 128) = ( 0.2432432 0.2619956 0.0000000), wk = 0.0036364 k( 129) = ( 0.2567568 0.2765509 0.0000000), wk = 0.0036364 k( 130) = ( 0.2702703 0.2911062 -0.0000000), wk = 0.0036364 k( 131) = ( 0.2837838 0.3056615 -0.0000000), wk = 0.0036364 k( 132) = ( 0.2972973 0.3202168 0.0000000), wk = 0.0036364 k( 133) = ( 0.3108108 0.3347721 0.0000000), wk = 0.0036364 k( 134) = ( 0.3243243 0.3493274 0.0000000), wk = 0.0036364 k( 135) = ( 0.3378378 0.3638828 -0.0000000), wk = 0.0036364 k( 136) = ( 0.3513514 0.3784381 -0.0000000), wk = 0.0036364 k( 137) = ( 0.3648649 0.3929934 0.0000000), wk = 0.0036364 k( 138) = ( 0.3783784 0.4075487 -0.0000000), wk = 0.0036364 k( 139) = ( 0.3918919 0.4221040 0.0000000), wk = 0.0036364 k( 140) = ( 0.4054054 0.4366593 -0.0000000), wk = 0.0036364 k( 141) = ( 0.4189189 0.4512146 0.0000000), wk = 0.0036364 k( 142) = ( 0.4324324 0.4657699 -0.0000000), wk = 0.0036364 k( 143) = ( 0.4459459 0.4803252 -0.0000000), wk = 0.0036364 k( 144) = ( 0.4594595 0.4948805 0.0000000), wk = 0.0036364 k( 145) = ( 0.4729730 0.5094358 -0.0000000), wk = 0.0036364 k( 146) = ( 0.4864865 0.5239912 0.0000000), wk = 0.0036364 k( 147) = ( 0.5000000 0.5385465 0.0000000), wk = 0.0036364 k( 148) = ( 0.5000000 0.5385465 0.0000000), wk = 0.0036364 k( 149) = ( 0.4904560 0.5474073 0.0130232), wk = 0.0036364 k( 150) = ( 0.4809120 0.5562682 0.0260463), wk = 0.0036364 k( 151) = ( 0.4713680 0.5651291 0.0390695), wk = 0.0036364 k( 152) = ( 0.4618240 0.5739900 0.0520927), wk = 0.0036364 k( 153) = ( 0.4522801 0.5828508 0.0651158), wk = 0.0036364 k( 154) = ( 0.4427361 0.5917117 0.0781390), wk = 0.0036364 k( 155) = ( 0.4331921 0.6005726 0.0911622), wk = 0.0036364 k( 156) = ( 0.4236481 0.6094335 0.1041853), wk = 0.0036364 k( 157) = ( 0.4141041 0.6182943 0.1172085), wk = 0.0036364 k( 158) = ( 0.4045601 0.6271552 0.1302316), wk = 0.0036364 k( 159) = ( 0.3950162 0.6360161 0.1432548), wk = 0.0036364 k( 160) = ( 0.3950162 0.6360161 0.1432548), wk = 0.0036364 k( 161) = ( 0.3785571 0.6304062 0.1514998), wk = 0.0036364 k( 162) = ( 0.3620981 0.6247964 0.1597448), wk = 0.0036364 k( 163) = ( 0.3456391 0.6191865 0.1679899), wk = 0.0036364 k( 164) = ( 0.3291801 0.6135767 0.1762349), wk = 0.0036364 k( 165) = ( 0.3127211 0.6079668 0.1844799), wk = 0.0036364 k( 166) = ( 0.2962621 0.6023569 0.1927249), wk = 0.0036364 k( 167) = ( 0.2798031 0.5967471 0.2009700), wk = 0.0036364 k( 168) = ( 0.2633441 0.5911372 0.2092150), wk = 0.0036364 k( 169) = ( 0.2468851 0.5855274 0.2174600), wk = 0.0036364 k( 170) = ( 0.2304261 0.5799175 0.2257050), wk = 0.0036364 k( 171) = ( 0.2139671 0.5743076 0.2339500), wk = 0.0036364 k( 172) = ( 0.1975081 0.5686978 0.2421951), wk = 0.0036364 k( 173) = ( 0.1810491 0.5630879 0.2504401), wk = 0.0036364 k( 174) = ( 0.1645901 0.5574781 0.2586851), wk = 0.0036364 k( 175) = ( 0.1481311 0.5518682 0.2669301), wk = 0.0036364 k( 176) = ( 0.1316721 0.5462584 0.2751752), wk = 0.0036364 k( 177) = ( 0.1152130 0.5406485 0.2834202), wk = 0.0036364 k( 178) = ( 0.0987540 0.5350386 0.2916652), wk = 0.0036364 k( 179) = ( 0.0822950 0.5294288 0.2999102), wk = 0.0036364 k( 180) = ( 0.0658360 0.5238189 0.3081552), wk = 0.0036364 k( 181) = ( 0.0493770 0.5182091 0.3164003), wk = 0.0036364 k( 182) = ( 0.0329180 0.5125992 0.3246453), wk = 0.0036364 k( 183) = ( 0.0164590 0.5069893 0.3328903), wk = 0.0036364 k( 184) = ( 0.0000000 0.5013795 0.3411353), wk = 0.0036364 k( 185) = ( 0.0000000 0.5013795 0.3411353), wk = 0.0036364 k( 186) = ( 0.0100000 0.4920952 0.3547807), wk = 0.0036364 k( 187) = ( 0.0200000 0.4828110 0.3684262), wk = 0.0036364 k( 188) = ( 0.0300000 0.4735267 0.3820716), wk = 0.0036364 k( 189) = ( 0.0400000 0.4642425 0.3957170), wk = 0.0036364 k( 190) = ( 0.0500000 0.4549582 0.4093624), wk = 0.0036364 k( 191) = ( 0.0600000 0.4456740 0.4230078), wk = 0.0036364 k( 192) = ( 0.0700000 0.4363897 0.4366532), wk = 0.0036364 k( 193) = ( 0.0800000 0.4271055 0.4502986), wk = 0.0036364 k( 194) = ( 0.0900000 0.4178212 0.4639440), wk = 0.0036364 k( 195) = ( 0.1000000 0.4085370 0.4775895), wk = 0.0036364 k( 196) = ( 0.1100000 0.3992527 0.4912349), wk = 0.0036364 k( 197) = ( 0.1200000 0.3899685 0.5048803), wk = 0.0036364 k( 198) = ( 0.1300000 0.3806842 0.5185257), wk = 0.0036364 k( 199) = ( 0.1400000 0.3714000 0.5321711), wk = 0.0036364 k( 200) = ( 0.1500000 0.3621157 0.5458165), wk = 0.0036364 k( 201) = ( 0.1600000 0.3528315 0.5594619), wk = 0.0036364 k( 202) = ( 0.1700000 0.3435472 0.5731073), wk = 0.0036364 k( 203) = ( 0.1800000 0.3342630 0.5867528), wk = 0.0036364 k( 204) = ( 0.1900000 0.3249787 0.6003982), wk = 0.0036364 k( 205) = ( 0.2000000 0.3156945 0.6140436), wk = 0.0036364 k( 206) = ( 0.2100000 0.3064102 0.6276890), wk = 0.0036364 k( 207) = ( 0.2200000 0.2971260 0.6413344), wk = 0.0036364 k( 208) = ( 0.2300000 0.2878417 0.6549798), wk = 0.0036364 k( 209) = ( 0.2400000 0.2785575 0.6686252), wk = 0.0036364 k( 210) = ( 0.2500000 0.2692732 0.6822707), wk = 0.0036364 k( 211) = ( 0.2500000 0.2692732 0.6822707), wk = 0.0036364 k( 212) = ( 0.2589286 0.2788901 0.6681363), wk = 0.0036364 k( 213) = ( 0.2678571 0.2885070 0.6540020), wk = 0.0036364 k( 214) = ( 0.2767857 0.2981239 0.6398677), wk = 0.0036364 k( 215) = ( 0.2857143 0.3077408 0.6257334), wk = 0.0036364 k( 216) = ( 0.2946429 0.3173577 0.6115990), wk = 0.0036364 k( 217) = ( 0.3035714 0.3269746 0.5974647), wk = 0.0036364 k( 218) = ( 0.3125000 0.3365915 0.5833304), wk = 0.0036364 k( 219) = ( 0.3214286 0.3462084 0.5691961), wk = 0.0036364 k( 220) = ( 0.3303571 0.3558253 0.5550617), wk = 0.0036364 k( 221) = ( 0.3392857 0.3654422 0.5409274), wk = 0.0036364 k( 222) = ( 0.3482143 0.3750592 0.5267931), wk = 0.0036364 k( 223) = ( 0.3571429 0.3846761 0.5126588), wk = 0.0036364 k( 224) = ( 0.3660714 0.3942930 0.4985245), wk = 0.0036364 k( 225) = ( 0.3750000 0.4039099 0.4843901), wk = 0.0036364 k( 226) = ( 0.3839286 0.4135268 0.4702558), wk = 0.0036364 k( 227) = ( 0.3928571 0.4231436 0.4561215), wk = 0.0036364 k( 228) = ( 0.4017857 0.4327605 0.4419872), wk = 0.0036364 k( 229) = ( 0.4107143 0.4423775 0.4278528), wk = 0.0036364 k( 230) = ( 0.4196429 0.4519944 0.4137185), wk = 0.0036364 k( 231) = ( 0.4285714 0.4616113 0.3995842), wk = 0.0036364 k( 232) = ( 0.4375000 0.4712282 0.3854499), wk = 0.0036364 k( 233) = ( 0.4464286 0.4808451 0.3713155), wk = 0.0036364 k( 234) = ( 0.4553571 0.4904620 0.3571812), wk = 0.0036364 k( 235) = ( 0.4642857 0.5000789 0.3430469), wk = 0.0036364 k( 236) = ( 0.4732143 0.5096958 0.3289126), wk = 0.0036364 k( 237) = ( 0.4821429 0.5193127 0.3147783), wk = 0.0036364 k( 238) = ( 0.4910714 0.5289296 0.3006439), wk = 0.0036364 k( 239) = ( 0.5000000 0.5385465 0.2865096), wk = 0.0036364 k( 240) = ( 0.5000000 0.5385465 0.2865096), wk = 0.0036364 k( 241) = ( 0.5000000 0.5385465 0.2674090), wk = 0.0036364 k( 242) = ( 0.5000000 0.5385465 0.2483083), wk = 0.0036364 k( 243) = ( 0.5000000 0.5385465 0.2292077), wk = 0.0036364 k( 244) = ( 0.5000000 0.5385465 0.2101070), wk = 0.0036364 k( 245) = ( 0.5000000 0.5385465 0.1910064), wk = 0.0036364 k( 246) = ( 0.5000000 0.5385465 0.1719058), wk = 0.0036364 k( 247) = ( 0.5000000 0.5385465 0.1528051), wk = 0.0036364 k( 248) = ( 0.5000000 0.5385465 0.1337045), wk = 0.0036364 k( 249) = ( 0.5000000 0.5385465 0.1146038), wk = 0.0036364 k( 250) = ( 0.5000000 0.5385465 0.0955032), wk = 0.0036364 k( 251) = ( 0.5000000 0.5385465 0.0764026), wk = 0.0036364 k( 252) = ( 0.5000000 0.5385465 0.0573019), wk = 0.0036364 k( 253) = ( 0.5000000 0.5385465 0.0382013), wk = 0.0036364 k( 254) = ( 0.5000000 0.5385465 0.0191006), wk = 0.0036364 k( 255) = ( 0.5000000 0.5385465 0.0000000), wk = 0.0036364 k( 256) = ( 0.0000000 0.0000000 0.6822707), wk = 0.0036364 k( 257) = ( 0.0131579 0.0141723 0.6822707), wk = 0.0036364 k( 258) = ( 0.0263158 0.0283446 0.6822707), wk = 0.0036364 k( 259) = ( 0.0394737 0.0425168 0.6822707), wk = 0.0036364 k( 260) = ( 0.0526316 0.0566891 0.6822707), wk = 0.0036364 k( 261) = ( 0.0657895 0.0708614 0.6822707), wk = 0.0036364 k( 262) = ( 0.0789474 0.0850337 0.6822707), wk = 0.0036364 k( 263) = ( 0.0921053 0.0992059 0.6822707), wk = 0.0036364 k( 264) = ( 0.1052632 0.1133782 0.6822707), wk = 0.0036364 k( 265) = ( 0.1184210 0.1275505 0.6822707), wk = 0.0036364 k( 266) = ( 0.1315790 0.1417228 0.6822707), wk = 0.0036364 k( 267) = ( 0.1447368 0.1558950 0.6822707), wk = 0.0036364 k( 268) = ( 0.1578947 0.1700673 0.6822707), wk = 0.0036364 k( 269) = ( 0.1710526 0.1842396 0.6822707), wk = 0.0036364 k( 270) = ( 0.1842105 0.1984119 0.6822707), wk = 0.0036364 k( 271) = ( 0.1973684 0.2125841 0.6822707), wk = 0.0036364 k( 272) = ( 0.2105263 0.2267564 0.6822707), wk = 0.0036364 k( 273) = ( 0.2236842 0.2409287 0.6822707), wk = 0.0036364 k( 274) = ( 0.2368421 0.2551010 0.6822707), wk = 0.0036364 k( 275) = ( 0.2500000 0.2692732 0.6822707), wk = 0.0036364 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036364 k( 2) = ( 0.0000000 0.0000000 0.0142857), wk = 0.0036364 k( 3) = ( 0.0000000 0.0000000 0.0285714), wk = 0.0036364 k( 4) = ( 0.0000000 0.0000000 0.0428571), wk = 0.0036364 k( 5) = ( 0.0000000 0.0000000 0.0571429), wk = 0.0036364 k( 6) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0036364 k( 7) = ( 0.0000000 0.0000000 0.0857143), wk = 0.0036364 k( 8) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0036364 k( 9) = ( 0.0000000 0.0000000 0.1142857), wk = 0.0036364 k( 10) = ( 0.0000000 0.0000000 0.1285714), wk = 0.0036364 k( 11) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0036364 k( 12) = ( 0.0000000 0.0000000 0.1571429), wk = 0.0036364 k( 13) = ( 0.0000000 0.0000000 0.1714286), wk = 0.0036364 k( 14) = ( 0.0000000 0.0000000 0.1857143), wk = 0.0036364 k( 15) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0036364 k( 16) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0036364 k( 17) = ( 0.0000000 0.0000000 0.2285714), wk = 0.0036364 k( 18) = ( 0.0000000 0.0000000 0.2428571), wk = 0.0036364 k( 19) = ( 0.0000000 0.0000000 0.2571429), wk = 0.0036364 k( 20) = ( 0.0000000 0.0000000 0.2714286), wk = 0.0036364 k( 21) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0036364 k( 22) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0036364 k( 23) = ( 0.0000000 0.0000000 0.3142857), wk = 0.0036364 k( 24) = ( 0.0000000 0.0000000 0.3285714), wk = 0.0036364 k( 25) = ( 0.0000000 0.0000000 0.3428571), wk = 0.0036364 k( 26) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0036364 k( 27) = ( 0.0000000 0.0000000 0.3714286), wk = 0.0036364 k( 28) = ( 0.0000000 0.0000000 0.3857143), wk = 0.0036364 k( 29) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0036364 k( 30) = ( 0.0000000 0.0000000 0.4142857), wk = 0.0036364 k( 31) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0036364 k( 32) = ( 0.0000000 0.0000000 0.4428571), wk = 0.0036364 k( 33) = ( 0.0000000 0.0000000 0.4571429), wk = 0.0036364 k( 34) = ( 0.0000000 0.0000000 0.4714286), wk = 0.0036364 k( 35) = ( 0.0000000 0.0000000 0.4857143), wk = 0.0036364 k( 36) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036364 k( 37) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036364 k( 38) = ( -0.0145016 0.0145016 0.5000000), wk = 0.0036364 k( 39) = ( -0.0290032 0.0290032 0.5000000), wk = 0.0036364 k( 40) = ( -0.0435048 0.0435048 0.5000000), wk = 0.0036364 k( 41) = ( -0.0580065 0.0580065 0.5000000), wk = 0.0036364 k( 42) = ( -0.0725081 0.0725081 0.5000000), wk = 0.0036364 k( 43) = ( -0.0870097 0.0870097 0.5000000), wk = 0.0036364 k( 44) = ( -0.1015113 0.1015113 0.5000000), wk = 0.0036364 k( 45) = ( -0.1160129 0.1160129 0.5000000), wk = 0.0036364 k( 46) = ( -0.1305145 0.1305145 0.5000000), wk = 0.0036364 k( 47) = ( -0.1450162 0.1450162 0.5000000), wk = 0.0036364 k( 48) = ( -0.1595178 0.1595178 0.5000000), wk = 0.0036364 k( 49) = ( -0.1740194 0.1740194 0.5000000), wk = 0.0036364 k( 50) = ( -0.1885210 0.1885210 0.5000000), wk = 0.0036364 k( 51) = ( -0.2030226 0.2030226 0.5000000), wk = 0.0036364 k( 52) = ( -0.2175242 0.2175242 0.5000000), wk = 0.0036364 k( 53) = ( -0.2320258 0.2320258 0.5000000), wk = 0.0036364 k( 54) = ( -0.2465275 0.2465275 0.5000000), wk = 0.0036364 k( 55) = ( -0.2610291 0.2610291 0.5000000), wk = 0.0036364 k( 56) = ( -0.2755307 0.2755307 0.5000000), wk = 0.0036364 k( 57) = ( -0.2900323 0.2900323 0.5000000), wk = 0.0036364 k( 58) = ( -0.2900323 0.2900323 0.5000000), wk = 0.0036364 k( 59) = ( -0.2995763 0.2995763 0.4904560), wk = 0.0036364 k( 60) = ( -0.3091203 0.3091203 0.4809120), wk = 0.0036364 k( 61) = ( -0.3186643 0.3186643 0.4713680), wk = 0.0036364 k( 62) = ( -0.3282082 0.3282082 0.4618241), wk = 0.0036364 k( 63) = ( -0.3377522 0.3377522 0.4522801), wk = 0.0036364 k( 64) = ( -0.3472962 0.3472962 0.4427361), wk = 0.0036364 k( 65) = ( -0.3568402 0.3568402 0.4331921), wk = 0.0036364 k( 66) = ( -0.3663842 0.3663842 0.4236481), wk = 0.0036364 k( 67) = ( -0.3759282 0.3759282 0.4141041), wk = 0.0036364 k( 68) = ( -0.3854722 0.3854722 0.4045601), wk = 0.0036364 k( 69) = ( -0.3950162 0.3950162 0.3950162), wk = 0.0036364 k( 70) = ( -0.3950162 0.3950162 0.3950162), wk = 0.0036364 k( 71) = ( -0.3848875 0.3848875 0.3848875), wk = 0.0036364 k( 72) = ( -0.3747589 0.3747589 0.3747589), wk = 0.0036364 k( 73) = ( -0.3646303 0.3646303 0.3646303), wk = 0.0036364 k( 74) = ( -0.3545017 0.3545017 0.3545017), wk = 0.0036364 k( 75) = ( -0.3443731 0.3443731 0.3443731), wk = 0.0036364 k( 76) = ( -0.3342444 0.3342444 0.3342444), wk = 0.0036364 k( 77) = ( -0.3241158 0.3241158 0.3241158), wk = 0.0036364 k( 78) = ( -0.3139872 0.3139872 0.3139872), wk = 0.0036364 k( 79) = ( -0.3038586 0.3038586 0.3038586), wk = 0.0036364 k( 80) = ( -0.2937300 0.2937300 0.2937300), wk = 0.0036364 k( 81) = ( -0.2836013 0.2836013 0.2836013), wk = 0.0036364 k( 82) = ( -0.2734727 0.2734727 0.2734727), wk = 0.0036364 k( 83) = ( -0.2633441 0.2633441 0.2633441), wk = 0.0036364 k( 84) = ( -0.2532155 0.2532155 0.2532155), wk = 0.0036364 k( 85) = ( -0.2430869 0.2430869 0.2430869), wk = 0.0036364 k( 86) = ( -0.2329582 0.2329582 0.2329582), wk = 0.0036364 k( 87) = ( -0.2228296 0.2228296 0.2228296), wk = 0.0036364 k( 88) = ( -0.2127010 0.2127010 0.2127010), wk = 0.0036364 k( 89) = ( -0.2025724 0.2025724 0.2025724), wk = 0.0036364 k( 90) = ( -0.1924438 0.1924438 0.1924438), wk = 0.0036364 k( 91) = ( -0.1823152 0.1823152 0.1823152), wk = 0.0036364 k( 92) = ( -0.1721865 0.1721865 0.1721865), wk = 0.0036364 k( 93) = ( -0.1620579 0.1620579 0.1620579), wk = 0.0036364 k( 94) = ( -0.1519293 0.1519293 0.1519293), wk = 0.0036364 k( 95) = ( -0.1418007 0.1418007 0.1418007), wk = 0.0036364 k( 96) = ( -0.1316721 0.1316721 0.1316721), wk = 0.0036364 k( 97) = ( -0.1215434 0.1215434 0.1215434), wk = 0.0036364 k( 98) = ( -0.1114148 0.1114148 0.1114148), wk = 0.0036364 k( 99) = ( -0.1012862 0.1012862 0.1012862), wk = 0.0036364 k( 100) = ( -0.0911576 0.0911576 0.0911576), wk = 0.0036364 k( 101) = ( -0.0810290 0.0810290 0.0810290), wk = 0.0036364 k( 102) = ( -0.0709003 0.0709003 0.0709003), wk = 0.0036364 k( 103) = ( -0.0607717 0.0607717 0.0607717), wk = 0.0036364 k( 104) = ( -0.0506431 0.0506431 0.0506431), wk = 0.0036364 k( 105) = ( -0.0405145 0.0405145 0.0405145), wk = 0.0036364 k( 106) = ( -0.0303859 0.0303859 0.0303859), wk = 0.0036364 k( 107) = ( -0.0202572 0.0202572 0.0202572), wk = 0.0036364 k( 108) = ( -0.0101286 0.0101286 0.0101286), wk = 0.0036364 k( 109) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036364 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036364 k( 111) = ( 0.0135135 0.0135135 -0.0135135), wk = 0.0036364 k( 112) = ( 0.0270270 0.0270270 -0.0270270), wk = 0.0036364 k( 113) = ( 0.0405405 0.0405405 -0.0405405), wk = 0.0036364 k( 114) = ( 0.0540540 0.0540541 -0.0540541), wk = 0.0036364 k( 115) = ( 0.0675676 0.0675676 -0.0675676), wk = 0.0036364 k( 116) = ( 0.0810811 0.0810811 -0.0810811), wk = 0.0036364 k( 117) = ( 0.0945946 0.0945946 -0.0945946), wk = 0.0036364 k( 118) = ( 0.1081081 0.1081081 -0.1081081), wk = 0.0036364 k( 119) = ( 0.1216216 0.1216216 -0.1216216), wk = 0.0036364 k( 120) = ( 0.1351351 0.1351351 -0.1351351), wk = 0.0036364 k( 121) = ( 0.1486486 0.1486487 -0.1486487), wk = 0.0036364 k( 122) = ( 0.1621622 0.1621622 -0.1621622), wk = 0.0036364 k( 123) = ( 0.1756757 0.1756757 -0.1756757), wk = 0.0036364 k( 124) = ( 0.1891892 0.1891892 -0.1891892), wk = 0.0036364 k( 125) = ( 0.2027027 0.2027027 -0.2027027), wk = 0.0036364 k( 126) = ( 0.2162162 0.2162162 -0.2162162), wk = 0.0036364 k( 127) = ( 0.2297297 0.2297297 -0.2297297), wk = 0.0036364 k( 128) = ( 0.2432432 0.2432432 -0.2432432), wk = 0.0036364 k( 129) = ( 0.2567568 0.2567568 -0.2567568), wk = 0.0036364 k( 130) = ( 0.2702703 0.2702703 -0.2702703), wk = 0.0036364 k( 131) = ( 0.2837838 0.2837838 -0.2837838), wk = 0.0036364 k( 132) = ( 0.2972973 0.2972973 -0.2972973), wk = 0.0036364 k( 133) = ( 0.3108108 0.3108108 -0.3108108), wk = 0.0036364 k( 134) = ( 0.3243243 0.3243243 -0.3243243), wk = 0.0036364 k( 135) = ( 0.3378378 0.3378378 -0.3378378), wk = 0.0036364 k( 136) = ( 0.3513514 0.3513514 -0.3513514), wk = 0.0036364 k( 137) = ( 0.3648649 0.3648649 -0.3648649), wk = 0.0036364 k( 138) = ( 0.3783784 0.3783784 -0.3783784), wk = 0.0036364 k( 139) = ( 0.3918919 0.3918919 -0.3918919), wk = 0.0036364 k( 140) = ( 0.4054054 0.4054054 -0.4054054), wk = 0.0036364 k( 141) = ( 0.4189189 0.4189189 -0.4189189), wk = 0.0036364 k( 142) = ( 0.4324324 0.4324324 -0.4324324), wk = 0.0036364 k( 143) = ( 0.4459459 0.4459460 -0.4459460), wk = 0.0036364 k( 144) = ( 0.4594595 0.4594595 -0.4594595), wk = 0.0036364 k( 145) = ( 0.4729730 0.4729730 -0.4729730), wk = 0.0036364 k( 146) = ( 0.4864865 0.4864865 -0.4864865), wk = 0.0036364 k( 147) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036364 k( 148) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036364 k( 149) = ( 0.4904560 0.5095440 -0.4904560), wk = 0.0036364 k( 150) = ( 0.4809120 0.5190880 -0.4809120), wk = 0.0036364 k( 151) = ( 0.4713680 0.5286320 -0.4713680), wk = 0.0036364 k( 152) = ( 0.4618240 0.5381759 -0.4618240), wk = 0.0036364 k( 153) = ( 0.4522801 0.5477199 -0.4522801), wk = 0.0036364 k( 154) = ( 0.4427361 0.5572639 -0.4427361), wk = 0.0036364 k( 155) = ( 0.4331921 0.5668079 -0.4331921), wk = 0.0036364 k( 156) = ( 0.4236481 0.5763519 -0.4236481), wk = 0.0036364 k( 157) = ( 0.4141041 0.5858959 -0.4141041), wk = 0.0036364 k( 158) = ( 0.4045601 0.5954399 -0.4045601), wk = 0.0036364 k( 159) = ( 0.3950162 0.6049838 -0.3950162), wk = 0.0036364 k( 160) = ( 0.3950162 0.6049838 -0.3950162), wk = 0.0036364 k( 161) = ( 0.3785571 0.6006095 -0.3785571), wk = 0.0036364 k( 162) = ( 0.3620981 0.5962352 -0.3620981), wk = 0.0036364 k( 163) = ( 0.3456391 0.5918609 -0.3456391), wk = 0.0036364 k( 164) = ( 0.3291801 0.5874865 -0.3291801), wk = 0.0036364 k( 165) = ( 0.3127211 0.5831122 -0.3127211), wk = 0.0036364 k( 166) = ( 0.2962621 0.5787379 -0.2962621), wk = 0.0036364 k( 167) = ( 0.2798031 0.5743636 -0.2798031), wk = 0.0036364 k( 168) = ( 0.2633441 0.5699892 -0.2633441), wk = 0.0036364 k( 169) = ( 0.2468851 0.5656149 -0.2468851), wk = 0.0036364 k( 170) = ( 0.2304261 0.5612406 -0.2304261), wk = 0.0036364 k( 171) = ( 0.2139671 0.5568663 -0.2139671), wk = 0.0036364 k( 172) = ( 0.1975081 0.5524919 -0.1975081), wk = 0.0036364 k( 173) = ( 0.1810491 0.5481176 -0.1810491), wk = 0.0036364 k( 174) = ( 0.1645901 0.5437433 -0.1645901), wk = 0.0036364 k( 175) = ( 0.1481311 0.5393689 -0.1481311), wk = 0.0036364 k( 176) = ( 0.1316721 0.5349946 -0.1316721), wk = 0.0036364 k( 177) = ( 0.1152130 0.5306203 -0.1152130), wk = 0.0036364 k( 178) = ( 0.0987540 0.5262460 -0.0987540), wk = 0.0036364 k( 179) = ( 0.0822950 0.5218716 -0.0822950), wk = 0.0036364 k( 180) = ( 0.0658360 0.5174973 -0.0658360), wk = 0.0036364 k( 181) = ( 0.0493770 0.5131230 -0.0493770), wk = 0.0036364 k( 182) = ( 0.0329180 0.5087487 -0.0329180), wk = 0.0036364 k( 183) = ( 0.0164590 0.5043743 -0.0164590), wk = 0.0036364 k( 184) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0036364 k( 185) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0036364 k( 186) = ( 0.0100000 0.4900000 0.0100000), wk = 0.0036364 k( 187) = ( 0.0200000 0.4800000 0.0200000), wk = 0.0036364 k( 188) = ( 0.0300000 0.4700000 0.0300000), wk = 0.0036364 k( 189) = ( 0.0400000 0.4600000 0.0400000), wk = 0.0036364 k( 190) = ( 0.0500000 0.4500000 0.0500000), wk = 0.0036364 k( 191) = ( 0.0600000 0.4400000 0.0600000), wk = 0.0036364 k( 192) = ( 0.0700000 0.4300000 0.0700000), wk = 0.0036364 k( 193) = ( 0.0800000 0.4200000 0.0800000), wk = 0.0036364 k( 194) = ( 0.0900000 0.4100000 0.0900000), wk = 0.0036364 k( 195) = ( 0.1000000 0.4000000 0.1000000), wk = 0.0036364 k( 196) = ( 0.1100000 0.3900000 0.1100000), wk = 0.0036364 k( 197) = ( 0.1200000 0.3800000 0.1200000), wk = 0.0036364 k( 198) = ( 0.1300000 0.3700000 0.1300000), wk = 0.0036364 k( 199) = ( 0.1400000 0.3600000 0.1400000), wk = 0.0036364 k( 200) = ( 0.1500000 0.3500000 0.1500000), wk = 0.0036364 k( 201) = ( 0.1600000 0.3400000 0.1600000), wk = 0.0036364 k( 202) = ( 0.1700000 0.3300000 0.1700000), wk = 0.0036364 k( 203) = ( 0.1800000 0.3200000 0.1800000), wk = 0.0036364 k( 204) = ( 0.1900000 0.3100000 0.1900000), wk = 0.0036364 k( 205) = ( 0.2000000 0.3000000 0.2000000), wk = 0.0036364 k( 206) = ( 0.2100000 0.2900000 0.2100000), wk = 0.0036364 k( 207) = ( 0.2200000 0.2800000 0.2200000), wk = 0.0036364 k( 208) = ( 0.2300000 0.2700000 0.2300000), wk = 0.0036364 k( 209) = ( 0.2400000 0.2600000 0.2400000), wk = 0.0036364 k( 210) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036364 k( 211) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036364 k( 212) = ( 0.2589286 0.2589286 0.2307131), wk = 0.0036364 k( 213) = ( 0.2678571 0.2678571 0.2114263), wk = 0.0036364 k( 214) = ( 0.2767857 0.2767857 0.1921394), wk = 0.0036364 k( 215) = ( 0.2857143 0.2857143 0.1728525), wk = 0.0036364 k( 216) = ( 0.2946429 0.2946429 0.1535657), wk = 0.0036364 k( 217) = ( 0.3035714 0.3035714 0.1342788), wk = 0.0036364 k( 218) = ( 0.3125000 0.3125000 0.1149919), wk = 0.0036364 k( 219) = ( 0.3214286 0.3214286 0.0957051), wk = 0.0036364 k( 220) = ( 0.3303571 0.3303571 0.0764182), wk = 0.0036364 k( 221) = ( 0.3392857 0.3392857 0.0571313), wk = 0.0036364 k( 222) = ( 0.3482143 0.3482143 0.0378444), wk = 0.0036364 k( 223) = ( 0.3571429 0.3571429 0.0185576), wk = 0.0036364 k( 224) = ( 0.3660714 0.3660714 -0.0007293), wk = 0.0036364 k( 225) = ( 0.3750000 0.3750000 -0.0200161), wk = 0.0036364 k( 226) = ( 0.3839286 0.3839286 -0.0393030), wk = 0.0036364 k( 227) = ( 0.3928571 0.3928571 -0.0585899), wk = 0.0036364 k( 228) = ( 0.4017857 0.4017857 -0.0778767), wk = 0.0036364 k( 229) = ( 0.4107143 0.4107143 -0.0971636), wk = 0.0036364 k( 230) = ( 0.4196429 0.4196429 -0.1164505), wk = 0.0036364 k( 231) = ( 0.4285714 0.4285714 -0.1357374), wk = 0.0036364 k( 232) = ( 0.4375000 0.4375000 -0.1550242), wk = 0.0036364 k( 233) = ( 0.4464286 0.4464286 -0.1743111), wk = 0.0036364 k( 234) = ( 0.4553571 0.4553571 -0.1935980), wk = 0.0036364 k( 235) = ( 0.4642857 0.4642857 -0.2128848), wk = 0.0036364 k( 236) = ( 0.4732143 0.4732143 -0.2321717), wk = 0.0036364 k( 237) = ( 0.4821429 0.4821429 -0.2514586), wk = 0.0036364 k( 238) = ( 0.4910714 0.4910714 -0.2707454), wk = 0.0036364 k( 239) = ( 0.5000000 0.5000000 -0.2900323), wk = 0.0036364 k( 240) = ( 0.5000000 0.5000000 -0.2900323), wk = 0.0036364 k( 241) = ( 0.5000000 0.5000000 -0.3040301), wk = 0.0036364 k( 242) = ( 0.5000000 0.5000000 -0.3180280), wk = 0.0036364 k( 243) = ( 0.5000000 0.5000000 -0.3320258), wk = 0.0036364 k( 244) = ( 0.5000000 0.5000000 -0.3460237), wk = 0.0036364 k( 245) = ( 0.5000000 0.5000000 -0.3600215), wk = 0.0036364 k( 246) = ( 0.5000000 0.5000000 -0.3740194), wk = 0.0036364 k( 247) = ( 0.5000000 0.5000000 -0.3880172), wk = 0.0036364 k( 248) = ( 0.5000000 0.5000000 -0.4020151), wk = 0.0036364 k( 249) = ( 0.5000000 0.5000000 -0.4160129), wk = 0.0036364 k( 250) = ( 0.5000000 0.5000000 -0.4300108), wk = 0.0036364 k( 251) = ( 0.5000000 0.5000000 -0.4440086), wk = 0.0036364 k( 252) = ( 0.5000000 0.5000000 -0.4580065), wk = 0.0036364 k( 253) = ( 0.5000000 0.5000000 -0.4720043), wk = 0.0036364 k( 254) = ( 0.5000000 0.5000000 -0.4860022), wk = 0.0036364 k( 255) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036364 k( 256) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036364 k( 257) = ( 0.0131579 0.0131579 0.4868421), wk = 0.0036364 k( 258) = ( 0.0263158 0.0263158 0.4736842), wk = 0.0036364 k( 259) = ( 0.0394737 0.0394737 0.4605263), wk = 0.0036364 k( 260) = ( 0.0526316 0.0526316 0.4473684), wk = 0.0036364 k( 261) = ( 0.0657895 0.0657895 0.4342105), wk = 0.0036364 k( 262) = ( 0.0789474 0.0789474 0.4210526), wk = 0.0036364 k( 263) = ( 0.0921053 0.0921053 0.4078947), wk = 0.0036364 k( 264) = ( 0.1052632 0.1052632 0.3947368), wk = 0.0036364 k( 265) = ( 0.1184210 0.1184211 0.3815790), wk = 0.0036364 k( 266) = ( 0.1315790 0.1315790 0.3684211), wk = 0.0036364 k( 267) = ( 0.1447368 0.1447368 0.3552632), wk = 0.0036364 k( 268) = ( 0.1578947 0.1578947 0.3421053), wk = 0.0036364 k( 269) = ( 0.1710526 0.1710526 0.3289474), wk = 0.0036364 k( 270) = ( 0.1842105 0.1842105 0.3157895), wk = 0.0036364 k( 271) = ( 0.1973684 0.1973684 0.3026316), wk = 0.0036364 k( 272) = ( 0.2105263 0.2105263 0.2894737), wk = 0.0036364 k( 273) = ( 0.2236842 0.2236842 0.2763158), wk = 0.0036364 k( 274) = ( 0.2368421 0.2368421 0.2631579), wk = 0.0036364 k( 275) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036364 Dense grid: 117049 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 1.26 Mb ( 844, 98) NL pseudopotentials 1.78 Mb ( 422, 276) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 3250) G-vector shells 0.01 Mb ( 1497) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 5.05 Mb ( 844, 392) Each subspace H/S matrix 0.15 Mb ( 98, 98) Each matrix 0.83 Mb ( 276, 2, 98) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./CsAgF3.save/charge-density.dat Starting wfc are 104 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.4 secs Computing kpt #: 2 total cpu time spent up to now is 6.7 secs Computing kpt #: 3 total cpu time spent up to now is 9.0 secs Computing kpt #: 4 total cpu time spent up to now is 11.3 secs Computing kpt #: 5 total cpu time spent up to now is 13.7 secs Computing kpt #: 6 total cpu time spent up to now is 16.0 secs Computing kpt #: 7 total cpu time spent up to now is 18.3 secs Computing kpt #: 8 total cpu time spent up to now is 20.7 secs Computing kpt #: 9 total cpu time spent up to now is 23.0 secs Computing kpt #: 10 total cpu time spent up to now is 25.3 secs Computing kpt #: 11 total cpu time spent up to now is 27.7 secs Computing kpt #: 12 total cpu time spent up to now is 30.1 secs Computing kpt #: 13 total cpu time spent up to now is 32.8 secs Computing kpt #: 14 total cpu time spent up to now is 35.6 secs Computing kpt #: 15 total cpu time spent up to now is 38.3 secs Computing kpt #: 16 total cpu time spent up to now is 40.7 secs Computing kpt #: 17 total cpu time spent up to now is 43.1 secs Computing kpt #: 18 total cpu time spent up to now is 45.4 secs Computing kpt #: 19 total cpu time spent up to now is 47.8 secs Computing kpt #: 20 total cpu time spent up to now is 50.2 secs Computing kpt #: 21 total cpu time spent up to now is 52.6 secs Computing kpt #: 22 total cpu time spent up to now is 54.9 secs Computing kpt #: 23 total cpu time spent up to now is 57.8 secs Computing kpt #: 24 total cpu time spent up to now is 60.6 secs Computing kpt #: 25 total cpu time spent up to now is 63.4 secs Computing kpt #: 26 total cpu time spent up to now is 66.2 secs Computing kpt #: 27 total cpu time spent up to now is 68.9 secs Computing kpt #: 28 total cpu time spent up to now is 71.6 secs Computing kpt #: 29 total cpu time spent up to now is 74.4 secs Computing kpt #: 30 total cpu time spent up to now is 77.1 secs Computing kpt #: 31 total cpu time spent up to now is 79.8 secs Computing kpt #: 32 total cpu time spent up to now is 82.5 secs Computing kpt #: 33 total cpu time spent up to now is 85.3 secs Computing kpt #: 34 total cpu time spent up to now is 88.2 secs Computing kpt #: 35 total cpu time spent up to now is 91.1 secs Computing kpt #: 36 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 97.0 secs Computing kpt #: 37 total cpu time spent up to now is 101.2 secs Computing kpt #: 38 total cpu time spent up to now is 106.9 secs Computing kpt #: 39 total cpu time spent up to now is 111.8 secs Computing kpt #: 40 total cpu time spent up to now is 116.8 secs Computing kpt #: 41 total cpu time spent up to now is 121.0 secs Computing kpt #: 42 total cpu time spent up to now is 126.6 secs Computing kpt #: 43 total cpu time spent up to now is 131.5 secs Computing kpt #: 44 total cpu time spent up to now is 134.9 secs Computing kpt #: 45 total cpu time spent up to now is 138.5 secs Computing kpt #: 46 total cpu time spent up to now is 141.5 secs Computing kpt #: 47 total cpu time spent up to now is 144.3 secs Computing kpt #: 48 total cpu time spent up to now is 147.0 secs Computing kpt #: 49 total cpu time spent up to now is 149.7 secs Computing kpt #: 50 total cpu time spent up to now is 152.0 secs Computing kpt #: 51 total cpu time spent up to now is 154.4 secs Computing kpt #: 52 total cpu time spent up to now is 156.8 secs Computing kpt #: 53 total cpu time spent up to now is 159.1 secs Computing kpt #: 54 total cpu time spent up to now is 161.4 secs Computing kpt #: 55 total cpu time spent up to now is 163.7 secs Computing kpt #: 56 total cpu time spent up to now is 166.0 secs Computing kpt 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spent up to now is 206.0 secs Computing kpt #: 73 total cpu time spent up to now is 208.4 secs Computing kpt #: 74 total cpu time spent up to now is 210.8 secs Computing kpt #: 75 total cpu time spent up to now is 213.2 secs Computing kpt #: 76 total cpu time spent up to now is 215.6 secs Computing kpt #: 77 total cpu time spent up to now is 218.4 secs Computing kpt #: 78 total cpu time spent up to now is 221.1 secs Computing kpt #: 79 total cpu time spent up to now is 223.9 secs Computing kpt #: 80 total cpu time spent up to now is 226.6 secs Computing kpt #: 81 total cpu time spent up to now is 229.3 secs Computing kpt #: 82 total cpu time spent up to now is 231.7 secs Computing kpt #: 83 total cpu time spent up to now is 234.0 secs Computing kpt #: 84 total cpu time spent up to now is 236.3 secs Computing kpt #: 85 total cpu time spent up to now is 238.6 secs Computing kpt #: 86 total cpu time spent up to now is 240.9 secs Computing kpt #: 87 total cpu time spent up to now is 243.2 secs Computing kpt #: 88 total cpu time spent up to now is 245.5 secs Computing kpt #: 89 total cpu time spent up to now is 247.8 secs Computing kpt #: 90 total cpu time spent up to now is 250.1 secs Computing kpt #: 91 total cpu time spent up to now is 252.5 secs Computing kpt #: 92 total cpu time spent up to now is 254.8 secs Computing kpt #: 93 total cpu time spent up to now is 257.2 secs Computing kpt #: 94 total cpu time spent up to now is 259.9 secs Computing kpt #: 95 total cpu time spent up to now is 262.7 secs Computing kpt #: 96 total cpu time spent up to now is 265.5 secs Computing kpt #: 97 total cpu time spent up to now is 268.3 secs Computing kpt #: 98 total cpu time spent up to now is 271.0 secs Computing kpt #: 99 total cpu time spent up to now is 273.4 secs Computing kpt #: 100 total cpu time spent up to now is 275.6 secs Computing kpt #: 101 total cpu time spent up to now is 277.9 secs Computing kpt #: 102 total cpu time spent up to now is 280.1 secs Computing kpt #: 103 total cpu time spent up to now is 282.4 secs Computing kpt #: 104 total cpu time spent up to now is 284.6 secs Computing kpt #: 105 total cpu time spent up to now is 286.9 secs Computing kpt #: 106 total cpu time spent up to now is 289.2 secs Computing kpt #: 107 total cpu time spent up to now is 291.4 secs Computing kpt #: 108 total cpu time spent up to now is 293.7 secs Computing kpt #: 109 total cpu time spent up to now is 296.0 secs Computing kpt #: 110 total cpu time spent up to now is 298.2 secs Computing kpt #: 111 total cpu time spent up to now is 300.5 secs Computing kpt #: 112 total cpu time spent up to now is 302.7 secs Computing kpt #: 113 total cpu time spent up to now is 305.0 secs Computing kpt #: 114 total cpu time spent up to now is 307.2 secs Computing kpt #: 115 total cpu time spent up to now is 309.5 secs Computing kpt #: 116 total cpu time spent up to now is 311.8 secs Computing kpt #: 117 total cpu time spent up to now is 314.0 secs Computing kpt #: 118 total cpu time spent up to now is 316.4 secs Computing kpt #: 119 total cpu time spent up to now is 318.6 secs Computing kpt #: 120 total cpu time spent up to now is 320.9 secs Computing kpt #: 121 total cpu time spent up to now is 323.3 secs Computing kpt #: 122 total cpu time spent up to now is 325.9 secs Computing kpt #: 123 total cpu time spent up to now is 328.6 secs Computing kpt #: 124 total cpu time spent up to now is 331.3 secs Computing kpt #: 125 total cpu time spent up to now is 334.7 secs Computing kpt #: 126 total cpu time spent up to now is 337.5 secs Computing kpt #: 127 total cpu time spent up to now is 340.3 secs Computing kpt #: 128 total cpu time spent up to now is 343.8 secs Computing kpt #: 129 total cpu time spent up to now is 346.8 secs Computing kpt #: 130 total cpu time spent up to now is 349.8 secs Computing kpt #: 131 total cpu time spent up to now is 352.6 secs Computing kpt #: 132 total cpu time spent up to now is 355.4 secs Computing kpt #: 133 total cpu time spent up to now is 358.1 secs Computing kpt #: 134 total cpu time spent up to now is 360.9 secs Computing kpt #: 135 total cpu time spent up to now is 363.7 secs Computing kpt #: 136 total cpu time spent up to now is 366.0 secs Computing kpt #: 137 total cpu time spent up to now is 368.3 secs Computing kpt #: 138 total cpu time spent up to now is 370.6 secs Computing kpt #: 139 total cpu time spent up to now is 372.9 secs Computing kpt #: 140 total cpu time spent up to now is 375.2 secs Computing kpt #: 141 total cpu time spent up to now is 377.6 secs Computing kpt #: 142 total cpu time spent up to now is 379.9 secs Computing kpt #: 143 total cpu time spent up to now is 382.2 secs Computing kpt #: 144 total cpu time spent up to now is 384.4 secs Computing kpt #: 145 total cpu time spent up to now is 386.7 secs Computing kpt #: 146 total cpu time spent up to now is 389.0 secs Computing kpt #: 147 total cpu time spent up to now is 391.2 secs Computing kpt #: 148 total cpu time spent up to now is 393.4 secs Computing kpt #: 149 total cpu time spent up to now is 395.7 secs Computing kpt #: 150 total cpu time spent up to now is 398.0 secs Computing kpt #: 151 total cpu time spent up to now is 400.2 secs Computing kpt #: 152 total cpu time spent up to now is 402.5 secs Computing kpt #: 153 total cpu time spent up to now is 404.7 secs Computing kpt #: 154 total cpu time spent up to now is 407.0 secs Computing kpt #: 155 total cpu time spent up to now is 409.4 secs Computing kpt #: 156 total cpu time spent up to now is 411.7 secs Computing kpt #: 157 total cpu time spent up to now is 414.4 secs Computing kpt #: 158 total cpu time spent up to now is 417.1 secs Computing kpt #: 159 total cpu time spent up to now is 419.9 secs Computing kpt #: 160 total cpu time spent up to now is 422.6 secs Computing kpt #: 161 total cpu time spent up to now is 425.3 secs Computing kpt #: 162 total cpu time spent up to now is 428.5 secs Computing kpt #: 163 total cpu time spent up to now is 430.9 secs Computing kpt #: 164 total cpu time spent up to now is 433.7 secs Computing kpt #: 165 total cpu time spent up to now is 436.4 secs Computing kpt #: 166 total cpu time spent up to now is 439.2 secs Computing kpt #: 167 total cpu time spent up to now is 441.9 secs Computing kpt #: 168 total cpu time spent up to now is 444.7 secs Computing kpt #: 169 total cpu time spent up to now is 447.5 secs Computing kpt #: 170 total cpu time spent up to now is 449.8 secs Computing kpt #: 171 total cpu time spent up to now is 452.3 secs Computing kpt #: 172 total cpu time spent up to now is 454.7 secs Computing kpt #: 173 total cpu time spent up to now is 457.2 secs Computing kpt #: 174 total cpu time spent up to now is 459.6 secs Computing kpt #: 175 total cpu time spent up to now is 462.0 secs Computing kpt #: 176 total cpu time spent up to now is 464.4 secs Computing kpt #: 177 total cpu time spent up to now is 466.8 secs Computing kpt #: 178 total cpu time spent up to now is 469.2 secs Computing kpt #: 179 total cpu time spent up to now is 471.7 secs Computing kpt #: 180 total cpu time spent up to now is 474.5 secs Computing kpt #: 181 total cpu time spent up to now is 477.2 secs Computing kpt #: 182 total cpu time spent up to now is 480.0 secs Computing kpt #: 183 total cpu time spent up to now is 482.9 secs Computing kpt #: 184 total cpu time spent up to now is 485.8 secs Computing kpt #: 185 total cpu time spent up to now is 488.8 secs Computing kpt #: 186 total cpu time spent up to now is 491.6 secs Computing kpt #: 187 total cpu time spent up to now is 494.6 secs Computing kpt #: 188 total cpu time spent up to now is 497.4 secs Computing kpt #: 189 total cpu time spent up to now is 500.2 secs Computing kpt #: 190 total cpu time spent up to now is 503.0 secs Computing kpt #: 191 total cpu time spent up to now is 505.8 secs Computing kpt #: 192 total cpu time spent up to now is 508.5 secs Computing kpt #: 193 total cpu time spent up to now is 511.3 secs Computing kpt #: 194 total cpu time spent up to now is 514.1 secs Computing kpt #: 195 total cpu time spent up to now is 516.8 secs Computing kpt #: 196 total cpu time spent up to now is 519.7 secs Computing kpt #: 197 total cpu time spent up to now is 522.4 secs Computing kpt #: 198 total cpu time spent up to now is 525.2 secs Computing kpt #: 199 total cpu time spent up to now is 528.0 secs Computing kpt #: 200 total cpu time spent up to now is 530.8 secs Computing kpt #: 201 total cpu time spent up to now is 533.6 secs Computing kpt #: 202 total cpu time spent up to now is 536.4 secs Computing kpt #: 203 total cpu time spent up to now is 538.9 secs Computing kpt #: 204 total cpu time spent up to now is 541.6 secs Computing kpt #: 205 total cpu time spent up to now is 544.4 secs Computing kpt #: 206 total cpu time spent up to now is 547.1 secs Computing kpt #: 207 total cpu time spent up to now is 549.9 secs Computing kpt #: 208 total cpu time spent up to now is 552.7 secs Computing kpt #: 209 total cpu time spent up to now is 555.5 secs Computing kpt #: 210 total cpu time spent up to now is 558.4 secs Computing kpt #: 211 total cpu time spent up to now is 561.2 secs Computing kpt #: 212 total cpu time spent up to now is 564.0 secs Computing kpt #: 213 total cpu time spent up to now is 566.7 secs Computing kpt #: 214 total cpu time spent up to now is 569.1 secs Computing kpt #: 215 total cpu time spent up to now is 571.5 secs Computing kpt #: 216 total cpu time spent up to now is 573.9 secs Computing kpt #: 217 total cpu time spent up to now is 576.4 secs Computing kpt #: 218 total cpu time spent up to now is 579.1 secs Computing kpt #: 219 total cpu time spent up to now is 581.9 secs Computing kpt #: 220 total cpu time spent up to now is 584.6 secs Computing kpt #: 221 total cpu time spent up to now is 587.3 secs Computing kpt #: 222 total cpu time spent up to now is 590.1 secs Computing kpt #: 223 total cpu time spent up to now is 592.9 secs Computing kpt #: 224 total cpu time spent up to now is 595.6 secs Computing kpt #: 225 total cpu time spent up to now is 598.4 secs Computing kpt #: 226 total cpu time spent up to now is 601.1 secs Computing kpt #: 227 total cpu time spent up to now is 603.8 secs Computing kpt #: 228 total cpu time spent up to now is 606.3 secs Computing kpt #: 229 total cpu time spent up to now is 608.7 secs Computing kpt #: 230 total cpu time spent up to now is 611.1 secs Computing kpt #: 231 total cpu time spent up to now is 613.5 secs Computing kpt #: 232 total cpu time spent up to now is 615.8 secs Computing kpt #: 233 total cpu time spent up to now is 618.2 secs Computing kpt #: 234 total cpu time spent up to now is 620.5 secs Computing kpt #: 235 total cpu time spent up to now is 622.8 secs Computing kpt #: 236 total cpu time spent up to now is 625.2 secs Computing kpt #: 237 total cpu time spent up to now is 627.4 secs Computing kpt #: 238 total cpu time spent up to now is 629.8 secs Computing kpt #: 239 total cpu time spent up to now is 632.0 secs Computing kpt #: 240 total cpu time spent up to now is 634.4 secs Computing kpt #: 241 total cpu time spent up to now is 636.7 secs Computing kpt #: 242 total cpu time spent up to now is 639.0 secs Computing kpt #: 243 total cpu time spent up to now is 641.4 secs Computing kpt #: 244 total cpu time spent up to now is 643.7 secs Computing kpt #: 245 total cpu time spent up to now is 646.1 secs Computing kpt #: 246 total cpu time spent up to now is 648.4 secs Computing kpt #: 247 total cpu time spent up to now is 650.7 secs Computing kpt #: 248 total cpu time spent up to now is 653.0 secs Computing kpt #: 249 total cpu time spent up to now is 655.2 secs Computing kpt #: 250 total cpu time spent up to now is 657.5 secs Computing kpt #: 251 total cpu time spent up to now is 659.7 secs Computing kpt #: 252 total cpu time spent up to now is 662.0 secs Computing kpt #: 253 total cpu time spent up to now is 664.2 secs Computing kpt #: 254 total cpu time spent up to now is 666.4 secs Computing kpt #: 255 total cpu time spent up to now is 668.7 secs Computing kpt #: 256 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 674.7 secs Computing kpt #: 257 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 680.6 secs Computing kpt #: 258 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 686.5 secs Computing kpt #: 259 total cpu time spent up to now is 690.7 secs Computing kpt #: 260 total cpu time spent up to now is 694.2 secs Computing kpt #: 261 total cpu time spent up to now is 697.6 secs Computing kpt #: 262 total cpu time spent up to now is 701.0 secs Computing kpt #: 263 total cpu time spent up to now is 704.0 secs Computing kpt #: 264 total cpu time spent up to now is 707.0 secs Computing kpt #: 265 total cpu time spent up to now is 710.0 secs Computing kpt #: 266 total cpu time spent up to now is 712.8 secs Computing kpt #: 267 total cpu time spent up to now is 715.6 secs Computing kpt #: 268 total cpu time spent up to now is 718.3 secs Computing kpt #: 269 total cpu time spent up to now is 721.1 secs Computing kpt #: 270 total cpu time spent up to now is 723.9 secs Computing kpt #: 271 total cpu time spent up to now is 726.7 secs Computing kpt #: 272 total cpu time spent up to now is 729.7 secs Computing kpt #: 273 total cpu time spent up to now is 732.4 secs Computing kpt #: 274 total cpu time spent up to now is 735.2 secs Computing kpt #: 275 total cpu time spent up to now is 738.1 secs ethr = 1.22E-08, avg # of iterations = 24.6 total cpu time spent up to now is 738.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 14599 PWs) bands (ev): -17.0102 -17.0102 -16.8500 -16.8500 -16.4056 -16.4056 -16.2729 -16.2729 -16.2689 -16.2689 -16.2513 -16.2513 -12.6908 -12.6908 -12.6646 -12.6646 -2.1108 -2.1108 -1.6351 -1.6351 -1.2040 -1.2040 -1.1634 -1.1634 -1.1024 -1.1024 -0.5094 -0.5094 -0.3585 -0.3585 -0.2215 -0.2215 -0.1931 -0.1931 0.8600 0.8600 1.2101 1.2101 1.4341 1.4341 1.4406 1.4406 1.5816 1.5816 1.7871 1.7871 1.8548 1.8548 1.9310 1.9310 2.2326 2.2326 2.2337 2.2337 2.2530 2.2530 2.5374 2.5374 2.7184 2.7184 2.7577 2.7577 2.7892 2.7892 2.9132 2.9132 2.9895 2.9895 3.0100 3.0100 3.0163 3.0163 3.2331 3.2331 3.7845 3.7845 3.8161 3.8161 3.9298 3.9298 5.4102 5.4102 5.9373 5.9373 8.6763 8.6763 11.3506 11.3506 11.4314 11.4314 11.4977 11.4977 11.5884 11.5884 11.6954 11.6954 13.5477 13.5477 k = 0.0000 0.0000 0.0195 ( 14599 PWs) bands (ev): -17.0101 -17.0101 -16.8500 -16.8500 -16.4055 -16.4055 -16.2736 -16.2736 -16.2683 -16.2683 -16.2513 -16.2513 -12.6909 -12.6909 -12.6646 -12.6646 -2.1102 -2.1102 -1.6349 -1.6349 -1.2039 -1.2039 -1.1625 -1.1625 -1.1014 -1.1014 -0.5093 -0.5093 -0.3582 -0.3582 -0.2203 -0.2203 -0.1925 -0.1925 0.8597 0.8597 1.2094 1.2094 1.4331 1.4331 1.4381 1.4381 1.5783 1.5783 1.7866 1.7866 1.8550 1.8550 1.9308 1.9308 2.2291 2.2291 2.2340 2.2340 2.2537 2.2537 2.5385 2.5385 2.7137 2.7137 2.7602 2.7602 2.7928 2.7928 2.9133 2.9133 2.9882 2.9882 3.0127 3.0127 3.0170 3.0170 3.2340 3.2340 3.7839 3.7839 3.8155 3.8155 3.9294 3.9294 5.4082 5.4082 5.9365 5.9365 8.6794 8.6794 11.3520 11.3520 11.4328 11.4328 11.4990 11.4990 11.5911 11.5911 11.6977 11.6977 13.5501 13.5501 k = 0.0000 0.0000 0.0390 ( 14595 PWs) bands (ev): -17.0100 -17.0100 -16.8500 -16.8500 -16.4052 -16.4052 -16.2753 -16.2753 -16.2670 -16.2670 -16.2514 -16.2514 -12.6911 -12.6911 -12.6648 -12.6648 -2.1081 -2.1081 -1.6345 -1.6345 -1.2036 -1.2036 -1.1599 -1.1599 -1.0984 -1.0984 -0.5089 -0.5089 -0.3573 -0.3573 -0.2171 -0.2171 -0.1902 -0.1902 0.8590 0.8590 1.2073 1.2073 1.4289 1.4289 1.4314 1.4314 1.5689 1.5689 1.7851 1.7851 1.8555 1.8555 1.9301 1.9301 2.2232 2.2232 2.2302 2.2302 2.2563 2.2563 2.5418 2.5418 2.7038 2.7038 2.7636 2.7636 2.8028 2.8028 2.9137 2.9137 2.9858 2.9858 3.0149 3.0149 3.0242 3.0242 3.2370 3.2370 3.7823 3.7823 3.8137 3.8137 3.9280 3.9280 5.4021 5.4021 5.9344 5.9344 8.6888 8.6888 11.3558 11.3558 11.4365 11.4365 11.5035 11.5035 11.5993 11.5993 11.7047 11.7047 13.5571 13.5571 k = 0.0000 0.0000 0.0585 ( 14587 PWs) bands (ev): -17.0096 -17.0096 -16.8501 -16.8501 -16.4046 -16.4046 -16.2772 -16.2772 -16.2657 -16.2657 -16.2514 -16.2514 -12.6914 -12.6914 -12.6652 -12.6652 -2.1048 -2.1048 -1.6337 -1.6337 -1.2032 -1.2032 -1.1555 -1.1555 -1.0933 -1.0933 -0.5082 -0.5082 -0.3559 -0.3559 -0.2130 -0.2130 -0.1853 -0.1853 0.8579 0.8579 1.2038 1.2038 1.4155 1.4155 1.4257 1.4257 1.5553 1.5553 1.7826 1.7826 1.8556 1.8556 1.9289 1.9289 2.2161 2.2161 2.2223 2.2223 2.2603 2.2603 2.5470 2.5470 2.6930 2.6930 2.7654 2.7654 2.8145 2.8145 2.9146 2.9146 2.9839 2.9839 3.0149 3.0149 3.0392 3.0392 3.2420 3.2420 3.7797 3.7797 3.8108 3.8108 3.9258 3.9258 5.3919 5.3919 5.9309 5.9309 8.7043 8.7043 11.3621 11.3621 11.4413 11.4413 11.5124 11.5124 11.6129 11.6129 11.7163 11.7163 13.5689 13.5689 k = 0.0000 0.0000 0.0780 ( 14583 PWs) bands (ev): -17.0092 -17.0092 -16.8501 -16.8501 -16.4039 -16.4039 -16.2794 -16.2794 -16.2645 -16.2645 -16.2515 -16.2515 -12.6918 -12.6918 -12.6657 -12.6657 -2.1001 -2.1001 -1.6327 -1.6327 -1.2026 -1.2026 -1.1493 -1.1493 -1.0861 -1.0861 -0.5072 -0.5072 -0.3538 -0.3538 -0.2094 -0.2094 -0.1766 -0.1766 0.8563 0.8563 1.1989 1.1989 1.3945 1.3945 1.4187 1.4187 1.5399 1.5399 1.7791 1.7791 1.8551 1.8551 1.9269 1.9269 2.2078 2.2078 2.2115 2.2115 2.2652 2.2652 2.5539 2.5539 2.6825 2.6825 2.7662 2.7662 2.8234 2.8234 2.9158 2.9158 2.9837 2.9837 3.0147 3.0147 3.0607 3.0607 3.2493 3.2493 3.7761 3.7761 3.8066 3.8066 3.9226 3.9226 5.3774 5.3774 5.9264 5.9264 8.7259 8.7259 11.3703 11.3703 11.4459 11.4459 11.5274 11.5274 11.6320 11.6320 11.7324 11.7324 13.5852 13.5852 k = 0.0000 0.0000 0.0975 ( 14583 PWs) bands (ev): -17.0087 -17.0087 -16.8502 -16.8502 -16.4030 -16.4030 -16.2816 -16.2816 -16.2634 -16.2634 -16.2516 -16.2516 -12.6924 -12.6924 -12.6663 -12.6663 -2.0942 -2.0942 -1.6313 -1.6313 -1.2020 -1.2020 -1.1416 -1.1416 -1.0767 -1.0767 -0.5059 -0.5059 -0.3510 -0.3510 -0.2069 -0.2069 -0.1636 -0.1636 0.8542 0.8542 1.1926 1.1926 1.3663 1.3663 1.4098 1.4098 1.5245 1.5245 1.7746 1.7746 1.8534 1.8534 1.9242 1.9242 2.1974 2.1974 2.2004 2.2004 2.2705 2.2705 2.5619 2.5619 2.6724 2.6724 2.7665 2.7665 2.8271 2.8271 2.9160 2.9160 2.9859 2.9859 3.0144 3.0144 3.0891 3.0891 3.2593 3.2593 3.7714 3.7714 3.8013 3.8013 3.9186 3.9186 5.3585 5.3585 5.9210 5.9210 8.7536 8.7536 11.3799 11.3799 11.4500 11.4500 11.5493 11.5493 11.6565 11.6565 11.7529 11.7529 13.6061 13.6061 k = 0.0000 0.0000 0.1170 ( 14599 PWs) bands (ev): -17.0080 -17.0080 -16.8502 -16.8502 -16.4018 -16.4018 -16.2840 -16.2840 -16.2624 -16.2624 -16.2517 -16.2517 -12.6930 -12.6930 -12.6670 -12.6670 -2.0870 -2.0870 -1.6297 -1.6297 -1.2014 -1.2014 -1.1323 -1.1323 -1.0649 -1.0649 -0.5043 -0.5043 -0.3475 -0.3475 -0.2052 -0.2052 -0.1468 -0.1468 0.8516 0.8516 1.1848 1.1848 1.3317 1.3317 1.3990 1.3990 1.5099 1.5099 1.7690 1.7690 1.8504 1.8504 1.9205 1.9205 2.1836 2.1836 2.1911 2.1911 2.2760 2.2760 2.5706 2.5706 2.6625 2.6625 2.7665 2.7665 2.8260 2.8260 2.9140 2.9140 2.9906 2.9906 3.0142 3.0142 3.1231 3.1231 3.2725 3.2725 3.7658 3.7658 3.7948 3.7948 3.9139 3.9139 5.3351 5.3351 5.9151 5.9151 8.7872 8.7872 11.3897 11.3897 11.4544 11.4544 11.5783 11.5783 11.6866 11.6866 11.7776 11.7776 13.6313 13.6313 k = 0.0000 0.0000 0.1365 ( 14609 PWs) bands (ev): -17.0073 -17.0073 -16.8503 -16.8503 -16.4005 -16.4005 -16.2865 -16.2865 -16.2616 -16.2616 -16.2518 -16.2518 -12.6938 -12.6938 -12.6679 -12.6679 -2.0787 -2.0787 -1.6278 -1.6278 -1.2009 -1.2009 -1.1216 -1.1216 -1.0507 -1.0507 -0.5023 -0.5023 -0.3434 -0.3434 -0.2040 -0.2040 -0.1268 -0.1268 0.8486 0.8486 1.1756 1.1756 1.2921 1.2921 1.3863 1.3863 1.4961 1.4961 1.7623 1.7623 1.8462 1.8462 1.9160 1.9160 2.1687 2.1687 2.1823 2.1823 2.2816 2.2816 2.5794 2.5794 2.6526 2.6526 2.7664 2.7664 2.8214 2.8214 2.9094 2.9094 2.9970 2.9970 3.0146 3.0146 3.1600 3.1600 3.2905 3.2905 3.7593 3.7593 3.7872 3.7872 3.9083 3.9083 5.3069 5.3069 5.9090 5.9090 8.8265 8.8265 11.3978 11.3978 11.4613 11.4613 11.6138 11.6138 11.7220 11.7220 11.8063 11.8063 13.6608 13.6608 k = 0.0000 0.0000 0.1559 ( 14609 PWs) bands (ev): -17.0064 -17.0064 -16.8504 -16.8504 -16.3990 -16.3990 -16.2891 -16.2891 -16.2609 -16.2609 -16.2519 -16.2519 -12.6947 -12.6947 -12.6688 -12.6688 -2.0692 -2.0692 -1.6257 -1.6257 -1.2004 -1.2004 -1.1094 -1.1094 -1.0341 -1.0341 -0.5000 -0.5000 -0.3385 -0.3385 -0.2031 -0.2031 -0.1041 -0.1041 0.8450 0.8450 1.1649 1.1649 1.2494 1.2494 1.3716 1.3716 1.4827 1.4827 1.7544 1.7544 1.8407 1.8407 1.9106 1.9106 2.1534 2.1534 2.1737 2.1737 2.2869 2.2869 2.5876 2.5876 2.6427 2.6427 2.7662 2.7662 2.8145 2.8145 2.9027 2.9027 3.0031 3.0031 3.0169 3.0169 3.1959 3.1959 3.3152 3.3152 3.7519 3.7519 3.7785 3.7785 3.9021 3.9021 5.2739 5.2739 5.9028 5.9028 8.8715 8.8715 11.4026 11.4026 11.4727 11.4727 11.6555 11.6555 11.7627 11.7627 11.8387 11.8387 13.6943 13.6943 k = 0.0000 0.0000 0.1754 ( 14613 PWs) bands (ev): -17.0055 -17.0055 -16.8505 -16.8505 -16.3973 -16.3973 -16.2918 -16.2918 -16.2604 -16.2604 -16.2521 -16.2521 -12.6956 -12.6956 -12.6699 -12.6699 -2.0586 -2.0586 -1.6233 -1.6233 -1.2000 -1.2000 -1.0960 -1.0960 -1.0150 -1.0150 -0.4974 -0.4974 -0.3331 -0.3331 -0.2023 -0.2023 -0.0792 -0.0792 0.8409 0.8409 1.1523 1.1523 1.2054 1.2054 1.3550 1.3550 1.4694 1.4694 1.7453 1.7453 1.8341 1.8341 1.9044 1.9044 2.1379 2.1379 2.1655 2.1655 2.2919 2.2919 2.5940 2.5940 2.6334 2.6334 2.7659 2.7659 2.8066 2.8066 2.8945 2.8945 3.0058 3.0058 3.0240 3.0240 3.2273 3.2273 3.3485 3.3485 3.7437 3.7437 3.7687 3.7687 3.8952 3.8952 5.2362 5.2362 5.8969 5.8969 8.9219 8.9219 11.4038 11.4038 11.4890 11.4890 11.7030 11.7030 11.8086 11.8086 11.8747 11.8747 13.7318 13.7318 k = 0.0000 0.0000 0.1949 ( 14617 PWs) bands (ev): -17.0044 -17.0044 -16.8506 -16.8506 -16.3954 -16.3954 -16.2945 -16.2945 -16.2600 -16.2600 -16.2522 -16.2522 -12.6967 -12.6967 -12.6710 -12.6710 -2.0470 -2.0470 -1.6207 -1.6207 -1.1998 -1.1998 -1.0813 -1.0813 -0.9934 -0.9934 -0.4945 -0.4945 -0.3269 -0.3269 -0.2016 -0.2016 -0.0526 -0.0526 0.8363 0.8363 1.1363 1.1363 1.1632 1.1632 1.3365 1.3365 1.4558 1.4558 1.7349 1.7349 1.8266 1.8266 1.8977 1.8977 2.1224 2.1224 2.1580 2.1580 2.2963 2.2963 2.5963 2.5963 2.6264 2.6264 2.7656 2.7656 2.7982 2.7982 2.8852 2.8852 3.0060 3.0060 3.0347 3.0347 3.2532 3.2532 3.3900 3.3900 3.7348 3.7348 3.7580 3.7580 3.8877 3.8877 5.1938 5.1938 5.8914 5.8914 8.9775 8.9775 11.4023 11.4023 11.5093 11.5093 11.7560 11.7560 11.8596 11.8596 11.9137 11.9137 13.7731 13.7731 k = 0.0000 0.0000 0.2144 ( 14607 PWs) bands (ev): -17.0033 -17.0033 -16.8508 -16.8508 -16.3933 -16.3933 -16.2972 -16.2972 -16.2598 -16.2598 -16.2524 -16.2524 -12.6978 -12.6978 -12.6723 -12.6723 -2.0346 -2.0346 -1.6179 -1.6179 -1.1996 -1.1996 -1.0654 -1.0654 -0.9694 -0.9694 -0.4913 -0.4913 -0.3203 -0.3203 -0.2009 -0.2009 -0.0249 -0.0249 0.8312 0.8312 1.1082 1.1082 1.1329 1.1329 1.3162 1.3162 1.4420 1.4420 1.7232 1.7232 1.8183 1.8183 1.8907 1.8907 2.1068 2.1068 2.1510 2.1510 2.3002 2.3002 2.5916 2.5916 2.6244 2.6244 2.7652 2.7652 2.7902 2.7902 2.8754 2.8754 3.0052 3.0052 3.0473 3.0473 3.2750 3.2750 3.4370 3.4370 3.7253 3.7253 3.7463 3.7463 3.8797 3.8797 5.1469 5.1469 5.8864 5.8864 9.0381 9.0381 11.3992 11.3992 11.5325 11.5325 11.8142 11.8142 11.9156 11.9156 11.9553 11.9553 13.8179 13.8179 k = 0.0000 0.0000 0.2339 ( 14591 PWs) bands (ev): -17.0022 -17.0022 -16.8509 -16.8509 -16.3910 -16.3910 -16.3000 -16.3000 -16.2598 -16.2598 -16.2526 -16.2526 -12.6990 -12.6990 -12.6736 -12.6736 -2.0212 -2.0212 -1.6149 -1.6149 -1.1995 -1.1995 -1.0484 -1.0484 -0.9430 -0.9430 -0.4879 -0.4879 -0.3130 -0.3130 -0.2002 -0.2002 0.0033 0.0033 0.8257 0.8257 1.0697 1.0697 1.1140 1.1140 1.2941 1.2941 1.4277 1.4277 1.7103 1.7103 1.8092 1.8092 1.8835 1.8835 2.0911 2.0911 2.1447 2.1447 2.3033 2.3033 2.5810 2.5810 2.6259 2.6259 2.7647 2.7647 2.7830 2.7830 2.8653 2.8653 3.0040 3.0040 3.0612 3.0612 3.2945 3.2945 3.4866 3.4866 3.7153 3.7153 3.7337 3.7337 3.8713 3.8713 5.0958 5.0958 5.8821 5.8821 9.1034 9.1034 11.3950 11.3950 11.5579 11.5579 11.8775 11.8775 11.9765 11.9765 11.9989 11.9989 13.8657 13.8657 k = 0.0000 0.0000 0.2534 ( 14621 PWs) bands (ev): -17.0010 -17.0010 -16.8510 -16.8510 -16.3886 -16.3886 -16.3028 -16.3028 -16.2599 -16.2599 -16.2528 -16.2528 -12.7003 -12.7003 -12.6750 -12.6750 -2.0072 -2.0072 -1.6118 -1.6118 -1.1995 -1.1995 -1.0304 -1.0304 -0.9143 -0.9143 -0.4843 -0.4843 -0.3053 -0.3053 -0.1996 -0.1996 0.0312 0.0312 0.8198 0.8198 1.0324 1.0324 1.0961 1.0961 1.2704 1.2704 1.4130 1.4130 1.6959 1.6959 1.7997 1.7997 1.8764 1.8764 2.0753 2.0753 2.1391 2.1391 2.3056 2.3056 2.5676 2.5676 2.6277 2.6277 2.7641 2.7641 2.7772 2.7772 2.8554 2.8554 3.0025 3.0025 3.0760 3.0760 3.3127 3.3127 3.5365 3.5365 3.7053 3.7053 3.7202 3.7202 3.8625 3.8625 5.0409 5.0409 5.8784 5.8784 9.1733 9.1733 11.3903 11.3903 11.5851 11.5851 11.9456 11.9456 12.0411 12.0411 12.0446 12.0446 13.8798 13.8798 k = 0.0000 0.0000 0.2729 ( 14641 PWs) bands (ev): -16.9997 -16.9997 -16.8512 -16.8512 -16.3860 -16.3860 -16.3057 -16.3057 -16.2602 -16.2602 -16.2530 -16.2530 -12.7016 -12.7016 -12.6764 -12.6764 -1.9925 -1.9925 -1.6085 -1.6085 -1.1995 -1.1995 -1.0114 -1.0114 -0.8833 -0.8833 -0.4805 -0.4805 -0.2972 -0.2972 -0.1990 -0.1990 0.0579 0.0579 0.8138 0.8138 0.9993 0.9993 1.0774 1.0774 1.2450 1.2450 1.3979 1.3979 1.6802 1.6802 1.7898 1.7898 1.8694 1.8694 2.0594 2.0594 2.1342 2.1342 2.3071 2.3071 2.5527 2.5527 2.6283 2.6283 2.7629 2.7629 2.7734 2.7734 2.8460 2.8460 3.0009 3.0009 3.0915 3.0915 3.3304 3.3304 3.5844 3.5844 3.6961 3.6961 3.7062 3.7062 3.8534 3.8534 4.9827 4.9827 5.8754 5.8754 9.2475 9.2475 11.3852 11.3852 11.6136 11.6136 12.0182 12.0182 12.0885 12.0885 12.1125 12.1125 13.8531 13.8531 k = 0.0000 0.0000 0.2924 ( 14627 PWs) bands (ev): -16.9984 -16.9984 -16.8513 -16.8513 -16.3833 -16.3833 -16.3085 -16.3085 -16.2607 -16.2607 -16.2532 -16.2532 -12.7029 -12.7029 -12.6779 -12.6779 -1.9773 -1.9773 -1.6051 -1.6051 -1.1997 -1.1997 -0.9915 -0.9915 -0.8502 -0.8502 -0.4766 -0.4766 -0.2887 -0.2887 -0.1985 -0.1985 0.0823 0.0823 0.8079 0.8079 0.9717 0.9717 1.0575 1.0575 1.2181 1.2181 1.3826 1.3826 1.6633 1.6633 1.7796 1.7796 1.8628 1.8628 2.0433 2.0433 2.1299 2.1299 2.3078 2.3078 2.5369 2.5369 2.6273 2.6273 2.7610 2.7610 2.7718 2.7718 2.8374 2.8374 2.9992 2.9992 3.1076 3.1076 3.3477 3.3477 3.6252 3.6252 3.6906 3.6906 3.6928 3.6928 3.8442 3.8442 4.9216 4.9216 5.8730 5.8730 9.3256 9.3256 11.3800 11.3800 11.6431 11.6431 12.0952 12.0952 12.1328 12.1328 12.1871 12.1871 13.8262 13.8262 k = 0.0000 0.0000 0.3119 ( 14633 PWs) bands (ev): -16.9970 -16.9970 -16.8515 -16.8515 -16.3804 -16.3804 -16.3113 -16.3113 -16.2613 -16.2613 -16.2535 -16.2535 -12.7043 -12.7043 -12.6794 -12.6794 -1.9616 -1.9616 -1.6016 -1.6016 -1.1999 -1.1999 -0.9707 -0.9707 -0.8150 -0.8150 -0.4728 -0.4728 -0.2799 -0.2799 -0.1980 -0.1980 0.1033 0.1033 0.8024 0.8024 0.9508 0.9508 1.0364 1.0364 1.1900 1.1900 1.3670 1.3670 1.6451 1.6451 1.7693 1.7693 1.8567 1.8567 2.0270 2.0270 2.1263 2.1263 2.3076 2.3076 2.5206 2.5206 2.6246 2.6246 2.7589 2.7589 2.7717 2.7717 2.8301 2.8301 2.9974 2.9974 3.1240 3.1240 3.3646 3.3646 3.6436 3.6436 3.6768 3.6768 3.7065 3.7065 3.8349 3.8349 4.8586 4.8586 5.8712 5.8712 9.4074 9.4074 11.3749 11.3749 11.6734 11.6734 12.1728 12.1728 12.1785 12.1785 12.2660 12.2660 13.7997 13.7997 k = 0.0000 0.0000 0.3314 ( 14623 PWs) bands (ev): -16.9957 -16.9957 -16.8516 -16.8516 -16.3774 -16.3774 -16.3140 -16.3140 -16.2621 -16.2621 -16.2537 -16.2537 -12.7057 -12.7057 -12.6810 -12.6810 -1.9456 -1.9456 -1.5980 -1.5980 -1.2001 -1.2001 -0.9493 -0.9493 -0.7778 -0.7778 -0.4690 -0.4690 -0.2710 -0.2710 -0.1976 -0.1976 0.1199 0.1199 0.7975 0.7975 0.9376 0.9376 1.0139 1.0139 1.1608 1.1608 1.3515 1.3515 1.6257 1.6257 1.7591 1.7591 1.8511 1.8511 2.0104 2.0104 2.1232 2.1232 2.3066 2.3066 2.5042 2.5042 2.6202 2.6202 2.7572 2.7572 2.7725 2.7725 2.8244 2.8244 2.9955 2.9955 3.1405 3.1405 3.3812 3.3812 3.6384 3.6384 3.6624 3.6624 3.7403 3.7403 3.8257 3.8257 4.7943 4.7943 5.8699 5.8699 9.4926 9.4926 11.3698 11.3698 11.7042 11.7042 12.2133 12.2133 12.2619 12.2619 12.3492 12.3492 13.7739 13.7739 k = 0.0000 0.0000 0.3509 ( 14627 PWs) bands (ev): -16.9944 -16.9944 -16.8518 -16.8518 -16.3742 -16.3742 -16.3167 -16.3167 -16.2631 -16.2631 -16.2539 -16.2539 -12.7071 -12.7071 -12.6825 -12.6825 -1.9295 -1.9295 -1.5945 -1.5945 -1.2004 -1.2004 -0.9272 -0.9272 -0.7387 -0.7387 -0.4652 -0.4652 -0.2619 -0.2619 -0.1973 -0.1973 0.1315 0.1315 0.7929 0.7929 0.9333 0.9333 0.9899 0.9899 1.1310 1.1310 1.3359 1.3359 1.6055 1.6055 1.7490 1.7490 1.8459 1.8459 1.9937 1.9937 2.1207 2.1207 2.3048 2.3048 2.4877 2.4877 2.6143 2.6143 2.7560 2.7560 2.7735 2.7735 2.8209 2.8209 2.9936 2.9936 3.1569 3.1569 3.3974 3.3974 3.6255 3.6255 3.6487 3.6487 3.7759 3.7759 3.8171 3.8171 4.7299 4.7299 5.8690 5.8690 9.5810 9.5810 11.3648 11.3648 11.7352 11.7352 12.2472 12.2472 12.3506 12.3506 12.4364 12.4364 13.7492 13.7492 k = 0.0000 0.0000 0.3704 ( 14639 PWs) bands (ev): -16.9930 -16.9930 -16.8520 -16.8520 -16.3710 -16.3710 -16.3193 -16.3193 -16.2642 -16.2642 -16.2541 -16.2541 -12.7085 -12.7085 -12.6840 -12.6840 -1.9132 -1.9132 -1.5909 -1.5909 -1.2008 -1.2008 -0.9047 -0.9047 -0.6979 -0.6979 -0.4617 -0.4617 -0.2529 -0.2529 -0.1971 -0.1971 0.1378 0.1378 0.7881 0.7881 0.9385 0.9385 0.9642 0.9642 1.1009 1.1009 1.3206 1.3206 1.5844 1.5844 1.7391 1.7391 1.8414 1.8414 1.9769 1.9769 2.1187 2.1187 2.3023 2.3023 2.4716 2.4716 2.6070 2.6070 2.7553 2.7553 2.7743 2.7743 2.8198 2.8198 2.9916 2.9916 3.1730 3.1730 3.4129 3.4129 3.6095 3.6095 3.6358 3.6358 3.8004 3.8004 3.8162 3.8162 4.6665 4.6665 5.8686 5.8686 9.6720 9.6720 11.3601 11.3601 11.7661 11.7661 12.2747 12.2747 12.4427 12.4427 12.5274 12.5274 13.7257 13.7257 k = 0.0000 0.0000 0.3899 ( 14653 PWs) bands (ev): -16.9917 -16.9917 -16.8521 -16.8521 -16.3677 -16.3677 -16.3218 -16.3218 -16.2656 -16.2656 -16.2544 -16.2544 -12.7099 -12.7099 -12.6855 -12.6855 -1.8970 -1.8970 -1.5874 -1.5874 -1.2011 -1.2011 -0.8819 -0.8819 -0.6555 -0.6555 -0.4584 -0.4584 -0.2440 -0.2440 -0.1971 -0.1971 0.1390 0.1390 0.7824 0.7824 0.9365 0.9365 0.9534 0.9534 1.0716 1.0716 1.3056 1.3056 1.5628 1.5628 1.7296 1.7296 1.8373 1.8373 1.9600 1.9600 2.1172 2.1172 2.2992 2.2992 2.4559 2.4559 2.5986 2.5986 2.7550 2.7550 2.7748 2.7748 2.8211 2.8211 2.9895 2.9895 3.1885 3.1885 3.4275 3.4275 3.5920 3.5920 3.6238 3.6238 3.7959 3.7959 3.8389 3.8389 4.6059 4.6059 5.8685 5.8685 9.7656 9.7656 11.3556 11.3556 11.7968 11.7968 12.2945 12.2945 12.5379 12.5379 12.6222 12.6222 13.7038 13.7038 k = 0.0000 0.0000 0.4094 ( 14647 PWs) bands (ev): -16.9904 -16.9904 -16.8523 -16.8523 -16.3643 -16.3643 -16.3242 -16.3242 -16.2670 -16.2670 -16.2546 -16.2546 -12.7112 -12.7112 -12.6870 -12.6870 -1.8811 -1.8811 -1.5839 -1.5839 -1.2015 -1.2015 -0.8589 -0.8589 -0.6116 -0.6116 -0.4555 -0.4555 -0.2355 -0.2355 -0.1972 -0.1972 0.1360 0.1360 0.7758 0.7758 0.9069 0.9069 0.9749 0.9749 1.0454 1.0454 1.2911 1.2911 1.5408 1.5408 1.7206 1.7206 1.8338 1.8338 1.9432 1.9432 2.1160 2.1160 2.2955 2.2955 2.4408 2.4408 2.5894 2.5894 2.7551 2.7551 2.7752 2.7752 2.8247 2.8247 2.9875 2.9875 3.2033 3.2033 3.4411 3.4411 3.5734 3.5734 3.6128 3.6128 3.7876 3.7876 3.8581 3.8581 4.5498 4.5498 5.8687 5.8687 9.8612 9.8612 11.3513 11.3513 11.8268 11.8268 12.3055 12.3055 12.6357 12.6357 12.7205 12.7205 13.6836 13.6836 k = 0.0000 0.0000 0.4289 ( 14641 PWs) bands (ev): -16.9892 -16.9892 -16.8524 -16.8524 -16.3609 -16.3609 -16.3265 -16.3265 -16.2687 -16.2687 -16.2548 -16.2548 -12.7126 -12.7126 -12.6884 -12.6884 -1.8654 -1.8654 -1.5805 -1.5805 -1.2019 -1.2019 -0.8359 -0.8359 -0.5664 -0.5664 -0.4529 -0.4529 -0.2274 -0.2274 -0.1974 -0.1974 0.1297 0.1297 0.7684 0.7684 0.8750 0.8750 0.9880 0.9880 1.0368 1.0368 1.2771 1.2771 1.5187 1.5187 1.7121 1.7121 1.8307 1.8307 1.9266 1.9266 2.1152 2.1152 2.2914 2.2914 2.4266 2.4266 2.5795 2.5795 2.7552 2.7552 2.7759 2.7759 2.8300 2.8300 2.9854 2.9854 3.2170 3.2170 3.4531 3.4531 3.5541 3.5541 3.6029 3.6029 3.7794 3.7794 3.8686 3.8686 4.5005 4.5005 5.8692 5.8692 9.9585 9.9585 11.3474 11.3474 11.8560 11.8560 12.3070 12.3070 12.7357 12.7357 12.8222 12.8222 13.6486 13.6486 k = 0.0000 0.0000 0.4483 ( 14647 PWs) bands (ev): -16.9880 -16.9880 -16.8525 -16.8525 -16.3575 -16.3575 -16.3286 -16.3286 -16.2705 -16.2705 -16.2550 -16.2550 -12.7138 -12.7138 -12.6898 -12.6898 -1.8502 -1.8502 -1.5773 -1.5773 -1.2024 -1.2024 -0.8131 -0.8131 -0.5201 -0.5201 -0.4507 -0.4507 -0.2204 -0.2204 -0.1972 -0.1972 0.1213 0.1213 0.7605 0.7605 0.8407 0.8407 0.9720 0.9720 1.0650 1.0650 1.2638 1.2638 1.4968 1.4968 1.7041 1.7041 1.8281 1.8281 1.9102 1.9102 2.1148 2.1148 2.2870 2.2870 2.4133 2.4133 2.5692 2.5692 2.7553 2.7553 2.7772 2.7772 2.8366 2.8366 2.9834 2.9834 3.2295 3.2295 3.4632 3.4632 3.5345 3.5345 3.5945 3.5945 3.7714 3.7714 3.8686 3.8686 4.4600 4.4600 5.8699 5.8699 10.0571 10.0571 11.3437 11.3437 11.8838 11.8838 12.2987 12.2987 12.8371 12.8371 12.9270 12.9270 13.5784 13.5784 k = 0.0000 0.0000 0.4678 ( 14643 PWs) bands (ev): -16.9868 -16.9868 -16.8527 -16.8527 -16.3541 -16.3541 -16.3305 -16.3305 -16.2724 -16.2724 -16.2551 -16.2551 -12.7150 -12.7150 -12.6911 -12.6911 -1.8356 -1.8356 -1.5742 -1.5742 -1.2028 -1.2028 -0.7907 -0.7907 -0.4730 -0.4730 -0.4489 -0.4489 -0.2150 -0.2150 -0.1960 -0.1960 0.1119 0.1119 0.7523 0.7523 0.8042 0.8042 0.9483 0.9483 1.1074 1.1074 1.2514 1.2514 1.4753 1.4753 1.6968 1.6968 1.8259 1.8259 1.8944 1.8944 2.1146 2.1146 2.2824 2.2824 2.4010 2.4010 2.5588 2.5588 2.7551 2.7551 2.7793 2.7793 2.8442 2.8442 2.9814 2.9814 3.2404 3.2404 3.4705 3.4705 3.5152 3.5152 3.5879 3.5879 3.7638 3.7638 3.8576 3.8576 4.4297 4.4297 5.8706 5.8706 10.1566 10.1566 11.3404 11.3404 11.9099 11.9099 12.2810 12.2810 12.9390 12.9390 13.0348 13.0348 13.5134 13.5134 k = 0.0000 0.0000 0.4873 ( 14630 PWs) bands (ev): -16.9858 -16.9858 -16.8528 -16.8528 -16.3508 -16.3508 -16.3321 -16.3321 -16.2745 -16.2745 -16.2553 -16.2553 -12.7162 -12.7162 -12.6923 -12.6923 -1.8217 -1.8217 -1.5712 -1.5712 -1.2032 -1.2032 -0.7690 -0.7690 -0.4478 -0.4478 -0.4250 -0.4250 -0.2123 -0.2123 -0.1931 -0.1931 0.1023 0.1023 0.7430 0.7430 0.7667 0.7667 0.9246 0.9246 1.1549 1.1549 1.2399 1.2399 1.4547 1.4547 1.6901 1.6901 1.8240 1.8240 1.8791 1.8791 2.1147 2.1147 2.2777 2.2777 2.3899 2.3899 2.5485 2.5485 2.7547 2.7547 2.7822 2.7822 2.8524 2.8524 2.9794 2.9794 3.2493 3.2493 3.4731 3.4731 3.4980 3.4980 3.5834 3.5834 3.7567 3.7567 3.8364 3.8364 4.4096 4.4096 5.8715 5.8715 10.2564 10.2564 11.3374 11.3374 11.9337 11.9337 12.2545 12.2545 13.0397 13.0397 13.1453 13.1453 13.4542 13.4542 k = 0.0000 0.0000 0.5068 ( 14628 PWs) bands (ev): -16.9848 -16.9848 -16.8529 -16.8529 -16.3478 -16.3478 -16.3332 -16.3332 -16.2767 -16.2767 -16.2555 -16.2555 -12.7172 -12.7172 -12.6935 -12.6935 -1.8087 -1.8087 -1.5685 -1.5685 -1.2036 -1.2036 -0.7481 -0.7481 -0.4469 -0.4469 -0.3771 -0.3771 -0.2119 -0.2119 -0.1885 -0.1885 0.0932 0.0932 0.7207 0.7207 0.7407 0.7407 0.9022 0.9022 1.2043 1.2043 1.2294 1.2294 1.4355 1.4355 1.6842 1.6842 1.8224 1.8224 1.8647 1.8647 2.1150 2.1150 2.2730 2.2730 2.3800 2.3800 2.5384 2.5384 2.7540 2.7540 2.7858 2.7858 2.8609 2.8609 2.9774 2.9774 3.2558 3.2558 3.4652 3.4652 3.4888 3.4888 3.5812 3.5812 3.7500 3.7500 3.8074 3.8074 4.3985 4.3985 5.8725 5.8725 10.3559 10.3559 11.3347 11.3347 11.9541 11.9541 12.2211 12.2211 13.1363 13.1363 13.2574 13.2574 13.4014 13.4014 k = 0.0000 0.0000 0.5263 ( 14636 PWs) bands (ev): -16.9839 -16.9839 -16.8530 -16.8530 -16.3455 -16.3455 -16.3336 -16.3336 -16.2790 -16.2790 -16.2556 -16.2556 -12.7182 -12.7182 -12.6945 -12.6945 -1.7966 -1.7966 -1.5660 -1.5660 -1.2040 -1.2040 -0.7284 -0.7284 -0.4465 -0.4465 -0.3296 -0.3296 -0.2124 -0.2124 -0.1834 -0.1834 0.0849 0.0849 0.6809 0.6809 0.7314 0.7314 0.8814 0.8814 1.2197 1.2197 1.2539 1.2539 1.4182 1.4182 1.6789 1.6789 1.8210 1.8210 1.8512 1.8512 2.1155 2.1155 2.2684 2.2684 2.3712 2.3712 2.5289 2.5289 2.7531 2.7531 2.7897 2.7897 2.8697 2.8697 2.9754 2.9754 3.2593 3.2593 3.4490 3.4490 3.4862 3.4862 3.5809 3.5809 3.7434 3.7434 3.7743 3.7743 4.3944 4.3944 5.8734 5.8734 10.4546 10.4546 11.3324 11.3324 11.9694 11.9694 12.1833 12.1833 13.2243 13.2243 13.3420 13.3420 13.3843 13.3843 k = 0.0000 0.0000 0.5458 ( 14626 PWs) bands (ev): -16.9830 -16.9830 -16.8531 -16.8531 -16.3441 -16.3441 -16.3330 -16.3330 -16.2814 -16.2814 -16.2558 -16.2558 -12.7191 -12.7191 -12.6955 -12.6955 -1.7856 -1.7856 -1.5638 -1.5638 -1.2043 -1.2043 -0.7101 -0.7101 -0.4465 -0.4465 -0.2839 -0.2839 -0.2122 -0.2122 -0.1784 -0.1784 0.0778 0.0778 0.6389 0.6389 0.7243 0.7243 0.8625 0.8625 1.2115 1.2115 1.3000 1.3000 1.4049 1.4049 1.6742 1.6742 1.8197 1.8197 1.8391 1.8391 2.1161 2.1161 2.2640 2.2640 2.3638 2.3638 2.5201 2.5201 2.7521 2.7521 2.7938 2.7938 2.8783 2.8783 2.9735 2.9735 3.2591 3.2591 3.4320 3.4320 3.4841 3.4841 3.5817 3.5817 3.7320 3.7320 3.7457 3.7457 4.3949 4.3949 5.8743 5.8743 10.5514 10.5514 11.3304 11.3304 11.9759 11.9759 12.1461 12.1461 13.2919 13.2919 13.3122 13.3122 13.4943 13.4943 k = 0.0000 0.0000 0.5653 ( 14624 PWs) bands (ev): -16.9823 -16.9823 -16.8532 -16.8532 -16.3437 -16.3437 -16.3311 -16.3311 -16.2839 -16.2839 -16.2559 -16.2559 -12.7198 -12.7198 -12.6963 -12.6963 -1.7759 -1.7759 -1.5618 -1.5618 -1.2047 -1.2047 -0.6936 -0.6936 -0.4468 -0.4468 -0.2458 -0.2458 -0.2059 -0.2059 -0.1738 -0.1738 0.0718 0.0718 0.5969 0.5969 0.7181 0.7181 0.8456 0.8456 1.2043 1.2043 1.3351 1.3351 1.4021 1.4021 1.6703 1.6703 1.8178 1.8178 1.8289 1.8289 2.1168 2.1168 2.2600 2.2600 2.3576 2.3576 2.5120 2.5120 2.7510 2.7510 2.7979 2.7979 2.8867 2.8867 2.9716 2.9716 3.2547 3.2547 3.4169 3.4169 3.4814 3.4814 3.5828 3.5828 3.7035 3.7035 3.7368 3.7368 4.3981 4.3981 5.8752 5.8752 10.6452 10.6452 11.3288 11.3288 11.9667 11.9667 12.1177 12.1177 13.2685 13.2685 13.3514 13.3514 13.6124 13.6124 k = 0.0000 0.0000 0.5848 ( 14640 PWs) bands (ev): -16.9817 -16.9817 -16.8533 -16.8533 -16.3439 -16.3439 -16.3287 -16.3287 -16.2864 -16.2864 -16.2560 -16.2560 -12.7205 -12.7205 -12.6970 -12.6970 -1.7674 -1.7674 -1.5601 -1.5601 -1.2049 -1.2049 -0.6789 -0.6789 -0.4473 -0.4473 -0.2309 -0.2309 -0.1791 -0.1791 -0.1689 -0.1689 0.0670 0.0670 0.5559 0.5559 0.7127 0.7127 0.8309 0.8309 1.1983 1.1983 1.3458 1.3458 1.4219 1.4219 1.6670 1.6670 1.8136 1.8136 1.8227 1.8227 2.1175 2.1175 2.2564 2.2564 2.3526 2.3526 2.5050 2.5050 2.7499 2.7499 2.8017 2.8017 2.8946 2.8946 2.9697 2.9697 3.2461 3.2461 3.4048 3.4048 3.4785 3.4785 3.5830 3.5830 3.6759 3.6759 3.7323 3.7323 4.4027 4.4027 5.8760 5.8760 10.7346 10.7346 11.3276 11.3276 11.9375 11.9375 12.1045 12.1045 13.2378 13.2378 13.3828 13.3828 13.7316 13.7316 k = 0.0000 0.0000 0.6043 ( 14630 PWs) bands (ev): -16.9812 -16.9812 -16.8533 -16.8533 -16.3444 -16.3444 -16.3260 -16.3260 -16.2888 -16.2888 -16.2561 -16.2561 -12.7210 -12.7210 -12.6976 -12.6976 -1.7604 -1.7604 -1.5587 -1.5587 -1.2052 -1.2052 -0.6665 -0.6665 -0.4480 -0.4480 -0.2291 -0.2291 -0.1673 -0.1673 -0.1395 -0.1395 0.0632 0.0632 0.5173 0.5173 0.7083 0.7083 0.8186 0.8186 1.1935 1.1935 1.3414 1.3414 1.4537 1.4537 1.6642 1.6642 1.8070 1.8070 1.8206 1.8206 2.1181 2.1181 2.2532 2.2532 2.3487 2.3487 2.4991 2.4991 2.7488 2.7488 2.8051 2.8051 2.9017 2.9017 2.9679 2.9679 3.2345 3.2345 3.3959 3.3959 3.4756 3.4756 3.5813 3.5813 3.6546 3.6546 3.7290 3.7290 4.4075 4.4075 5.8767 5.8767 10.8172 10.8172 11.3268 11.3268 11.8944 11.8944 12.1027 12.1027 13.2123 13.2123 13.4001 13.4001 13.8506 13.8506 k = 0.0000 0.0000 0.6238 ( 14628 PWs) bands (ev): -16.9808 -16.9808 -16.8534 -16.8534 -16.3448 -16.3448 -16.3235 -16.3235 -16.2910 -16.2910 -16.2561 -16.2561 -12.7215 -12.7215 -12.6981 -12.6981 -1.7548 -1.7548 -1.5575 -1.5575 -1.2054 -1.2054 -0.6566 -0.6566 -0.4486 -0.4486 -0.2297 -0.2297 -0.1645 -0.1645 -0.1039 -0.1039 0.0603 0.0603 0.4829 0.4829 0.7048 0.7048 0.8087 0.8087 1.1898 1.1898 1.3346 1.3346 1.4836 1.4836 1.6620 1.6620 1.8009 1.8009 1.8197 1.8197 2.1187 2.1187 2.2507 2.2507 2.3459 2.3459 2.4944 2.4944 2.7479 2.7479 2.8079 2.8079 2.9078 2.9078 2.9662 2.9662 3.2218 3.2218 3.3900 3.3900 3.4731 3.4731 3.5774 3.5774 3.6407 3.6407 3.7265 3.7265 4.4118 4.4118 5.8772 5.8772 10.8898 10.8898 11.3266 11.3266 11.8476 11.8476 12.1056 12.1056 13.1924 13.1924 13.4091 13.4091 13.9677 13.9677 k = 0.0000 0.0000 0.6433 ( 14638 PWs) bands (ev): -16.9805 -16.9805 -16.8534 -16.8534 -16.3452 -16.3452 -16.3214 -16.3214 -16.2928 -16.2928 -16.2562 -16.2562 -12.7218 -12.7218 -12.6984 -12.6984 -1.7508 -1.7508 -1.5568 -1.5568 -1.2055 -1.2055 -0.6494 -0.6494 -0.4491 -0.4491 -0.2305 -0.2305 -0.1627 -0.1627 -0.0747 -0.0747 0.0582 0.0582 0.4550 0.4550 0.7023 0.7023 0.8015 0.8015 1.1872 1.1872 1.3289 1.3289 1.5070 1.5070 1.6604 1.6604 1.7963 1.7963 1.8192 1.8192 2.1192 2.1192 2.2489 2.2489 2.3440 2.3440 2.4910 2.4910 2.7471 2.7471 2.8100 2.8100 2.9126 2.9126 2.9648 2.9648 3.2104 3.2104 3.3863 3.3863 3.4712 3.4712 3.5722 3.5722 3.6332 3.6332 3.7248 3.7248 4.4152 4.4152 5.8776 5.8776 10.9482 10.9482 11.3267 11.3267 11.8058 11.8058 12.1091 12.1091 13.1782 13.1782 13.4135 13.4135 14.0793 14.0793 k = 0.0000 0.0000 0.6628 ( 14632 PWs) bands (ev): -16.9803 -16.9803 -16.8534 -16.8534 -16.3454 -16.3454 -16.3199 -16.3199 -16.2941 -16.2941 -16.2562 -16.2562 -12.7220 -12.7220 -12.6986 -12.6986 -1.7483 -1.7483 -1.5563 -1.5563 -1.2056 -1.2056 -0.6450 -0.6450 -0.4495 -0.4495 -0.2310 -0.2310 -0.1615 -0.1615 -0.0552 -0.0552 0.0568 0.0568 0.4365 0.4365 0.7008 0.7008 0.7972 0.7972 1.1856 1.1856 1.3252 1.3252 1.5217 1.5217 1.6594 1.6594 1.7935 1.7935 1.8190 1.8190 2.1194 2.1194 2.2477 2.2477 2.3430 2.3430 2.4889 2.4889 2.7465 2.7465 2.8113 2.8113 2.9156 2.9156 2.9638 2.9638 3.2026 3.2026 3.3844 3.3844 3.4699 3.4699 3.5681 3.5681 3.6298 3.6298 3.7237 3.7237 4.4174 4.4174 5.8779 5.8779 10.9867 10.9867 11.3271 11.3271 11.7764 11.7764 12.1117 12.1117 13.1696 13.1696 13.4156 13.4156 14.1776 14.1776 k = 0.0000 0.0000 0.6823 ( 14632 PWs) bands (ev): -16.9802 -16.9802 -16.8534 -16.8534 -16.3455 -16.3455 -16.3194 -16.3194 -16.2946 -16.2946 -16.2562 -16.2562 -12.7220 -12.7220 -12.6987 -12.6987 -1.7475 -1.7475 -1.5561 -1.5561 -1.2056 -1.2056 -0.6435 -0.6435 -0.4496 -0.4496 -0.2313 -0.2313 -0.1612 -0.1612 -0.0483 -0.0483 0.0563 0.0563 0.4300 0.4300 0.7003 0.7003 0.7957 0.7957 1.1851 1.1851 1.3240 1.3240 1.5268 1.5268 1.6590 1.6590 1.7925 1.7925 1.8189 1.8189 2.1195 2.1195 2.2473 2.2473 2.3427 2.3427 2.4882 2.4882 2.7464 2.7464 2.8117 2.8117 2.9167 2.9167 2.9634 2.9634 3.1999 3.1999 3.3838 3.3838 3.4695 3.4695 3.5666 3.5666 3.6289 3.6289 3.7234 3.7234 4.4181 4.4181 5.8780 5.8780 11.0003 11.0003 11.3273 11.3273 11.7658 11.7658 12.1127 12.1127 13.1668 13.1668 13.4161 13.4161 14.2399 14.2405 k = 0.0000 0.0000 0.6823 ( 14632 PWs) bands (ev): -16.9802 -16.9802 -16.8534 -16.8534 -16.3455 -16.3455 -16.3194 -16.3194 -16.2946 -16.2946 -16.2562 -16.2562 -12.7220 -12.7220 -12.6987 -12.6987 -1.7475 -1.7475 -1.5561 -1.5561 -1.2056 -1.2056 -0.6435 -0.6435 -0.4496 -0.4496 -0.2313 -0.2313 -0.1612 -0.1612 -0.0483 -0.0483 0.0563 0.0563 0.4300 0.4300 0.7003 0.7003 0.7957 0.7957 1.1851 1.1851 1.3240 1.3240 1.5268 1.5268 1.6590 1.6590 1.7925 1.7925 1.8189 1.8189 2.1195 2.1195 2.2473 2.2473 2.3427 2.3427 2.4882 2.4882 2.7464 2.7464 2.8117 2.8117 2.9167 2.9167 2.9634 2.9634 3.1999 3.1999 3.3838 3.3838 3.4695 3.4695 3.5666 3.5666 3.6289 3.6289 3.7234 3.7234 4.4181 4.4181 5.8780 5.8780 11.0003 11.0003 11.3273 11.3273 11.7658 11.7658 12.1127 12.1127 13.1668 13.1668 13.4161 13.4161 14.2399 14.2399 k =-0.0145 0.0135 0.6823 ( 14624 PWs) bands (ev): -16.9802 -16.9802 -16.8535 -16.8535 -16.3457 -16.3457 -16.3193 -16.3193 -16.2946 -16.2946 -16.2562 -16.2562 -12.7221 -12.7221 -12.6987 -12.6987 -1.7473 -1.7473 -1.5563 -1.5563 -1.2056 -1.2056 -0.6429 -0.6429 -0.4496 -0.4496 -0.2301 -0.2301 -0.1612 -0.1612 -0.0491 -0.0491 0.0561 0.0561 0.4311 0.4311 0.7004 0.7004 0.7968 0.7968 1.1828 1.1828 1.3241 1.3241 1.5272 1.5272 1.6559 1.6559 1.7842 1.7842 1.8282 1.8282 2.1167 2.1167 2.2436 2.2436 2.3446 2.3446 2.4903 2.4903 2.7505 2.7505 2.8108 2.8108 2.9155 2.9155 2.9652 2.9652 3.2006 3.2006 3.3835 3.3835 3.4693 3.4693 3.5665 3.5665 3.6289 3.6289 3.7231 3.7231 4.4190 4.4190 5.8762 5.8762 11.0005 11.0005 11.3277 11.3277 11.7683 11.7683 12.1149 12.1149 13.1637 13.1637 13.4160 13.4160 14.2395 14.2396 k =-0.0290 0.0269 0.6823 ( 14616 PWs) bands (ev): -16.9801 -16.9801 -16.8535 -16.8535 -16.3462 -16.3462 -16.3192 -16.3192 -16.2945 -16.2945 -16.2560 -16.2560 -12.7222 -12.7222 -12.6988 -12.6988 -1.7465 -1.7465 -1.5567 -1.5567 -1.2056 -1.2056 -0.6411 -0.6411 -0.4496 -0.4496 -0.2268 -0.2268 -0.1611 -0.1611 -0.0513 -0.0513 0.0555 0.0555 0.4342 0.4342 0.7008 0.7008 0.8001 0.8001 1.1758 1.1758 1.3245 1.3245 1.5282 1.5282 1.6467 1.6467 1.7706 1.7706 1.8444 1.8444 2.1086 2.1086 2.2331 2.2331 2.3503 2.3503 2.4964 2.4964 2.7618 2.7618 2.8082 2.8082 2.9119 2.9119 2.9703 2.9703 3.2028 3.2028 3.3826 3.3826 3.4686 3.4686 3.5663 3.5663 3.6291 3.6291 3.7222 3.7222 4.4215 4.4215 5.8707 5.8707 11.0013 11.0013 11.3289 11.3289 11.7757 11.7757 12.1217 12.1217 13.1545 13.1545 13.4156 13.4156 14.2385 14.2385 k =-0.0435 0.0404 0.6823 ( 14616 PWs) bands (ev): -16.9799 -16.9799 -16.8536 -16.8536 -16.3470 -16.3470 -16.3188 -16.3188 -16.2943 -16.2943 -16.2557 -16.2557 -12.7223 -12.7223 -12.6988 -12.6988 -1.7453 -1.7453 -1.5575 -1.5575 -1.2055 -1.2055 -0.6381 -0.6381 -0.4497 -0.4497 -0.2214 -0.2214 -0.1610 -0.1610 -0.0548 -0.0548 0.0545 0.0545 0.4394 0.4394 0.7015 0.7015 0.8054 0.8054 1.1642 1.1642 1.3252 1.3252 1.5299 1.5299 1.6319 1.6319 1.7578 1.7578 1.8615 1.8615 2.0964 2.0964 2.2171 2.2171 2.3594 2.3594 2.5060 2.5060 2.7769 2.7769 2.8048 2.8048 2.9064 2.9064 2.9789 2.9789 3.2066 3.2066 3.3812 3.3812 3.4675 3.4675 3.5659 3.5659 3.6293 3.6293 3.7208 3.7208 4.4257 4.4257 5.8618 5.8618 11.0026 11.0026 11.3309 11.3309 11.7880 11.7880 12.1331 12.1331 13.1395 13.1395 13.4151 13.4151 14.2363 14.2363 k =-0.0580 0.0539 0.6823 ( 14620 PWs) bands (ev): -16.9797 -16.9797 -16.8537 -16.8537 -16.3481 -16.3481 -16.3184 -16.3184 -16.2940 -16.2940 -16.2552 -16.2552 -12.7225 -12.7225 -12.6990 -12.6990 -1.7436 -1.7436 -1.5586 -1.5586 -1.2054 -1.2054 -0.6339 -0.6339 -0.4499 -0.4499 -0.2141 -0.2141 -0.1608 -0.1608 -0.0595 -0.0595 0.0532 0.0532 0.4467 0.4467 0.7025 0.7025 0.8128 0.8128 1.1481 1.1481 1.3262 1.3262 1.5318 1.5318 1.6129 1.6129 1.7462 1.7462 1.8779 1.8779 2.0817 2.0817 2.1978 2.1978 2.3716 2.3716 2.5181 2.5181 2.7869 2.7869 2.8065 2.8065 2.8995 2.8995 2.9909 2.9909 3.2122 3.2122 3.3791 3.3791 3.4660 3.4660 3.5654 3.5654 3.6297 3.6297 3.7189 3.7189 4.4315 4.4315 5.8495 5.8495 11.0044 11.0044 11.3337 11.3337 11.8048 11.8048 12.1493 12.1493 13.1192 13.1192 13.4145 13.4145 14.2320 14.2320 k =-0.0725 0.0673 0.6823 ( 14624 PWs) bands (ev): -16.9794 -16.9794 -16.8539 -16.8539 -16.3496 -16.3496 -16.3178 -16.3178 -16.2937 -16.2937 -16.2547 -16.2547 -12.7228 -12.7228 -12.6991 -12.6991 -1.7414 -1.7414 -1.5600 -1.5600 -1.2052 -1.2052 -0.6286 -0.6286 -0.4501 -0.4501 -0.2053 -0.2053 -0.1605 -0.1605 -0.0650 -0.0650 0.0518 0.0518 0.4560 0.4560 0.7037 0.7037 0.8219 0.8219 1.1277 1.1277 1.3273 1.3273 1.5328 1.5328 1.5917 1.5917 1.7355 1.7355 1.8928 1.8928 2.0661 2.0661 2.1771 2.1771 2.3861 2.3861 2.5316 2.5316 2.7825 2.7825 2.8198 2.8198 2.8916 2.8916 3.0059 3.0059 3.2199 3.2199 3.3765 3.3765 3.4641 3.4641 3.5648 3.5648 3.6302 3.6302 3.7166 3.7166 4.4389 4.4389 5.8340 5.8340 11.0066 11.0066 11.3372 11.3372 11.8258 11.8258 12.1707 12.1707 13.0939 13.0939 13.4140 13.4140 14.2229 14.2229 k =-0.0870 0.0808 0.6823 ( 14628 PWs) bands (ev): -16.9791 -16.9791 -16.8541 -16.8541 -16.3513 -16.3513 -16.3171 -16.3171 -16.2933 -16.2933 -16.2541 -16.2541 -12.7231 -12.7231 -12.6993 -12.6993 -1.7388 -1.7388 -1.5618 -1.5618 -1.2050 -1.2050 -0.6222 -0.6222 -0.4505 -0.4505 -0.1957 -0.1957 -0.1600 -0.1600 -0.0709 -0.0709 0.0505 0.0505 0.4672 0.4672 0.7052 0.7052 0.8328 0.8328 1.1035 1.1035 1.3287 1.3287 1.5289 1.5289 1.5735 1.5735 1.7254 1.7254 1.9054 1.9054 2.0512 2.0512 2.1566 2.1566 2.4026 2.4026 2.5453 2.5453 2.7726 2.7726 2.8330 2.8330 2.8844 2.8844 3.0230 3.0230 3.2300 3.2300 3.3732 3.3732 3.4619 3.4619 3.5641 3.5641 3.6310 3.6310 3.7140 3.7140 4.4479 4.4479 5.8155 5.8155 11.0093 11.0093 11.3413 11.3413 11.8504 11.8504 12.1975 12.1975 13.0643 13.0643 13.4136 13.4136 14.2061 14.2061 k =-0.1015 0.0942 0.6823 ( 14630 PWs) bands (ev): -16.9787 -16.9787 -16.8543 -16.8543 -16.3533 -16.3533 -16.3162 -16.3162 -16.2928 -16.2928 -16.2535 -16.2535 -12.7234 -12.7234 -12.6995 -12.6995 -1.7358 -1.7358 -1.5637 -1.5637 -1.2047 -1.2047 -0.6147 -0.6147 -0.4511 -0.4511 -0.1863 -0.1863 -0.1589 -0.1589 -0.0766 -0.0766 0.0495 0.0495 0.4803 0.4803 0.7070 0.7070 0.8451 0.8451 1.0759 1.0759 1.3302 1.3302 1.5127 1.5127 1.5663 1.5663 1.7154 1.7154 1.9140 1.9140 2.0391 2.0391 2.1379 2.1379 2.4205 2.4205 2.5582 2.5582 2.7604 2.7604 2.8392 2.8392 2.8816 2.8816 3.0407 3.0407 3.2429 3.2429 3.3693 3.3693 3.4596 3.4596 3.5633 3.5633 3.6321 3.6321 3.7114 3.7114 4.4583 4.4583 5.7945 5.7945 11.0123 11.0123 11.3461 11.3461 11.8781 11.8781 12.2302 12.2302 13.0309 13.0309 13.4138 13.4138 14.1819 14.1820 k =-0.1160 0.1077 0.6823 ( 14626 PWs) bands (ev): -16.9782 -16.9782 -16.8546 -16.8546 -16.3556 -16.3556 -16.3151 -16.3151 -16.2923 -16.2923 -16.2529 -16.2529 -12.7238 -12.7238 -12.6997 -12.6997 -1.7324 -1.7324 -1.5660 -1.5660 -1.2043 -1.2043 -0.6063 -0.6063 -0.4519 -0.4519 -0.1788 -0.1788 -0.1570 -0.1570 -0.0812 -0.0812 0.0492 0.0492 0.4952 0.4952 0.7091 0.7091 0.8585 0.8585 1.0457 1.0457 1.3318 1.3318 1.4867 1.4867 1.5686 1.5686 1.7053 1.7053 1.9165 1.9165 2.0322 2.0322 2.1220 2.1220 2.4391 2.4391 2.5695 2.5695 2.7463 2.7463 2.8349 2.8349 2.8867 2.8867 3.0572 3.0572 3.2583 3.2583 3.3649 3.3649 3.4570 3.4570 3.5624 3.5624 3.6333 3.6333 3.7090 3.7090 4.4699 4.4699 5.7712 5.7712 11.0156 11.0156 11.3514 11.3514 11.9083 11.9083 12.2692 12.2692 12.9943 12.9943 13.4146 13.4146 14.1510 14.1510 k =-0.1305 0.1212 0.6823 ( 14616 PWs) bands (ev): -16.9777 -16.9777 -16.8549 -16.8549 -16.3581 -16.3581 -16.3139 -16.3139 -16.2918 -16.2918 -16.2522 -16.2522 -12.7243 -12.7243 -12.6999 -12.6999 -1.7287 -1.7287 -1.5685 -1.5685 -1.2039 -1.2039 -0.5971 -0.5971 -0.4529 -0.4529 -0.1744 -0.1744 -0.1546 -0.1546 -0.0835 -0.0835 0.0499 0.0499 0.5119 0.5119 0.7115 0.7115 0.8730 0.8730 1.0139 1.0139 1.3334 1.3334 1.4567 1.4567 1.5748 1.5748 1.6950 1.6950 1.9114 1.9114 2.0322 2.0322 2.1096 2.1096 2.4579 2.4579 2.5784 2.5784 2.7305 2.7305 2.8235 2.8235 2.8971 2.8971 3.0715 3.0715 3.2758 3.2758 3.3600 3.3600 3.4545 3.4545 3.5616 3.5616 3.6346 3.6346 3.7070 3.7070 4.4826 4.4826 5.7462 5.7462 11.0192 11.0192 11.3571 11.3571 11.9404 11.9404 12.3147 12.3147 12.9550 12.9550 13.4163 13.4163 14.0851 14.0851 k =-0.1450 0.1346 0.6823 ( 14612 PWs) bands (ev): -16.9771 -16.9771 -16.8552 -16.8552 -16.3607 -16.3607 -16.3126 -16.3126 -16.2911 -16.2911 -16.2515 -16.2515 -12.7248 -12.7248 -12.7002 -12.7002 -1.7247 -1.7247 -1.5713 -1.5713 -1.2034 -1.2034 -0.5871 -0.5871 -0.4540 -0.4540 -0.1730 -0.1730 -0.1535 -0.1535 -0.0822 -0.0822 0.0519 0.0519 0.5302 0.5302 0.7142 0.7142 0.8878 0.8878 0.9818 0.9818 1.3349 1.3349 1.4252 1.4252 1.5832 1.5832 1.6845 1.6845 1.8991 1.8991 2.0386 2.0386 2.1010 2.1010 2.4765 2.4765 2.5847 2.5847 2.7131 2.7131 2.8086 2.8086 2.9096 2.9096 3.0831 3.0831 3.2942 3.2942 3.3547 3.3547 3.4519 3.4519 3.5609 3.5609 3.6357 3.6357 3.7057 3.7057 4.4958 4.4958 5.7201 5.7201 11.0229 11.0229 11.3632 11.3632 11.9740 11.9740 12.3671 12.3671 12.9135 12.9135 13.4191 13.4191 13.9895 13.9895 k =-0.1595 0.1481 0.6823 ( 14618 PWs) bands (ev): -16.9765 -16.9765 -16.8555 -16.8555 -16.3635 -16.3635 -16.3111 -16.3111 -16.2905 -16.2905 -16.2509 -16.2509 -12.7253 -12.7253 -12.7005 -12.7005 -1.7205 -1.7205 -1.5743 -1.5743 -1.2028 -1.2028 -0.5765 -0.5765 -0.4553 -0.4553 -0.1737 -0.1737 -0.1551 -0.1551 -0.0775 -0.0775 0.0555 0.0555 0.5500 0.5500 0.7171 0.7171 0.9019 0.9019 0.9517 0.9517 1.3358 1.3358 1.3936 1.3936 1.5929 1.5929 1.6737 1.6737 1.8819 1.8819 2.0494 2.0494 2.0961 2.0961 2.4942 2.4942 2.5881 2.5881 2.6945 2.6945 2.7915 2.7915 2.9233 2.9233 3.0920 3.0920 3.3119 3.3119 3.3496 3.3496 3.4496 3.4496 3.5602 3.5602 3.6365 3.6365 3.7056 3.7056 4.5092 4.5092 5.6935 5.6935 11.0268 11.0268 11.3695 11.3695 12.0086 12.0086 12.4263 12.4263 12.8701 12.8701 13.4233 13.4233 13.8872 13.8872 k =-0.1740 0.1616 0.6823 ( 14620 PWs) bands (ev): -16.9759 -16.9759 -16.8559 -16.8559 -16.3664 -16.3664 -16.3095 -16.3095 -16.2898 -16.2898 -16.2503 -16.2503 -12.7259 -12.7259 -12.7008 -12.7008 -1.7161 -1.7161 -1.5775 -1.5775 -1.2021 -1.2021 -0.5655 -0.5655 -0.4566 -0.4566 -0.1761 -0.1761 -0.1588 -0.1588 -0.0706 -0.0706 0.0606 0.0606 0.5712 0.5712 0.7204 0.7204 0.9056 0.9056 0.9345 0.9345 1.3337 1.3337 1.3646 1.3646 1.6038 1.6038 1.6628 1.6628 1.8618 1.8618 2.0626 2.0626 2.0949 2.0949 2.5106 2.5106 2.5887 2.5887 2.6748 2.6748 2.7727 2.7727 2.9377 2.9377 3.0989 3.0989 3.3257 3.3257 3.3468 3.3468 3.4475 3.4475 3.5599 3.5599 3.6366 3.6366 3.7069 3.7069 4.5221 4.5221 5.6672 5.6672 11.0307 11.0307 11.3761 11.3761 12.0439 12.0439 12.4923 12.4923 12.8253 12.8253 13.4290 13.4290 13.7827 13.7827 k =-0.1885 0.1750 0.6823 ( 14624 PWs) bands (ev): -16.9752 -16.9752 -16.8562 -16.8562 -16.3694 -16.3694 -16.3078 -16.3078 -16.2890 -16.2890 -16.2498 -16.2498 -12.7264 -12.7264 -12.7011 -12.7011 -1.7115 -1.7115 -1.5809 -1.5809 -1.2014 -1.2014 -0.5542 -0.5542 -0.4579 -0.4579 -0.1803 -0.1803 -0.1634 -0.1634 -0.0632 -0.0632 0.0667 0.0667 0.5935 0.5935 0.7241 0.7241 0.8864 0.8864 0.9438 0.9438 1.3175 1.3175 1.3498 1.3498 1.6152 1.6152 1.6522 1.6522 1.8403 1.8403 2.0768 2.0768 2.0975 2.0975 2.5249 2.5249 2.5868 2.5868 2.6542 2.6542 2.7525 2.7525 2.9524 2.9524 3.1041 3.1041 3.3283 3.3283 3.3526 3.3526 3.4459 3.4459 3.5598 3.5598 3.6359 3.6359 3.7095 3.7095 4.5337 4.5337 5.6420 5.6420 11.0346 11.0346 11.3827 11.3827 12.0799 12.0799 12.5649 12.5649 12.7793 12.7793 13.4364 13.4364 13.6782 13.6782 k =-0.2030 0.1885 0.6823 ( 14634 PWs) bands (ev): -16.9745 -16.9745 -16.8566 -16.8566 -16.3725 -16.3725 -16.3060 -16.3060 -16.2883 -16.2883 -16.2493 -16.2493 -12.7270 -12.7270 -12.7014 -12.7014 -1.7069 -1.7069 -1.5845 -1.5845 -1.2005 -1.2005 -0.5431 -0.5431 -0.4588 -0.4588 -0.1863 -0.1863 -0.1678 -0.1678 -0.0561 -0.0561 0.0728 0.0728 0.6167 0.6167 0.7282 0.7282 0.8660 0.8660 0.9593 0.9593 1.2885 1.2885 1.3482 1.3482 1.6248 1.6248 1.6445 1.6445 1.8181 1.8181 2.0896 2.0896 2.1047 2.1047 2.5365 2.5365 2.5833 2.5833 2.6331 2.6331 2.7309 2.7309 2.9667 2.9667 3.1084 3.1084 3.3235 3.3235 3.3627 3.3627 3.4448 3.4448 3.5603 3.5603 3.6344 3.6344 3.7132 3.7132 4.5434 4.5434 5.6189 5.6189 11.0384 11.0384 11.3892 11.3892 12.1163 12.1163 12.6436 12.6436 12.7324 12.7324 13.4456 13.4456 13.5755 13.5755 k =-0.2175 0.2020 0.6823 ( 14622 PWs) bands (ev): -16.9738 -16.9738 -16.8570 -16.8570 -16.3756 -16.3756 -16.3041 -16.3041 -16.2875 -16.2875 -16.2489 -16.2489 -12.7277 -12.7277 -12.7018 -12.7018 -1.7022 -1.7022 -1.5881 -1.5881 -1.1996 -1.1996 -0.5325 -0.5325 -0.4589 -0.4589 -0.1934 -0.1934 -0.1719 -0.1719 -0.0495 -0.0495 0.0777 0.0777 0.6403 0.6403 0.7329 0.7329 0.8511 0.8511 0.9757 0.9757 1.2574 1.2574 1.3491 1.3491 1.6224 1.6224 1.6495 1.6495 1.7958 1.7958 2.0995 2.0995 2.1177 2.1177 2.5437 2.5437 2.5793 2.5793 2.6119 2.6119 2.7080 2.7080 2.9801 2.9801 3.1123 3.1123 3.3171 3.3171 3.3711 3.3711 3.4443 3.4443 3.5613 3.5613 3.6322 3.6322 3.7177 3.7177 4.5502 4.5502 5.5987 5.5987 11.0420 11.0420 11.3957 11.3957 12.1532 12.1532 12.6845 12.6845 12.7281 12.7281 13.4546 13.4546 13.4778 13.4778 k =-0.2320 0.2154 0.6823 ( 14628 PWs) bands (ev): -16.9731 -16.9731 -16.8574 -16.8574 -16.3787 -16.3787 -16.3022 -16.3022 -16.2867 -16.2867 -16.2486 -16.2486 -12.7283 -12.7283 -12.7021 -12.7021 -1.6975 -1.6975 -1.5919 -1.5919 -1.1985 -1.1985 -0.5233 -0.5233 -0.4578 -0.4578 -0.2012 -0.2012 -0.1759 -0.1759 -0.0434 -0.0434 0.0800 0.0800 0.6638 0.6638 0.7386 0.7386 0.8438 0.8438 0.9921 0.9921 1.2266 1.2266 1.3506 1.3506 1.6124 1.6124 1.6632 1.6632 1.7739 1.7739 2.1083 2.1083 2.1336 2.1336 2.5445 2.5445 2.5754 2.5754 2.5923 2.5923 2.6841 2.6841 2.9918 2.9918 3.1165 3.1165 3.3103 3.3103 3.3766 3.3766 3.4445 3.4445 3.5630 3.5630 3.6297 3.6297 3.7225 3.7225 4.5533 4.5533 5.5823 5.5823 11.0454 11.0454 11.4020 11.4020 12.1904 12.1904 12.6362 12.6362 12.8175 12.8175 13.3782 13.3782 13.4712 13.4712 k =-0.2465 0.2289 0.6823 ( 14636 PWs) bands (ev): -16.9724 -16.9724 -16.8578 -16.8578 -16.3818 -16.3818 -16.3001 -16.3001 -16.2858 -16.2858 -16.2484 -16.2484 -12.7290 -12.7290 -12.7024 -12.7024 -1.6929 -1.6929 -1.5958 -1.5958 -1.1975 -1.1975 -0.5161 -0.5161 -0.4547 -0.4547 -0.2091 -0.2091 -0.1801 -0.1801 -0.0378 -0.0378 0.0790 0.0790 0.6862 0.6862 0.7460 0.7460 0.8449 0.8449 1.0081 1.0081 1.1966 1.1966 1.3521 1.3521 1.6013 1.6013 1.6791 1.6791 1.7526 1.7526 2.1175 2.1175 2.1505 2.1505 2.5386 2.5386 2.5634 2.5634 2.5832 2.5832 2.6592 2.6592 3.0010 3.0010 3.1215 3.1215 3.3036 3.3036 3.3790 3.3790 3.4451 3.4451 3.5654 3.5654 3.6270 3.6270 3.7271 3.7271 4.5521 4.5521 5.5703 5.5703 11.0486 11.0486 11.4080 11.4080 12.2280 12.2280 12.5873 12.5873 12.9112 12.9112 13.2869 13.2869 13.4859 13.4859 k =-0.2610 0.2423 0.6823 ( 14636 PWs) bands (ev): -16.9717 -16.9717 -16.8582 -16.8582 -16.3849 -16.3849 -16.2980 -16.2980 -16.2850 -16.2850 -16.2483 -16.2483 -12.7296 -12.7296 -12.7028 -12.7028 -1.6883 -1.6883 -1.5997 -1.5997 -1.1963 -1.1963 -0.5116 -0.5116 -0.4491 -0.4491 -0.2168 -0.2168 -0.1843 -0.1843 -0.0326 -0.0326 0.0741 0.0741 0.7061 0.7061 0.7566 0.7566 0.8548 0.8548 1.0236 1.0236 1.1678 1.1678 1.3537 1.3537 1.5901 1.5901 1.6960 1.6960 1.7322 1.7322 2.1273 2.1273 2.1676 2.1676 2.5282 2.5282 2.5441 2.5441 2.5814 2.5814 2.6343 2.6343 3.0070 3.0070 3.1276 3.1276 3.2972 3.2972 3.3787 3.3787 3.4461 3.4461 3.5686 3.5686 3.6242 3.6242 3.7311 3.7311 4.5464 4.5464 5.5632 5.5632 11.0516 11.0516 11.4138 11.4138 12.2657 12.2657 12.5381 12.5381 13.0083 13.0083 13.2008 13.2008 13.5024 13.5024 k =-0.2755 0.2558 0.6823 ( 14622 PWs) bands (ev): -16.9710 -16.9710 -16.8586 -16.8586 -16.3879 -16.3879 -16.2958 -16.2958 -16.2842 -16.2842 -16.2483 -16.2483 -12.7303 -12.7303 -12.7031 -12.7031 -1.6839 -1.6839 -1.6036 -1.6036 -1.1952 -1.1952 -0.5097 -0.5097 -0.4412 -0.4412 -0.2241 -0.2241 -0.1887 -0.1887 -0.0281 -0.0281 0.0659 0.0659 0.7216 0.7216 0.7721 0.7721 0.8729 0.8729 1.0380 1.0380 1.1405 1.1405 1.3553 1.3553 1.5792 1.5792 1.7108 1.7108 1.7159 1.7159 2.1376 2.1376 2.1846 2.1846 2.5146 2.5146 2.5251 2.5251 2.5763 2.5763 2.6117 2.6117 3.0095 3.0095 3.1350 3.1350 3.2912 3.2912 3.3761 3.3761 3.4471 3.4471 3.5726 3.5726 3.6215 3.6215 3.7343 3.7343 4.5361 4.5361 5.5610 5.5610 11.0542 11.0542 11.4191 11.4191 12.3036 12.3036 12.4886 12.4886 13.1044 13.1044 13.1238 13.1238 13.5200 13.5200 k =-0.2900 0.2693 0.6823 ( 14622 PWs) bands (ev): -16.9703 -16.9703 -16.8590 -16.8590 -16.3908 -16.3908 -16.2936 -16.2936 -16.2834 -16.2834 -16.2483 -16.2483 -12.7309 -12.7309 -12.7035 -12.7035 -1.6796 -1.6796 -1.6074 -1.6074 -1.1940 -1.1940 -0.5098 -0.5098 -0.4317 -0.4317 -0.2309 -0.2309 -0.1930 -0.1930 -0.0251 -0.0251 0.0556 0.0556 0.7326 0.7326 0.7926 0.7926 0.8981 0.8981 1.0508 1.0508 1.1157 1.1157 1.3568 1.3568 1.5690 1.5690 1.6941 1.6941 1.7329 1.7329 2.1481 2.1481 2.2014 2.2014 2.4983 2.4983 2.5082 2.5082 2.5610 2.5610 2.5967 2.5967 3.0083 3.0083 3.1434 3.1434 3.2859 3.2859 3.3715 3.3715 3.4480 3.4480 3.5772 3.5772 3.6190 3.6190 3.7365 3.7365 4.5215 4.5215 5.5636 5.5636 11.0564 11.0564 11.4241 11.4241 12.3415 12.3415 12.4392 12.4392 13.0450 13.0450 13.2094 13.2094 13.5383 13.5383 k =-0.2900 0.2693 0.6823 ( 14622 PWs) bands (ev): -16.9703 -16.9703 -16.8590 -16.8590 -16.3908 -16.3908 -16.2936 -16.2936 -16.2834 -16.2834 -16.2483 -16.2483 -12.7309 -12.7309 -12.7035 -12.7035 -1.6796 -1.6796 -1.6074 -1.6074 -1.1940 -1.1940 -0.5098 -0.5098 -0.4317 -0.4317 -0.2309 -0.2309 -0.1930 -0.1930 -0.0251 -0.0251 0.0556 0.0556 0.7326 0.7326 0.7926 0.7926 0.8981 0.8981 1.0508 1.0508 1.1157 1.1157 1.3568 1.3568 1.5690 1.5690 1.6941 1.6941 1.7329 1.7329 2.1481 2.1481 2.2014 2.2014 2.4983 2.4983 2.5082 2.5082 2.5610 2.5610 2.5967 2.5967 3.0083 3.0083 3.1434 3.1434 3.2859 3.2859 3.3715 3.3715 3.4480 3.4480 3.5772 3.5772 3.6190 3.6190 3.7365 3.7365 4.5215 4.5215 5.5636 5.5636 11.0564 11.0564 11.4241 11.4241 12.3415 12.3415 12.4392 12.4392 13.0450 13.0450 13.2094 13.2094 13.5383 13.5383 k =-0.2996 0.2781 0.6692 ( 14612 PWs) bands (ev): -16.9699 -16.9699 -16.8593 -16.8593 -16.3926 -16.3926 -16.2925 -16.2925 -16.2826 -16.2826 -16.2485 -16.2485 -12.7313 -12.7313 -12.7037 -12.7037 -1.6771 -1.6771 -1.6099 -1.6099 -1.1932 -1.1932 -0.5107 -0.5107 -0.4255 -0.4255 -0.2349 -0.2349 -0.1954 -0.1954 -0.0247 -0.0247 0.0487 0.0487 0.7382 0.7382 0.8066 0.8066 0.9178 0.9178 1.0583 1.0583 1.1026 1.1026 1.3565 1.3565 1.5627 1.5627 1.6833 1.6833 1.7448 1.7448 2.1538 2.1538 2.2129 2.2129 2.4848 2.4848 2.4989 2.4989 2.5460 2.5460 2.5920 2.5920 3.0065 3.0065 3.1496 3.1496 3.2829 3.2829 3.3679 3.3679 3.4487 3.4487 3.5805 3.5805 3.6177 3.6177 3.7381 3.7381 4.5096 4.5096 5.5673 5.5673 11.0564 11.0564 11.4272 11.4272 12.3655 12.3655 12.4077 12.4077 13.0000 13.0000 13.2744 13.2744 13.5490 13.5490 k =-0.3091 0.2870 0.6562 ( 14626 PWs) bands (ev): -16.9695 -16.9695 -16.8595 -16.8595 -16.3943 -16.3943 -16.2920 -16.2920 -16.2812 -16.2812 -16.2486 -16.2486 -12.7316 -12.7316 -12.7039 -12.7039 -1.6750 -1.6750 -1.6123 -1.6123 -1.1925 -1.1925 -0.5120 -0.5120 -0.4206 -0.4206 -0.2382 -0.2382 -0.1965 -0.1965 -0.0263 -0.0263 0.0426 0.0426 0.7430 0.7430 0.8187 0.8187 0.9395 0.9395 1.0626 1.0626 1.0967 1.0967 1.3534 1.3534 1.5566 1.5566 1.6741 1.6741 1.7558 1.7558 2.1575 2.1575 2.2252 2.2252 2.4691 2.4691 2.4906 2.4906 2.5297 2.5297 2.5903 2.5903 3.0053 3.0053 3.1565 3.1565 3.2803 3.2803 3.3643 3.3643 3.4493 3.4493 3.5837 3.5837 3.6168 3.6168 3.7404 3.7404 4.4960 4.4960 5.5720 5.5720 11.0540 11.0540 11.4304 11.4304 12.3776 12.3776 12.3878 12.3878 12.9587 12.9587 13.3343 13.3343 13.5585 13.5585 k =-0.3187 0.2959 0.6432 ( 14628 PWs) bands (ev): -16.9691 -16.9691 -16.8597 -16.8597 -16.3958 -16.3958 -16.2919 -16.2919 -16.2796 -16.2796 -16.2489 -16.2489 -12.7319 -12.7319 -12.7040 -12.7040 -1.6733 -1.6733 -1.6146 -1.6146 -1.1919 -1.1919 -0.5135 -0.5135 -0.4169 -0.4169 -0.2407 -0.2407 -0.1965 -0.1965 -0.0302 -0.0302 0.0380 0.0380 0.7475 0.7475 0.8284 0.8284 0.9626 0.9626 1.0592 1.0592 1.1020 1.1020 1.3474 1.3474 1.5507 1.5507 1.6667 1.6667 1.7661 1.7661 2.1596 2.1596 2.2376 2.2376 2.4526 2.4526 2.4826 2.4826 2.5136 2.5136 2.5901 2.5901 3.0049 3.0049 3.1635 3.1635 3.2781 3.2781 3.3610 3.3610 3.4499 3.4499 3.5868 3.5868 3.6162 3.6162 3.7433 3.7433 4.4814 4.4814 5.5773 5.5773 11.0500 11.0500 11.4334 11.4334 12.3504 12.3504 12.4072 12.4072 12.9215 12.9215 13.3821 13.3821 13.5721 13.5721 k =-0.3282 0.3047 0.6302 ( 14634 PWs) bands (ev): -16.9688 -16.9688 -16.8599 -16.8599 -16.3971 -16.3971 -16.2920 -16.2920 -16.2777 -16.2777 -16.2492 -16.2492 -12.7322 -12.7322 -12.7041 -12.7041 -1.6719 -1.6719 -1.6167 -1.6167 -1.1913 -1.1913 -0.5150 -0.5150 -0.4143 -0.4143 -0.2425 -0.2425 -0.1954 -0.1954 -0.0364 -0.0364 0.0350 0.0350 0.7518 0.7518 0.8355 0.8355 0.9863 0.9863 1.0526 1.0526 1.1139 1.1139 1.3384 1.3384 1.5452 1.5452 1.6611 1.6611 1.7757 1.7757 2.1607 2.1607 2.2494 2.2494 2.4362 2.4362 2.4745 2.4745 2.4988 2.4988 2.5906 2.5906 3.0052 3.0052 3.1705 3.1705 3.2766 3.2766 3.3578 3.3578 3.4505 3.4505 3.5898 3.5898 3.6158 3.6158 3.7466 3.7466 4.4663 4.4663 5.5829 5.5829 11.0450 11.0450 11.4364 11.4364 12.3254 12.3254 12.4243 12.4243 12.8886 12.8886 13.4100 13.4100 13.5968 13.5968 k =-0.3378 0.3136 0.6172 ( 14628 PWs) bands (ev): -16.9686 -16.9686 -16.8601 -16.8601 -16.3982 -16.3982 -16.2923 -16.2923 -16.2759 -16.2759 -16.2496 -16.2496 -12.7324 -12.7324 -12.7042 -12.7042 -1.6708 -1.6708 -1.6185 -1.6185 -1.1908 -1.1908 -0.5165 -0.5165 -0.4128 -0.4128 -0.2435 -0.2435 -0.1932 -0.1932 -0.0442 -0.0442 0.0335 0.0335 0.7558 0.7558 0.8405 0.8405 1.0077 1.0077 1.0492 1.0492 1.1275 1.1275 1.3263 1.3263 1.5400 1.5400 1.6571 1.6571 1.7847 1.7847 2.1609 2.1609 2.2602 2.2602 2.4207 2.4207 2.4658 2.4658 2.4864 2.4864 2.5913 2.5913 3.0062 3.0062 3.1769 3.1769 3.2755 3.2755 3.3550 3.3550 3.4510 3.4510 3.5924 3.5924 3.6156 3.6156 3.7501 3.7501 4.4513 4.4513 5.5885 5.5885 11.0397 11.0397 11.4391 11.4391 12.3030 12.3030 12.4390 12.4390 12.8601 12.8601 13.4178 13.4178 13.6323 13.6323 k =-0.3473 0.3224 0.6041 ( 14625 PWs) bands (ev): -16.9683 -16.9683 -16.8602 -16.8602 -16.3992 -16.3992 -16.2927 -16.2927 -16.2741 -16.2741 -16.2500 -16.2500 -12.7326 -12.7326 -12.7043 -12.7043 -1.6700 -1.6700 -1.6202 -1.6202 -1.1904 -1.1904 -0.5178 -0.5178 -0.4120 -0.4120 -0.2440 -0.2440 -0.1902 -0.1902 -0.0531 -0.0531 0.0329 0.0329 0.7596 0.7596 0.8436 0.8436 1.0182 1.0182 1.0584 1.0584 1.1410 1.1410 1.3112 1.3112 1.5353 1.5353 1.6546 1.6546 1.7929 1.7929 2.1605 2.1605 2.2699 2.2699 2.4065 2.4065 2.4564 2.4564 2.4770 2.4770 2.5919 2.5919 3.0077 3.0077 3.1827 3.1827 3.2749 3.2749 3.3524 3.3524 3.4515 3.4515 3.5947 3.5947 3.6155 3.6155 3.7537 3.7537 4.4372 4.4372 5.5937 5.5937 11.0344 11.0344 11.4415 11.4415 12.2836 12.2836 12.4511 12.4511 12.8359 12.8359 13.4135 13.4135 13.6699 13.6699 k =-0.3568 0.3313 0.5911 ( 14634 PWs) bands (ev): -16.9682 -16.9682 -16.8603 -16.8603 -16.4000 -16.4000 -16.2931 -16.2931 -16.2723 -16.2723 -16.2506 -16.2506 -12.7328 -12.7328 -12.7044 -12.7044 -1.6693 -1.6693 -1.6215 -1.6215 -1.1901 -1.1901 -0.5189 -0.5189 -0.4118 -0.4118 -0.2441 -0.2441 -0.1865 -0.1865 -0.0622 -0.0622 0.0328 0.0328 0.7629 0.7629 0.8454 0.8454 1.0175 1.0175 1.0805 1.0805 1.1532 1.1532 1.2936 1.2936 1.5312 1.5312 1.6532 1.6532 1.8002 1.8002 2.1597 2.1597 2.2781 2.2781 2.3942 2.3942 2.4469 2.4469 2.4704 2.4704 2.5924 2.5924 3.0094 3.0094 3.1876 3.1876 3.2748 3.2748 3.3501 3.3501 3.4519 3.4519 3.5967 3.5967 3.6155 3.6155 3.7571 3.7571 4.4245 4.4245 5.5983 5.5983 11.0296 11.0296 11.4436 11.4436 12.2673 12.2673 12.4609 12.4609 12.8162 12.8162 13.4046 13.4046 13.7019 13.7019 k =-0.3664 0.3402 0.5781 ( 14637 PWs) bands (ev): -16.9680 -16.9680 -16.8604 -16.8604 -16.4006 -16.4006 -16.2935 -16.2935 -16.2707 -16.2707 -16.2512 -16.2512 -12.7329 -12.7329 -12.7044 -12.7044 -1.6688 -1.6688 -1.6226 -1.6226 -1.1898 -1.1898 -0.5197 -0.5197 -0.4119 -0.4119 -0.2440 -0.2440 -0.1825 -0.1825 -0.0708 -0.0708 0.0331 0.0331 0.7657 0.7657 0.8462 0.8462 1.0142 1.0142 1.1060 1.1060 1.1635 1.1635 1.2741 1.2741 1.5278 1.5278 1.6526 1.6526 1.8064 1.8064 2.1587 2.1587 2.2847 2.2847 2.3841 2.3841 2.4385 2.4385 2.4660 2.4660 2.5928 2.5928 3.0109 3.0109 3.1913 3.1913 3.2751 3.2751 3.3482 3.3482 3.4522 3.4522 3.5983 3.5983 3.6154 3.6154 3.7601 3.7601 4.4139 4.4139 5.6021 5.6021 11.0256 11.0256 11.4453 11.4453 12.2544 12.2544 12.4684 12.4684 12.8010 12.8010 13.3951 13.3951 13.7255 13.7255 k =-0.3759 0.3490 0.5651 ( 14648 PWs) bands (ev): -16.9679 -16.9679 -16.8605 -16.8605 -16.4010 -16.4010 -16.2939 -16.2939 -16.2692 -16.2692 -16.2518 -16.2518 -12.7330 -12.7330 -12.7044 -12.7044 -1.6685 -1.6685 -1.6234 -1.6234 -1.1896 -1.1896 -0.5203 -0.5203 -0.4121 -0.4121 -0.2438 -0.2438 -0.1785 -0.1785 -0.0783 -0.0783 0.0334 0.0334 0.7678 0.7678 0.8465 0.8465 1.0113 1.0113 1.1305 1.1305 1.1716 1.1716 1.2540 1.2540 1.5252 1.5252 1.6525 1.6525 1.8110 1.8110 2.1578 2.1578 2.2895 2.2895 2.3767 2.3767 2.4319 2.4319 2.4632 2.4632 2.5930 2.5930 3.0122 3.0122 3.1938 3.1938 3.2757 3.2757 3.3467 3.3467 3.4525 3.4525 3.5995 3.5995 3.6154 3.6154 3.7624 3.7624 4.4059 4.4059 5.6049 5.6049 11.0225 11.0225 11.4466 11.4466 12.2451 12.2451 12.4737 12.4737 12.7901 12.7901 13.3872 13.3872 13.7411 13.7411 k =-0.3855 0.3579 0.5520 ( 14652 PWs) bands (ev): -16.9679 -16.9679 -16.8605 -16.8605 -16.4012 -16.4012 -16.2944 -16.2944 -16.2679 -16.2679 -16.2525 -16.2525 -12.7330 -12.7330 -12.7044 -12.7044 -1.6683 -1.6683 -1.6239 -1.6239 -1.1895 -1.1895 -0.5207 -0.5207 -0.4122 -0.4122 -0.2436 -0.2436 -0.1750 -0.1750 -0.0839 -0.0839 0.0336 0.0336 0.7692 0.7692 0.8465 0.8465 1.0094 1.0094 1.1497 1.1497 1.1773 1.1773 1.2369 1.2369 1.5236 1.5236 1.6526 1.6526 1.8139 1.8139 2.1572 2.1572 2.2925 2.2925 2.3723 2.3723 2.4276 2.4276 2.4619 2.4619 2.5929 2.5929 3.0130 3.0130 3.1950 3.1950 3.2763 3.2763 3.3457 3.3457 3.4526 3.4526 3.6004 3.6004 3.6153 3.6153 3.7639 3.7639 4.4009 4.4009 5.6066 5.6066 11.0207 11.0207 11.4474 11.4474 12.2393 12.2393 12.4768 12.4768 12.7837 12.7837 13.3821 13.3821 13.7499 13.7499 k =-0.3950 0.3667 0.5390 ( 14658 PWs) bands (ev): -16.9679 -16.9679 -16.8605 -16.8605 -16.4012 -16.4012 -16.2948 -16.2948 -16.2667 -16.2667 -16.2532 -16.2532 -12.7331 -12.7331 -12.7045 -12.7045 -1.6682 -1.6682 -1.6240 -1.6240 -1.1894 -1.1894 -0.5207 -0.5207 -0.4123 -0.4123 -0.2435 -0.2435 -0.1727 -0.1727 -0.0871 -0.0871 0.0337 0.0337 0.7696 0.7696 0.8463 0.8463 1.0087 1.0087 1.1556 1.1556 1.1789 1.1789 1.2321 1.2321 1.5230 1.5230 1.6526 1.6526 1.8148 1.8148 2.1571 2.1571 2.2935 2.2935 2.3710 2.3710 2.4258 2.4258 2.4620 2.4620 2.5928 2.5928 3.0132 3.0132 3.1949 3.1949 3.2770 3.2770 3.3452 3.3452 3.4528 3.4528 3.6009 3.6009 3.6150 3.6150 3.7646 3.7646 4.3992 4.3992 5.6071 5.6071 11.0201 11.0201 11.4476 11.4476 12.2373 12.2373 12.4778 12.4778 12.7816 12.7816 13.3803 13.3803 13.7529 13.7529 k =-0.3950 0.3667 0.5390 ( 14658 PWs) bands (ev): -16.9679 -16.9679 -16.8605 -16.8605 -16.4012 -16.4012 -16.2948 -16.2948 -16.2667 -16.2667 -16.2532 -16.2532 -12.7331 -12.7331 -12.7045 -12.7045 -1.6682 -1.6682 -1.6240 -1.6240 -1.1894 -1.1894 -0.5207 -0.5207 -0.4123 -0.4123 -0.2435 -0.2435 -0.1727 -0.1727 -0.0871 -0.0871 0.0337 0.0337 0.7696 0.7696 0.8463 0.8463 1.0087 1.0087 1.1556 1.1556 1.1789 1.1789 1.2321 1.2321 1.5230 1.5230 1.6526 1.6526 1.8148 1.8148 2.1571 2.1571 2.2935 2.2935 2.3710 2.3710 2.4258 2.4258 2.4620 2.4620 2.5928 2.5928 3.0132 3.0132 3.1949 3.1949 3.2770 3.2770 3.3452 3.3452 3.4528 3.4528 3.6009 3.6009 3.6150 3.6150 3.7646 3.7646 4.3992 4.3992 5.6071 5.6071 11.0201 11.0201 11.4476 11.4476 12.2373 12.2373 12.4778 12.4778 12.7816 12.7816 13.3803 13.3803 13.7529 13.7529 k =-0.3849 0.3573 0.5252 ( 14654 PWs) bands (ev): -16.9686 -16.9686 -16.8602 -16.8602 -16.3987 -16.3987 -16.2980 -16.2980 -16.2664 -16.2664 -16.2528 -16.2528 -12.7324 -12.7324 -12.7040 -12.7040 -1.6733 -1.6733 -1.6213 -1.6213 -1.1907 -1.1907 -0.5189 -0.5189 -0.4274 -0.4274 -0.2387 -0.2387 -0.1591 -0.1591 -0.0776 -0.0776 0.0287 0.0287 0.7682 0.7682 0.8139 0.8139 1.0284 1.0284 1.1299 1.1299 1.1738 1.1738 1.2125 1.2125 1.5253 1.5253 1.6675 1.6675 1.7960 1.7960 2.1405 2.1405 2.2882 2.2882 2.3719 2.3719 2.4475 2.4475 2.4795 2.4795 2.6106 2.6106 3.0348 3.0348 3.1999 3.1999 3.2718 3.2718 3.3626 3.3626 3.4528 3.4528 3.5938 3.5938 3.6189 3.6189 3.7817 3.7817 4.4113 4.4113 5.5894 5.5894 11.0004 11.0004 11.4474 11.4474 12.2817 12.2817 12.4390 12.4390 12.8214 12.8214 13.3297 13.3297 13.6953 13.6953 k =-0.3748 0.3479 0.5114 ( 14644 PWs) bands (ev): -16.9693 -16.9693 -16.8598 -16.8598 -16.3959 -16.3959 -16.3013 -16.3013 -16.2661 -16.2661 -16.2525 -16.2525 -12.7317 -12.7317 -12.7035 -12.7035 -1.6791 -1.6791 -1.6185 -1.6185 -1.1920 -1.1920 -0.5184 -0.5184 -0.4428 -0.4428 -0.2347 -0.2347 -0.1451 -0.1451 -0.0688 -0.0688 0.0254 0.0254 0.7671 0.7671 0.7816 0.7816 1.0486 1.0486 1.1013 1.1013 1.1610 1.1610 1.2042 1.2042 1.5293 1.5293 1.6834 1.6834 1.7775 1.7775 2.1233 2.1233 2.2826 2.2826 2.3732 2.3732 2.4681 2.4681 2.4993 2.4993 2.6280 2.6280 3.0515 3.0515 3.2072 3.2072 3.2660 3.2660 3.3790 3.3790 3.4533 3.4533 3.5858 3.5858 3.6240 3.6240 3.8036 3.8036 4.4214 4.4214 5.5723 5.5723 10.9750 10.9750 11.4474 11.4474 12.3276 12.3276 12.3997 12.3997 12.8647 12.8647 13.2779 13.2779 13.6408 13.6408 k =-0.3646 0.3385 0.4976 ( 14636 PWs) bands (ev): -16.9701 -16.9701 -16.8595 -16.8595 -16.3930 -16.3930 -16.3047 -16.3047 -16.2658 -16.2658 -16.2522 -16.2522 -12.7309 -12.7309 -12.7030 -12.7030 -1.6856 -1.6856 -1.6157 -1.6157 -1.1933 -1.1933 -0.5207 -0.5207 -0.4568 -0.4568 -0.2321 -0.2321 -0.1313 -0.1313 -0.0616 -0.0616 0.0250 0.0250 0.7492 0.7492 0.7673 0.7673 1.0576 1.0576 1.0840 1.0840 1.1393 1.1393 1.2061 1.2061 1.5349 1.5349 1.6999 1.6999 1.7599 1.7599 2.1055 2.1055 2.2769 2.2769 2.3758 2.3758 2.4871 2.4871 2.5208 2.5208 2.6449 2.6449 3.0632 3.0632 3.2171 3.2171 3.2598 3.2598 3.3933 3.3933 3.4543 3.4543 3.5775 3.5775 3.6301 3.6301 3.8310 3.8310 4.4288 4.4288 5.5564 5.5564 10.9433 10.9433 11.4477 11.4477 12.3604 12.3604 12.3747 12.3747 12.9113 12.9113 13.2252 13.2252 13.5896 13.5896 k =-0.3545 0.3291 0.4837 ( 14620 PWs) bands (ev): -16.9710 -16.9710 -16.8591 -16.8591 -16.3899 -16.3899 -16.3083 -16.3083 -16.2654 -16.2654 -16.2519 -16.2519 -12.7300 -12.7300 -12.7024 -12.7024 -1.6930 -1.6930 -1.6130 -1.6130 -1.1946 -1.1946 -0.5281 -0.5281 -0.4672 -0.4672 -0.2316 -0.2316 -0.1184 -0.1184 -0.0566 -0.0566 0.0285 0.0285 0.7198 0.7198 0.7671 0.7671 1.0345 1.0345 1.0914 1.0914 1.1235 1.1235 1.2117 1.2117 1.5419 1.5419 1.7166 1.7166 1.7438 1.7438 2.0875 2.0875 2.2710 2.2710 2.3797 2.3797 2.5049 2.5049 2.5430 2.5430 2.6608 2.6608 3.0702 3.0702 3.2287 3.2287 3.2540 3.2540 3.4046 3.4046 3.4558 3.4558 3.5688 3.5688 3.6370 3.6370 3.8643 3.8643 4.4328 4.4328 5.5424 5.5424 10.9049 10.9049 11.4483 11.4483 12.3227 12.3227 12.4210 12.4210 12.9612 12.9612 13.1721 13.1721 13.5421 13.5421 k =-0.3444 0.3197 0.4699 ( 14630 PWs) bands (ev): -16.9720 -16.9720 -16.8587 -16.8587 -16.3867 -16.3867 -16.3120 -16.3120 -16.2650 -16.2650 -16.2517 -16.2517 -12.7291 -12.7291 -12.7017 -12.7017 -1.7013 -1.7013 -1.6104 -1.6104 -1.1959 -1.1959 -0.5418 -0.5418 -0.4726 -0.4726 -0.2339 -0.2339 -0.1079 -0.1079 -0.0531 -0.0531 0.0362 0.0362 0.6934 0.6934 0.7675 0.7675 1.0066 1.0066 1.0746 1.0746 1.1379 1.1379 1.2189 1.2189 1.5503 1.5503 1.7240 1.7240 1.7386 1.7386 2.0698 2.0698 2.2650 2.2650 2.3848 2.3848 2.5220 2.5220 2.5648 2.5648 2.6756 2.6756 3.0734 3.0734 3.2363 3.2363 3.2540 3.2540 3.4127 3.4127 3.4577 3.4577 3.5600 3.5600 3.6444 3.6444 3.9034 3.9034 4.4327 4.4327 5.5306 5.5306 10.8593 10.8593 11.4493 11.4493 12.2862 12.2862 12.4664 12.4664 13.0138 13.0138 13.1189 13.1189 13.4986 13.4986 k =-0.3342 0.3103 0.4561 ( 14628 PWs) bands (ev): -16.9730 -16.9730 -16.8583 -16.8583 -16.3833 -16.3833 -16.3157 -16.3157 -16.2646 -16.2646 -16.2516 -16.2516 -12.7281 -12.7281 -12.7010 -12.7010 -1.7103 -1.7103 -1.6080 -1.6080 -1.1972 -1.1972 -0.5605 -0.5605 -0.4742 -0.4742 -0.2396 -0.2396 -0.1017 -0.1017 -0.0486 -0.0486 0.0472 0.0472 0.6711 0.6711 0.7683 0.7683 0.9796 0.9796 1.0480 1.0480 1.1629 1.1629 1.2278 1.2278 1.5599 1.5599 1.7117 1.7117 1.7547 1.7547 2.0526 2.0526 2.2590 2.2590 2.3912 2.3912 2.5387 2.5387 2.5857 2.5857 2.6891 2.6891 3.0734 3.0734 3.2321 3.2321 3.2671 3.2671 3.4176 3.4176 3.4599 3.4599 3.5515 3.5515 3.6523 3.6523 3.9479 3.9479 4.4280 4.4280 5.5218 5.5218 10.8067 10.8067 11.4505 11.4505 12.2514 12.2514 12.5096 12.5096 13.0513 13.0513 13.0832 13.0832 13.4596 13.4596 k =-0.3241 0.3009 0.4423 ( 14640 PWs) bands (ev): -16.9741 -16.9741 -16.8579 -16.8579 -16.3798 -16.3798 -16.3196 -16.3196 -16.2643 -16.2643 -16.2515 -16.2515 -12.7271 -12.7271 -12.7002 -12.7002 -1.7203 -1.7203 -1.6058 -1.6058 -1.1983 -1.1983 -0.5822 -0.5822 -0.4737 -0.4737 -0.2495 -0.2495 -0.1012 -0.1012 -0.0412 -0.0412 0.0603 0.0603 0.6538 0.6538 0.7695 0.7695 0.9546 0.9546 1.0206 1.0206 1.1882 1.1882 1.2395 1.2395 1.5706 1.5706 1.6993 1.6993 1.7727 1.7727 2.0362 2.0362 2.2530 2.2530 2.3987 2.3987 2.5552 2.5552 2.6052 2.6052 2.7013 2.7013 3.0712 3.0712 3.2240 3.2240 3.2845 3.2845 3.4198 3.4198 3.4622 3.4622 3.5434 3.5434 3.6604 3.6604 3.9971 3.9971 4.4181 4.4181 5.5162 5.5162 10.7472 10.7472 11.4521 11.4521 12.2181 12.2181 12.5493 12.5493 13.0036 13.0036 13.1347 13.1347 13.4253 13.4253 k =-0.3140 0.2915 0.4284 ( 14628 PWs) bands (ev): -16.9752 -16.9752 -16.8574 -16.8574 -16.3761 -16.3761 -16.3234 -16.3234 -16.2639 -16.2639 -16.2513 -16.2513 -12.7260 -12.7260 -12.6993 -12.6993 -1.7312 -1.7312 -1.6038 -1.6038 -1.1994 -1.1994 -0.6059 -0.6059 -0.4724 -0.4724 -0.2638 -0.2638 -0.1054 -0.1054 -0.0316 -0.0316 0.0745 0.0745 0.6420 0.6420 0.7710 0.7710 0.9322 0.9322 0.9939 0.9939 1.2093 1.2093 1.2574 1.2574 1.5823 1.5823 1.6883 1.6883 1.7907 1.7907 2.0213 2.0213 2.2470 2.2470 2.4071 2.4071 2.5713 2.5713 2.6233 2.6233 2.7121 2.7121 3.0672 3.0672 3.2148 3.2148 3.3028 3.3028 3.4201 3.4201 3.4641 3.4641 3.5366 3.5366 3.6689 3.6689 4.0501 4.0501 4.4029 4.4029 5.5140 5.5140 10.6813 10.6813 11.4540 11.4540 12.1861 12.1861 12.5842 12.5842 12.9467 12.9467 13.1971 13.1971 13.3951 13.3951 k =-0.3039 0.2821 0.4146 ( 14612 PWs) bands (ev): -16.9764 -16.9764 -16.8570 -16.8570 -16.3724 -16.3724 -16.3273 -16.3273 -16.2635 -16.2635 -16.2513 -16.2513 -12.7248 -12.7248 -12.6983 -12.6983 -1.7428 -1.7428 -1.6020 -1.6020 -1.2003 -1.2003 -0.6307 -0.6307 -0.4709 -0.4709 -0.2828 -0.2828 -0.1126 -0.1126 -0.0212 -0.0212 0.0888 0.0888 0.6361 0.6361 0.7727 0.7727 0.9130 0.9130 0.9687 0.9687 1.2238 1.2238 1.2832 1.2832 1.5949 1.5949 1.6789 1.6789 1.8083 1.8083 2.0081 2.0081 2.2411 2.2411 2.4163 2.4163 2.5872 2.5872 2.6397 2.6397 2.7216 2.7216 3.0620 3.0620 3.2049 3.2049 3.3205 3.3205 3.4197 3.4197 3.4647 3.4647 3.5318 3.5318 3.6776 3.6776 4.1062 4.1062 4.3822 4.3822 5.5155 5.5155 10.6096 10.6096 11.4562 11.4562 12.1550 12.1550 12.6128 12.6128 12.8878 12.8878 13.2632 13.2632 13.3625 13.3625 k =-0.2937 0.2727 0.4008 ( 14616 PWs) bands (ev): -16.9776 -16.9776 -16.8566 -16.8566 -16.3687 -16.3687 -16.3312 -16.3312 -16.2631 -16.2631 -16.2512 -16.2512 -12.7236 -12.7236 -12.6973 -12.6973 -1.7553 -1.7553 -1.6005 -1.6005 -1.2011 -1.2011 -0.6562 -0.6562 -0.4695 -0.4695 -0.3063 -0.3063 -0.1216 -0.1216 -0.0114 -0.0114 0.1025 0.1025 0.6362 0.6362 0.7745 0.7745 0.8976 0.8976 0.9458 0.9458 1.2338 1.2338 1.3146 1.3146 1.6083 1.6083 1.6713 1.6713 1.8252 1.8252 1.9972 1.9972 2.2352 2.2352 2.4262 2.4262 2.6026 2.6026 2.6543 2.6543 2.7297 2.7297 3.0558 3.0558 3.1946 3.1946 3.3355 3.3355 3.4205 3.4205 3.4631 3.4631 3.5299 3.5299 3.6867 3.6867 4.1646 4.1646 4.3560 4.3560 5.5206 5.5206 10.5329 10.5329 11.4587 11.4587 12.1243 12.1243 12.6339 12.6339 12.8273 12.8273 13.3021 13.3021 13.3324 13.3324 k =-0.2836 0.2633 0.3870 ( 14628 PWs) bands (ev): -16.9789 -16.9789 -16.8562 -16.8562 -16.3649 -16.3649 -16.3350 -16.3350 -16.2628 -16.2628 -16.2511 -16.2511 -12.7223 -12.7223 -12.6962 -12.6962 -1.7686 -1.7686 -1.5993 -1.5993 -1.2018 -1.2018 -0.6823 -0.6823 -0.4685 -0.4685 -0.3340 -0.3340 -0.1316 -0.1316 -0.0029 -0.0029 0.1148 0.1148 0.6421 0.6421 0.7762 0.7762 0.8862 0.8862 0.9260 0.9260 1.2418 1.2418 1.3490 1.3490 1.6225 1.6225 1.6653 1.6653 1.8410 1.8410 1.9892 1.9892 2.2295 2.2295 2.4367 2.4367 2.6176 2.6176 2.6673 2.6673 2.7367 2.7367 3.0489 3.0489 3.1840 3.1840 3.3452 3.3452 3.4250 3.4250 3.4589 3.4589 3.5317 3.5317 3.6960 3.6960 4.2248 4.2248 4.3247 4.3247 5.5289 5.5289 10.4518 10.4518 11.4613 11.4613 12.0935 12.0935 12.6461 12.6461 12.7654 12.7654 13.2206 13.2206 13.3679 13.3679 k =-0.2735 0.2539 0.3732 ( 14638 PWs) bands (ev): -16.9803 -16.9803 -16.8557 -16.8557 -16.3611 -16.3611 -16.3387 -16.3387 -16.2625 -16.2625 -16.2511 -16.2511 -12.7210 -12.7210 -12.6951 -12.6951 -1.7826 -1.7826 -1.5985 -1.5985 -1.2023 -1.2023 -0.7086 -0.7086 -0.4681 -0.4681 -0.3652 -0.3652 -0.1422 -0.1422 0.0036 0.0036 0.1251 0.1251 0.6533 0.6533 0.7777 0.7777 0.8794 0.8794 0.9101 0.9101 1.2487 1.2487 1.3849 1.3849 1.6372 1.6372 1.6610 1.6610 1.8553 1.8553 1.9847 1.9847 2.2240 2.2240 2.4476 2.4476 2.6320 2.6320 2.6786 2.6786 2.7426 2.7426 3.0414 3.0414 3.1730 3.1730 3.3476 3.3476 3.4344 3.4344 3.4532 3.4532 3.5368 3.5368 3.7057 3.7057 4.2836 4.2836 4.2911 4.2911 5.5403 5.5403 10.3674 10.3674 11.4640 11.4640 12.0622 12.0622 12.6483 12.6483 12.7027 12.7027 13.1343 13.1343 13.3652 13.3652 k =-0.2633 0.2445 0.3593 ( 14633 PWs) bands (ev): -16.9817 -16.9817 -16.8553 -16.8553 -16.3577 -16.3577 -16.3420 -16.3420 -16.2622 -16.2622 -16.2510 -16.2510 -12.7196 -12.7196 -12.6939 -12.6939 -1.7973 -1.7973 -1.5979 -1.5979 -1.2027 -1.2027 -0.7351 -0.7351 -0.4686 -0.4686 -0.3991 -0.3991 -0.1534 -0.1534 0.0077 0.0077 0.1328 0.1328 0.6694 0.6694 0.7789 0.7789 0.8769 0.8769 0.8993 0.8993 1.2550 1.2550 1.4217 1.4217 1.6524 1.6524 1.6583 1.6583 1.8678 1.8678 1.9840 1.9840 2.2186 2.2186 2.4588 2.4588 2.6457 2.6457 2.6883 2.6883 2.7476 2.7476 3.0334 3.0334 3.1618 3.1618 3.3436 3.3436 3.4385 3.4385 3.4560 3.4560 3.5445 3.5445 3.7157 3.7157 4.2473 4.2473 4.3488 4.3488 5.5543 5.5543 10.2802 10.2802 11.4669 11.4669 12.0302 12.0302 12.6304 12.6304 12.6493 12.6493 13.0472 13.0472 13.3698 13.3698 k =-0.2532 0.2351 0.3455 ( 14631 PWs) bands (ev): -16.9831 -16.9831 -16.8549 -16.8549 -16.3552 -16.3552 -16.3443 -16.3443 -16.2619 -16.2619 -16.2510 -16.2510 -12.7182 -12.7182 -12.6926 -12.6926 -1.8125 -1.8125 -1.5976 -1.5976 -1.2029 -1.2029 -0.7614 -0.7614 -0.4719 -0.4719 -0.4333 -0.4333 -0.1648 -0.1648 0.0092 0.0092 0.1372 0.1372 0.6896 0.6896 0.7799 0.7799 0.8785 0.8785 0.8945 0.8945 1.2610 1.2610 1.4588 1.4588 1.6570 1.6570 1.6683 1.6683 1.8786 1.8786 1.9873 1.9873 2.2135 2.2135 2.4701 2.4701 2.6584 2.6584 2.6966 2.6966 2.7518 2.7518 3.0252 3.0252 3.1505 3.1505 3.3353 3.3353 3.4300 3.4300 3.4731 3.4731 3.5542 3.5542 3.7260 3.7260 4.2026 4.2026 4.4114 4.4114 5.5705 5.5705 10.1910 10.1910 11.4698 11.4698 11.9972 11.9972 12.5701 12.5701 12.6277 12.6277 12.9602 12.9602 13.3808 13.3808 k =-0.2431 0.2257 0.3317 ( 14633 PWs) bands (ev): -16.9845 -16.9845 -16.8545 -16.8545 -16.3552 -16.3552 -16.3440 -16.3440 -16.2617 -16.2617 -16.2509 -16.2509 -12.7167 -12.7167 -12.6913 -12.6913 -1.8282 -1.8282 -1.5976 -1.5976 -1.2030 -1.2030 -0.7876 -0.7876 -0.4884 -0.4884 -0.4565 -0.4565 -0.1765 -0.1765 0.0080 0.0080 0.1382 0.1382 0.7134 0.7134 0.7810 0.7810 0.8828 0.8828 0.8970 0.8970 1.2668 1.2668 1.4957 1.4957 1.6573 1.6573 1.6842 1.6842 1.8884 1.8884 1.9942 1.9942 2.2086 2.2086 2.4816 2.4816 2.6697 2.6697 2.7039 2.7039 2.7554 2.7554 3.0167 3.0167 3.1392 3.1392 3.3243 3.3243 3.4191 3.4191 3.4932 3.4932 3.5653 3.5653 3.7366 3.7366 4.1544 4.1544 4.4740 4.4740 5.5886 5.5886 10.1006 10.1006 11.4726 11.4726 11.9633 11.9633 12.5050 12.5050 12.6013 12.6013 12.8740 12.8740 13.3975 13.3975 k =-0.2330 0.2163 0.3179 ( 14623 PWs) bands (ev): -16.9860 -16.9860 -16.8542 -16.8542 -16.3575 -16.3575 -16.3413 -16.3413 -16.2616 -16.2616 -16.2508 -16.2508 -12.7152 -12.7152 -12.6899 -12.6899 -1.8444 -1.8444 -1.5980 -1.5980 -1.2030 -1.2030 -0.8135 -0.8135 -0.5236 -0.5236 -0.4629 -0.4629 -0.1883 -0.1883 0.0042 0.0042 0.1354 0.1354 0.7401 0.7401 0.7824 0.7824 0.8899 0.8899 0.9069 0.9069 1.2725 1.2725 1.5319 1.5319 1.6589 1.6589 1.7003 1.7003 1.8983 1.8983 2.0039 2.0039 2.2040 2.2040 2.4930 2.4930 2.6792 2.6792 2.7106 2.7106 2.7587 2.7587 3.0080 3.0080 3.1279 3.1279 3.3115 3.3115 3.4072 3.4072 3.5140 3.5140 3.5776 3.5776 3.7475 3.7475 4.1031 4.1031 4.5365 4.5365 5.6080 5.6080 10.0095 10.0095 11.4753 11.4753 11.9284 11.9284 12.4394 12.4394 12.5668 12.5668 12.7891 12.7891 13.4193 13.4193 k =-0.2228 0.2069 0.3041 ( 14635 PWs) bands (ev): -16.9875 -16.9875 -16.8538 -16.8538 -16.3607 -16.3607 -16.3378 -16.3378 -16.2614 -16.2614 -16.2507 -16.2507 -12.7137 -12.7137 -12.6884 -12.6884 -1.8608 -1.8608 -1.5987 -1.5987 -1.2029 -1.2029 -0.8390 -0.8390 -0.5636 -0.5636 -0.4656 -0.4656 -0.2001 -0.2001 -0.0021 -0.0021 0.1288 0.1288 0.7690 0.7690 0.7845 0.7845 0.9005 0.9005 0.9226 0.9226 1.2781 1.2781 1.5670 1.5670 1.6617 1.6617 1.7163 1.7163 1.9094 1.9094 2.0155 2.0155 2.1997 2.1997 2.5043 2.5043 2.6861 2.6861 2.7172 2.7172 2.7620 2.7620 2.9993 2.9993 3.1166 3.1166 3.2975 3.2975 3.3947 3.3947 3.5349 3.5349 3.5907 3.5907 3.7585 3.7585 4.0494 4.0494 4.5984 4.5984 5.6285 5.6285 9.9183 9.9183 11.4779 11.4779 11.8927 11.8927 12.3738 12.3738 12.5252 12.5252 12.7059 12.7059 13.4457 13.4457 k =-0.2127 0.1975 0.2902 ( 14621 PWs) bands (ev): -16.9891 -16.9891 -16.8535 -16.8535 -16.3640 -16.3640 -16.3339 -16.3339 -16.2614 -16.2614 -16.2506 -16.2506 -12.7122 -12.7122 -12.6870 -12.6870 -1.8775 -1.8775 -1.5996 -1.5996 -1.2027 -1.2027 -0.8640 -0.8640 -0.6047 -0.6047 -0.4678 -0.4678 -0.2120 -0.2120 -0.0107 -0.0107 0.1188 0.1188 0.7873 0.7873 0.7998 0.7998 0.9151 0.9151 0.9429 0.9429 1.2837 1.2837 1.6003 1.6003 1.6657 1.6657 1.7323 1.7323 1.9226 1.9226 2.0281 2.0281 2.1958 2.1958 2.5154 2.5154 2.6900 2.6900 2.7238 2.7238 2.7658 2.7658 2.9905 2.9905 3.1056 3.1056 3.2826 3.2826 3.3819 3.3819 3.5554 3.5554 3.6045 3.6045 3.7697 3.7697 3.9935 3.9935 4.6596 4.6596 5.6496 5.6496 9.8276 9.8276 11.4802 11.4802 11.8563 11.8563 12.3086 12.3086 12.4776 12.4776 12.6247 12.6247 13.4761 13.4761 k =-0.2026 0.1881 0.2764 ( 14609 PWs) bands (ev): -16.9906 -16.9906 -16.8531 -16.8531 -16.3675 -16.3675 -16.3299 -16.3299 -16.2614 -16.2614 -16.2505 -16.2505 -12.7107 -12.7107 -12.6855 -12.6855 -1.8943 -1.8943 -1.6008 -1.6008 -1.2024 -1.2024 -0.8884 -0.8884 -0.6460 -0.6460 -0.4701 -0.4701 -0.2237 -0.2237 -0.0211 -0.0211 0.1057 0.1057 0.7910 0.7910 0.8318 0.8318 0.9336 0.9336 0.9672 0.9672 1.2893 1.2893 1.6313 1.6313 1.6708 1.6708 1.7481 1.7481 1.9385 1.9385 2.0413 2.0413 2.1924 2.1924 2.5263 2.5263 2.6912 2.6912 2.7301 2.7301 2.7705 2.7705 2.9818 2.9818 3.0947 3.0947 3.2670 3.2670 3.3687 3.3687 3.5753 3.5753 3.6188 3.6188 3.7809 3.7809 3.9363 3.9363 4.7197 4.7197 5.6712 5.6712 9.7378 9.7378 11.4822 11.4822 11.8195 11.8195 12.2441 12.2441 12.4251 12.4251 12.5457 12.5457 13.5100 13.5100 k =-0.1924 0.1787 0.2626 ( 14603 PWs) bands (ev): -16.9921 -16.9921 -16.8528 -16.8528 -16.3708 -16.3708 -16.3259 -16.3259 -16.2614 -16.2614 -16.2504 -16.2504 -12.7092 -12.7092 -12.6840 -12.6840 -1.9111 -1.9111 -1.6023 -1.6023 -1.2021 -1.2021 -0.9122 -0.9122 -0.6868 -0.6868 -0.4725 -0.4725 -0.2354 -0.2354 -0.0330 -0.0330 0.0900 0.0900 0.7953 0.7953 0.8644 0.8644 0.9556 0.9556 0.9950 0.9950 1.2951 1.2951 1.6591 1.6591 1.6776 1.6776 1.7637 1.7637 1.9573 1.9573 2.0547 2.0547 2.1894 2.1894 2.5368 2.5368 2.6901 2.6901 2.7355 2.7355 2.7765 2.7765 2.9731 2.9731 3.0842 3.0842 3.2508 3.2508 3.3554 3.3554 3.5942 3.5942 3.6333 3.6333 3.7918 3.7918 3.8782 3.8782 4.7786 4.7786 5.6928 5.6928 9.6493 9.6493 11.4839 11.4839 11.7826 11.7826 12.1805 12.1805 12.3689 12.3689 12.4691 12.4691 13.5468 13.5468 k =-0.1823 0.1693 0.2488 ( 14601 PWs) bands (ev): -16.9936 -16.9936 -16.8525 -16.8525 -16.3741 -16.3741 -16.3220 -16.3220 -16.2615 -16.2615 -16.2503 -16.2503 -12.7076 -12.7076 -12.6824 -12.6824 -1.9278 -1.9278 -1.6040 -1.6040 -1.2017 -1.2017 -0.9351 -0.9351 -0.7269 -0.7269 -0.4750 -0.4750 -0.2469 -0.2469 -0.0461 -0.0461 0.0722 0.0722 0.8001 0.8001 0.8974 0.8974 0.9808 0.9808 1.0258 1.0258 1.3011 1.3011 1.6785 1.6785 1.6908 1.6908 1.7792 1.7792 1.9787 1.9787 2.0681 2.0681 2.1870 2.1870 2.5470 2.5470 2.6870 2.6870 2.7396 2.7396 2.7838 2.7838 2.9646 2.9646 3.0739 3.0739 3.2342 3.2342 3.3419 3.3419 3.6118 3.6118 3.6480 3.6480 3.7996 3.7996 3.8231 3.8231 4.8360 4.8360 5.7144 5.7144 9.5626 9.5626 11.4851 11.4851 11.7457 11.7457 12.1182 12.1182 12.3102 12.3102 12.3953 12.3953 13.5860 13.5860 k =-0.1722 0.1599 0.2350 ( 14603 PWs) bands (ev): -16.9951 -16.9951 -16.8522 -16.8522 -16.3773 -16.3773 -16.3180 -16.3180 -16.2616 -16.2616 -16.2502 -16.2502 -12.7061 -12.7061 -12.6809 -12.6809 -1.9443 -1.9443 -1.6058 -1.6058 -1.2014 -1.2014 -0.9573 -0.9573 -0.7658 -0.7658 -0.4777 -0.4777 -0.2582 -0.2582 -0.0599 -0.0599 0.0529 0.0529 0.8051 0.8051 0.9302 0.9302 1.0087 1.0087 1.0590 1.0590 1.3073 1.3073 1.6877 1.6877 1.7123 1.7123 1.7947 1.7947 2.0022 2.0022 2.0813 2.0813 2.1853 2.1853 2.5568 2.5568 2.6823 2.6823 2.7429 2.7429 2.7921 2.7921 2.9564 2.9564 3.0640 3.0640 3.2174 3.2174 3.3283 3.3283 3.6271 3.6271 3.6624 3.6624 3.7593 3.7593 3.8170 3.8170 4.8917 4.8917 5.7356 5.7356 9.4781 9.4781 11.4859 11.4859 11.7092 11.7092 12.0573 12.0573 12.2499 12.2499 12.3244 12.3244 13.6271 13.6271 k =-0.1621 0.1505 0.2211 ( 14595 PWs) bands (ev): -16.9966 -16.9966 -16.8519 -16.8519 -16.3803 -16.3803 -16.3142 -16.3142 -16.2617 -16.2617 -16.2501 -16.2501 -12.7046 -12.7046 -12.6794 -12.6794 -1.9606 -1.9606 -1.6079 -1.6079 -1.2010 -1.2010 -0.9785 -0.9785 -0.8034 -0.8034 -0.4805 -0.4805 -0.2692 -0.2692 -0.0743 -0.0743 0.0324 0.0324 0.8102 0.8102 0.9624 0.9624 1.0389 1.0389 1.0943 1.0943 1.3138 1.3138 1.6956 1.6956 1.7329 1.7329 1.8100 1.8100 2.0270 2.0270 2.0943 2.0943 2.1844 2.1844 2.5663 2.5663 2.6760 2.6760 2.7456 2.7456 2.8009 2.8009 2.9484 2.9484 3.0544 3.0544 3.2005 3.2005 3.3145 3.3145 3.6357 3.6357 3.6751 3.6751 3.7100 3.7100 3.8273 3.8273 4.9456 4.9456 5.7563 5.7563 9.3961 9.3961 11.4862 11.4862 11.6734 11.6734 11.9982 11.9982 12.1888 12.1888 12.2566 12.2566 13.6697 13.6697 k =-0.1519 0.1411 0.2073 ( 14621 PWs) bands (ev): -16.9980 -16.9980 -16.8517 -16.8517 -16.3832 -16.3832 -16.3104 -16.3104 -16.2619 -16.2619 -16.2500 -16.2500 -12.7032 -12.7032 -12.6779 -12.6779 -1.9765 -1.9765 -1.6101 -1.6101 -1.2006 -1.2006 -0.9988 -0.9988 -0.8393 -0.8393 -0.4833 -0.4833 -0.2797 -0.2797 -0.0888 -0.0888 0.0114 0.0114 0.8153 0.8153 0.9936 0.9936 1.0710 1.0710 1.1311 1.1311 1.3207 1.3207 1.7035 1.7035 1.7516 1.7516 1.8251 1.8251 2.0519 2.0519 2.1074 2.1074 2.1844 2.1844 2.5753 2.5753 2.6686 2.6686 2.7481 2.7481 2.8098 2.8098 2.9408 2.9408 3.0453 3.0453 3.1835 3.1835 3.3005 3.3005 3.6151 3.6151 3.6788 3.6788 3.6975 3.6975 3.8380 3.8380 4.9973 4.9973 5.7764 5.7764 9.3171 9.3171 11.4860 11.4860 11.6384 11.6384 11.9411 11.9411 12.1279 12.1279 12.1920 12.1920 13.7130 13.7130 k =-0.1418 0.1317 0.1935 ( 14615 PWs) bands (ev): -16.9994 -16.9994 -16.8515 -16.8515 -16.3860 -16.3860 -16.3068 -16.3068 -16.2621 -16.2621 -16.2500 -16.2500 -12.7018 -12.7018 -12.6764 -12.6764 -1.9919 -1.9919 -1.6124 -1.6124 -1.2003 -1.2003 -1.0182 -1.0182 -0.8734 -0.8734 -0.4861 -0.4861 -0.2899 -0.2899 -0.1033 -0.1033 -0.0098 -0.0098 0.8203 0.8203 1.0235 1.0235 1.1044 1.1044 1.1691 1.1691 1.3280 1.3280 1.7116 1.7116 1.7686 1.7686 1.8398 1.8398 2.0756 2.0756 2.1207 2.1207 2.1857 2.1857 2.5841 2.5841 2.6600 2.6600 2.7509 2.7509 2.8185 2.8185 2.9338 2.9338 3.0364 3.0364 3.1667 3.1667 3.2861 3.2861 3.5655 3.5655 3.6870 3.6870 3.7092 3.7092 3.8484 3.8484 5.0468 5.0468 5.7957 5.7957 9.2412 9.2412 11.4852 11.4852 11.6045 11.6045 11.8862 11.8862 12.0679 12.0679 12.1308 12.1308 13.7566 13.7566 k =-0.1317 0.1222 0.1797 ( 14629 PWs) bands (ev): -17.0007 -17.0007 -16.8513 -16.8513 -16.3886 -16.3886 -16.3032 -16.3032 -16.2623 -16.2623 -16.2499 -16.2499 -12.7004 -12.7004 -12.6750 -12.6750 -2.0067 -2.0067 -1.6147 -1.6147 -1.2001 -1.2001 -1.0364 -1.0364 -0.9056 -0.9056 -0.4889 -0.4889 -0.2995 -0.2995 -0.1176 -0.1176 -0.0310 -0.0310 0.8252 0.8252 1.0517 1.0517 1.1386 1.1386 1.2080 1.2080 1.3359 1.3359 1.7198 1.7198 1.7839 1.7839 1.8540 1.8540 2.0969 2.0969 2.1345 2.1345 2.1884 2.1884 2.5927 2.5927 2.6504 2.6504 2.7539 2.7539 2.8265 2.8265 2.9276 2.9276 3.0280 3.0280 3.1501 3.1501 3.2709 3.2709 3.5114 3.5114 3.6986 3.6986 3.7223 3.7223 3.8586 3.8586 5.0938 5.0938 5.8140 5.8140 9.1689 9.1689 11.4839 11.4839 11.5721 11.5721 11.8338 11.8338 12.0093 12.0093 12.0732 12.0732 13.8000 13.8000 k =-0.1215 0.1128 0.1659 ( 14629 PWs) bands (ev): -17.0020 -17.0020 -16.8511 -16.8511 -16.3911 -16.3911 -16.2998 -16.2998 -16.2626 -16.2626 -16.2499 -16.2499 -12.6991 -12.6991 -12.6736 -12.6736 -2.0208 -2.0208 -1.6171 -1.6171 -1.2000 -1.2000 -1.0536 -1.0536 -0.9356 -0.9356 -0.4916 -0.4916 -0.3084 -0.3084 -0.1313 -0.1313 -0.0517 -0.0517 0.8299 0.8299 1.0778 1.0778 1.1732 1.1732 1.2472 1.2472 1.3444 1.3444 1.7279 1.7279 1.7977 1.7977 1.8672 1.8672 2.1149 2.1149 2.1487 2.1487 2.1932 2.1932 2.6010 2.6010 2.6401 2.6401 2.7575 2.7575 2.8334 2.8334 2.9225 2.9225 3.0199 3.0199 3.1339 3.1339 3.2543 3.2543 3.4587 3.4587 3.7105 3.7105 3.7351 3.7351 3.8682 3.8682 5.1382 5.1382 5.8314 5.8314 9.1005 9.1005 11.4821 11.4821 11.5414 11.5414 11.7841 11.7841 11.9528 11.9528 12.0193 12.0193 13.8421 13.8421 k =-0.1114 0.1034 0.1520 ( 14629 PWs) bands (ev): -17.0032 -17.0032 -16.8509 -16.8509 -16.3933 -16.3933 -16.2965 -16.2965 -16.2629 -16.2629 -16.2500 -16.2500 -12.6979 -12.6979 -12.6723 -12.6723 -2.0342 -2.0342 -1.6195 -1.6195 -1.1999 -1.1999 -1.0697 -1.0697 -0.9633 -0.9633 -0.4941 -0.4941 -0.3168 -0.3168 -0.1445 -0.1445 -0.0717 -0.0717 0.8344 0.8344 1.1016 1.1016 1.2077 1.2077 1.2865 1.2865 1.3535 1.3535 1.7359 1.7359 1.8102 1.8102 1.8795 1.8795 2.1298 2.1298 2.1621 2.1621 2.2004 2.2004 2.6093 2.6093 2.6293 2.6293 2.7614 2.7614 2.8388 2.8388 2.9190 2.9190 3.0121 3.0121 3.1182 3.1182 3.2353 3.2353 3.4099 3.4099 3.7218 3.7218 3.7472 3.7472 3.8774 3.8774 5.1797 5.1797 5.8476 5.8476 9.0363 9.0363 11.4795 11.4795 11.5127 11.5127 11.7375 11.7375 11.8990 11.8990 11.9691 11.9691 13.8416 13.8416 k =-0.1013 0.0940 0.1382 ( 14621 PWs) bands (ev): -17.0044 -17.0044 -16.8507 -16.8507 -16.3954 -16.3954 -16.2934 -16.2934 -16.2633 -16.2633 -16.2501 -16.2501 -12.6967 -12.6967 -12.6711 -12.6711 -2.0467 -2.0467 -1.6218 -1.6218 -1.1999 -1.1999 -1.0847 -1.0847 -0.9886 -0.9886 -0.4966 -0.4966 -0.3244 -0.3244 -0.1569 -0.1569 -0.0908 -0.0908 0.8385 0.8385 1.1229 1.1229 1.2416 1.2416 1.3255 1.3255 1.3631 1.3631 1.7437 1.7437 1.8214 1.8214 1.8904 1.8904 2.1423 2.1423 2.1738 2.1738 2.2100 2.2100 2.6158 2.6158 2.6199 2.6199 2.7657 2.7657 2.8421 2.8421 2.9175 2.9175 3.0046 3.0046 3.1032 3.1032 3.2127 3.2127 3.3671 3.3671 3.7324 3.7324 3.7586 3.7586 3.8860 3.8860 5.2183 5.2183 5.8627 5.8627 8.9765 8.9765 11.4746 11.4746 11.4879 11.4879 11.6941 11.6941 11.8484 11.8484 11.9229 11.9229 13.7904 13.7904 k =-0.0912 0.0846 0.1244 ( 14625 PWs) bands (ev): -17.0054 -17.0054 -16.8506 -16.8506 -16.3973 -16.3973 -16.2904 -16.2904 -16.2636 -16.2636 -16.2502 -16.2502 -12.6957 -12.6957 -12.6699 -12.6699 -2.0584 -2.0584 -1.6240 -1.6240 -1.2001 -1.2001 -1.0985 -1.0985 -1.0114 -1.0114 -0.4989 -0.4989 -0.3313 -0.3313 -0.1684 -0.1684 -0.1087 -0.1087 0.8424 0.8424 1.1415 1.1415 1.2743 1.2743 1.3634 1.3634 1.3735 1.3735 1.7511 1.7511 1.8311 1.8311 1.9000 1.9000 2.1535 2.1535 2.1838 2.1838 2.2206 2.2206 2.6059 2.6059 2.6269 2.6269 2.7698 2.7698 2.8432 2.8432 2.9180 2.9180 2.9975 2.9975 3.0889 3.0889 3.1855 3.1855 3.3321 3.3321 3.7421 3.7421 3.7691 3.7691 3.8940 3.8940 5.2537 5.2537 5.8765 5.8765 8.9215 8.9215 11.4577 11.4577 11.4767 11.4767 11.6543 11.6543 11.8013 11.8013 11.8807 11.8807 13.7438 13.7438 k =-0.0810 0.0752 0.1106 ( 14611 PWs) bands (ev): -17.0064 -17.0064 -16.8505 -16.8505 -16.3990 -16.3990 -16.2875 -16.2875 -16.2640 -16.2640 -16.2503 -16.2503 -12.6947 -12.6947 -12.6688 -12.6688 -2.0690 -2.0690 -1.6261 -1.6261 -1.2004 -1.2004 -1.1112 -1.1112 -1.0316 -1.0316 -0.5010 -0.5010 -0.3373 -0.3373 -0.1790 -0.1790 -0.1254 -0.1254 0.8460 0.8460 1.1576 1.1576 1.3053 1.3053 1.3829 1.3829 1.4015 1.4015 1.7581 1.7581 1.8392 1.8392 1.9082 1.9082 2.1641 2.1641 2.1927 2.1927 2.2309 2.2309 2.5944 2.5944 2.6359 2.6359 2.7733 2.7733 2.8425 2.8425 2.9200 2.9200 2.9907 2.9907 3.0755 3.0755 3.1545 3.1545 3.3052 3.3052 3.7509 3.7509 3.7787 3.7787 3.9013 3.9013 5.2857 5.2857 5.8890 5.8890 8.8715 8.8715 11.4361 11.4361 11.4721 11.4721 11.6184 11.6184 11.7581 11.7581 11.8426 11.8426 13.7022 13.7022 k =-0.0709 0.0658 0.0967 ( 14603 PWs) bands (ev): -17.0073 -17.0073 -16.8503 -16.8503 -16.4005 -16.4005 -16.2849 -16.2849 -16.2645 -16.2645 -16.2505 -16.2505 -12.6938 -12.6938 -12.6679 -12.6679 -2.0785 -2.0785 -1.6281 -1.6281 -1.2008 -1.2008 -1.1227 -1.1227 -1.0491 -1.0491 -0.5029 -0.5029 -0.3426 -0.3426 -0.1886 -0.1886 -0.1405 -0.1405 0.8491 0.8491 1.1711 1.1711 1.3343 1.3343 1.3931 1.3931 1.4369 1.4369 1.7645 1.7645 1.8457 1.8457 1.9149 1.9149 2.1743 2.1743 2.2011 2.2011 2.2396 2.2396 2.5832 2.5832 2.6454 2.6454 2.7756 2.7756 2.8406 2.8406 2.9224 2.9224 2.9847 2.9847 3.0630 3.0630 3.1221 3.1221 3.2851 3.2851 3.7587 3.7587 3.7873 3.7873 3.9078 3.9078 5.3144 5.3144 5.9001 5.9001 8.8268 8.8268 11.4163 11.4163 11.4677 11.4677 11.5867 11.5867 11.7193 11.7193 11.8086 11.8086 13.6656 13.6656 k =-0.0608 0.0564 0.0829 ( 14607 PWs) bands (ev): -17.0080 -17.0080 -16.8502 -16.8502 -16.4019 -16.4019 -16.2824 -16.2824 -16.2650 -16.2650 -16.2506 -16.2506 -12.6930 -12.6930 -12.6670 -12.6670 -2.0869 -2.0869 -1.6298 -1.6298 -1.2014 -1.2014 -1.1329 -1.1329 -1.0640 -1.0640 -0.5046 -0.5046 -0.3470 -0.3470 -0.1970 -0.1970 -0.1540 -0.1540 0.8519 0.8519 1.1823 1.1823 1.3606 1.3606 1.4028 1.4028 1.4704 1.4704 1.7703 1.7703 1.8505 1.8505 1.9201 1.9201 2.1845 2.1845 2.2091 2.2091 2.2465 2.2465 2.5725 2.5725 2.6554 2.6554 2.7762 2.7762 2.8377 2.8377 2.9238 2.9238 2.9800 2.9800 3.0515 3.0515 3.0917 3.0917 3.2699 3.2699 3.7655 3.7655 3.7948 3.7948 3.9135 3.9135 5.3395 5.3395 5.9099 5.9099 8.7875 8.7875 11.3989 11.3989 11.4626 11.4626 11.5598 11.5598 11.6852 11.6852 11.7790 11.7790 13.6341 13.6341 k =-0.0506 0.0470 0.0691 ( 14595 PWs) bands (ev): -17.0087 -17.0087 -16.8502 -16.8502 -16.4030 -16.4030 -16.2801 -16.2801 -16.2656 -16.2656 -16.2508 -16.2508 -12.6924 -12.6924 -12.6663 -12.6663 -2.0941 -2.0941 -1.6314 -1.6314 -1.2020 -1.2020 -1.1419 -1.1419 -1.0762 -1.0762 -0.5060 -0.5060 -0.3507 -0.3507 -0.2043 -0.2043 -0.1657 -0.1657 0.8544 0.8544 1.1913 1.1913 1.3838 1.3838 1.4118 1.4118 1.5009 1.5009 1.7753 1.7753 1.8536 1.8536 1.9241 1.9241 2.1946 2.1946 2.2166 2.2166 2.2512 2.2512 2.5627 2.5627 2.6662 2.6662 2.7749 2.7749 2.8333 2.8333 2.9228 2.9228 2.9777 2.9777 3.0410 3.0410 3.0658 3.0658 3.2581 3.2581 3.7712 3.7712 3.8013 3.8013 3.9185 3.9185 5.3609 5.3609 5.9182 5.9182 8.7539 8.7539 11.3841 11.3841 11.4567 11.4567 11.5381 11.5381 11.6559 11.6559 11.7537 11.7537 13.6076 13.6076 k =-0.0405 0.0376 0.0553 ( 14591 PWs) bands (ev): -17.0092 -17.0092 -16.8501 -16.8501 -16.4039 -16.4039 -16.2780 -16.2780 -16.2663 -16.2663 -16.2510 -16.2510 -12.6918 -12.6918 -12.6657 -12.6657 -2.1001 -2.1001 -1.6327 -1.6327 -1.2026 -1.2026 -1.1494 -1.1494 -1.0859 -1.0859 -0.5072 -0.5072 -0.3536 -0.3536 -0.2103 -0.2103 -0.1754 -0.1754 0.8564 0.8564 1.1984 1.1984 1.4035 1.4035 1.4196 1.4196 1.5279 1.5279 1.7795 1.7795 1.8553 1.8553 1.9270 1.9270 2.2045 2.2045 2.2232 2.2232 2.2540 2.2540 2.5541 2.5541 2.6778 2.6778 2.7721 2.7721 2.8262 2.8262 2.9198 2.9198 2.9783 2.9783 3.0314 3.0314 3.0461 3.0461 3.2490 3.2490 3.7760 3.7760 3.8066 3.8066 3.9225 3.9225 5.3785 5.3785 5.9250 5.9250 8.7262 8.7262 11.3720 11.3720 11.4500 11.4500 11.5216 11.5216 11.6317 11.6317 11.7328 11.7328 13.5859 13.5859 k =-0.0304 0.0282 0.0415 ( 14589 PWs) bands (ev): -17.0096 -17.0096 -16.8501 -16.8501 -16.4046 -16.4046 -16.2762 -16.2762 -16.2671 -16.2671 -16.2511 -16.2511 -12.6914 -12.6914 -12.6652 -12.6652 -2.1048 -2.1048 -1.6337 -1.6337 -1.2031 -1.2031 -1.1554 -1.1554 -1.0933 -1.0933 -0.5082 -0.5082 -0.3558 -0.3558 -0.2151 -0.2151 -0.1831 -0.1831 0.8579 0.8579 1.2036 1.2036 1.4191 1.4191 1.4261 1.4261 1.5503 1.5503 1.7828 1.7828 1.8557 1.8557 1.9289 1.9289 2.2139 2.2139 2.2287 2.2287 2.2550 2.2550 2.5470 2.5470 2.6900 2.6900 2.7684 2.7684 2.8158 2.8158 2.9165 2.9165 2.9811 2.9811 3.0229 3.0229 3.0324 3.0324 3.2420 3.2420 3.7797 3.7797 3.8107 3.8107 3.9257 3.9257 5.3923 5.3923 5.9304 5.9304 8.7044 8.7044 11.3626 11.3626 11.4431 11.4431 11.5102 11.5102 11.6128 11.6128 11.7165 11.7165 13.5692 13.5692 k =-0.0203 0.0188 0.0276 ( 14603 PWs) bands (ev): -17.0100 -17.0100 -16.8500 -16.8500 -16.4052 -16.4052 -16.2746 -16.2746 -16.2678 -16.2678 -16.2512 -16.2512 -12.6911 -12.6911 -12.6648 -12.6648 -2.1081 -2.1081 -1.6345 -1.6345 -1.2036 -1.2036 -1.1598 -1.1598 -1.0984 -1.0984 -0.5089 -0.5089 -0.3573 -0.3573 -0.2186 -0.2186 -0.1886 -0.1886 0.8591 0.8591 1.2073 1.2073 1.4294 1.4294 1.4320 1.4320 1.5673 1.5673 1.7851 1.7851 1.8555 1.8555 1.9301 1.9301 2.2222 2.2222 2.2326 2.2326 2.2546 2.2546 2.5418 2.5418 2.7025 2.7025 2.7643 2.7643 2.8036 2.8036 2.9144 2.9144 2.9848 2.9848 3.0161 3.0161 3.0235 3.0235 3.2371 3.2371 3.7823 3.7823 3.8137 3.8137 3.9280 3.9280 5.4022 5.4022 5.9342 5.9342 8.6888 8.6888 11.3560 11.3560 11.4370 11.4370 11.5029 11.5029 11.5993 11.5993 11.7048 11.7048 13.5572 13.5572 k =-0.0101 0.0094 0.0138 ( 14593 PWs) bands (ev): -17.0101 -17.0101 -16.8500 -16.8500 -16.4055 -16.4055 -16.2734 -16.2734 -16.2686 -16.2686 -16.2513 -16.2513 -12.6909 -12.6909 -12.6646 -12.6646 -2.1102 -2.1102 -1.6349 -1.6349 -1.2039 -1.2039 -1.1625 -1.1625 -1.1014 -1.1014 -0.5093 -0.5093 -0.3582 -0.3582 -0.2207 -0.2207 -0.1920 -0.1920 0.8597 0.8597 1.2094 1.2094 1.4331 1.4331 1.4383 1.4383 1.5780 1.5780 1.7866 1.7866 1.8550 1.8550 1.9308 1.9308 2.2289 2.2289 2.2343 2.2343 2.2536 2.2536 2.5385 2.5385 2.7134 2.7134 2.7601 2.7601 2.7933 2.7933 2.9134 2.9134 2.9881 2.9881 3.0116 3.0116 3.0181 3.0181 3.2341 3.2341 3.7839 3.7839 3.8155 3.8155 3.9294 3.9294 5.4082 5.4082 5.9365 5.9365 8.6794 8.6794 11.3520 11.3520 11.4329 11.4329 11.4990 11.4990 11.5912 11.5912 11.6977 11.6977 13.5501 13.5501 k = 0.0000 0.0000 0.0000 ( 14599 PWs) bands (ev): -17.0102 -17.0102 -16.8500 -16.8500 -16.4056 -16.4056 -16.2729 -16.2729 -16.2689 -16.2689 -16.2513 -16.2513 -12.6908 -12.6908 -12.6646 -12.6646 -2.1108 -2.1108 -1.6351 -1.6351 -1.2040 -1.2040 -1.1634 -1.1634 -1.1024 -1.1024 -0.5094 -0.5094 -0.3585 -0.3585 -0.2215 -0.2215 -0.1931 -0.1931 0.8600 0.8600 1.2101 1.2101 1.4341 1.4341 1.4406 1.4406 1.5816 1.5816 1.7871 1.7871 1.8548 1.8548 1.9310 1.9310 2.2326 2.2326 2.2337 2.2337 2.2530 2.2530 2.5374 2.5374 2.7184 2.7184 2.7577 2.7577 2.7892 2.7892 2.9132 2.9132 2.9895 2.9895 3.0100 3.0100 3.0163 3.0163 3.2331 3.2331 3.7845 3.7845 3.8161 3.8161 3.9298 3.9298 5.4102 5.4102 5.9373 5.9373 8.6763 8.6763 11.3506 11.3506 11.4314 11.4314 11.4977 11.4977 11.5884 11.5884 11.6954 11.6954 13.5477 13.5477 k = 0.0000 0.0000 0.0000 ( 14599 PWs) bands (ev): -17.0102 -17.0102 -16.8500 -16.8500 -16.4056 -16.4056 -16.2729 -16.2729 -16.2689 -16.2689 -16.2513 -16.2513 -12.6908 -12.6908 -12.6646 -12.6646 -2.1108 -2.1108 -1.6351 -1.6351 -1.2040 -1.2040 -1.1634 -1.1634 -1.1024 -1.1024 -0.5094 -0.5094 -0.3585 -0.3585 -0.2215 -0.2215 -0.1931 -0.1931 0.8600 0.8600 1.2101 1.2101 1.4341 1.4341 1.4406 1.4406 1.5816 1.5816 1.7871 1.7871 1.8548 1.8548 1.9310 1.9310 2.2326 2.2326 2.2337 2.2337 2.2530 2.2530 2.5374 2.5374 2.7184 2.7184 2.7577 2.7577 2.7892 2.7892 2.9132 2.9132 2.9895 2.9895 3.0100 3.0100 3.0163 3.0163 3.2331 3.2331 3.7845 3.7845 3.8161 3.8161 3.9298 3.9298 5.4102 5.4102 5.9373 5.9373 8.6763 8.6763 11.3506 11.3506 11.4314 11.4314 11.4977 11.4977 11.5884 11.5884 11.6954 11.6954 13.5477 13.5477 k = 0.0135 0.0146 0.0000 ( 14595 PWs) bands (ev): -17.0100 -17.0100 -16.8502 -16.8502 -16.4056 -16.4056 -16.2729 -16.2729 -16.2689 -16.2689 -16.2513 -16.2513 -12.6908 -12.6908 -12.6647 -12.6647 -2.1100 -2.1100 -1.6350 -1.6350 -1.2018 -1.2018 -1.1621 -1.1621 -1.1014 -1.1014 -0.5089 -0.5089 -0.3593 -0.3593 -0.2211 -0.2211 -0.1931 -0.1931 0.8534 0.8534 1.2103 1.2103 1.4341 1.4341 1.4401 1.4401 1.5815 1.5815 1.7864 1.7864 1.8542 1.8542 1.9271 1.9271 2.2057 2.2057 2.2376 2.2376 2.2816 2.2816 2.5371 2.5371 2.7151 2.7151 2.7629 2.7629 2.7889 2.7889 2.9122 2.9122 2.9876 2.9876 3.0122 3.0122 3.0172 3.0172 3.2331 3.2331 3.7837 3.7837 3.8155 3.8155 3.9293 3.9293 5.4107 5.4107 5.9342 5.9342 8.6796 8.6796 11.3542 11.3542 11.4341 11.4341 11.5005 11.5005 11.5861 11.5861 11.6979 11.6979 13.5506 13.5506 k = 0.0270 0.0291 0.0000 ( 14583 PWs) bands (ev): -17.0092 -17.0092 -16.8508 -16.8508 -16.4056 -16.4056 -16.2728 -16.2728 -16.2689 -16.2689 -16.2514 -16.2514 -12.6909 -12.6909 -12.6651 -12.6651 -2.1075 -2.1075 -1.6347 -1.6347 -1.1953 -1.1953 -1.1581 -1.1581 -1.0986 -1.0986 -0.5076 -0.5076 -0.3618 -0.3618 -0.2200 -0.2200 -0.1930 -0.1930 0.8339 0.8339 1.2108 1.2108 1.4341 1.4341 1.4388 1.4388 1.5811 1.5811 1.7843 1.7843 1.8521 1.8521 1.9161 1.9161 2.1708 2.1708 2.2517 2.2517 2.3181 2.3181 2.5360 2.5360 2.7080 2.7080 2.7747 2.7747 2.7883 2.7883 2.9090 2.9090 2.9831 2.9831 3.0147 3.0147 3.0234 3.0234 3.2330 3.2330 3.7815 3.7815 3.8135 3.8135 3.9275 3.9275 5.4121 5.4121 5.9251 5.9251 8.6895 8.6895 11.3648 11.3648 11.4421 11.4421 11.5090 11.5090 11.5797 11.5797 11.7050 11.7050 13.5592 13.5592 k = 0.0405 0.0437 0.0000 ( 14591 PWs) bands (ev): -17.0080 -17.0080 -16.8519 -16.8519 -16.4056 -16.4056 -16.2728 -16.2728 -16.2690 -16.2690 -16.2514 -16.2514 -12.6911 -12.6911 -12.6657 -12.6657 -2.1034 -2.1034 -1.6343 -1.6343 -1.1846 -1.1846 -1.1515 -1.1515 -1.0937 -1.0937 -0.5052 -0.5052 -0.3658 -0.3658 -0.2183 -0.2183 -0.1929 -0.1929 0.8025 0.8025 1.2117 1.2117 1.4340 1.4340 1.4366 1.4366 1.5804 1.5804 1.7808 1.7808 1.8485 1.8485 1.8994 1.8994 2.1371 2.1371 2.2735 2.2735 2.3546 2.3546 2.5343 2.5343 2.6999 2.6999 2.7856 2.7856 2.7899 2.7899 2.9039 2.9039 2.9770 2.9770 3.0158 3.0158 3.0370 3.0370 3.2329 3.2329 3.7779 3.7779 3.8101 3.8101 3.9247 3.9247 5.4145 5.4145 5.9099 5.9099 8.7061 8.7061 11.3824 11.3824 11.4549 11.4549 11.5230 11.5230 11.5705 11.5705 11.7157 11.7157 13.5734 13.5734 k = 0.0541 0.0582-0.0000 ( 14599 PWs) bands (ev): -17.0063 -17.0063 -16.8533 -16.8533 -16.4056 -16.4056 -16.2727 -16.2727 -16.2691 -16.2691 -16.2515 -16.2515 -12.6912 -12.6912 -12.6667 -12.6667 -2.0977 -2.0977 -1.6337 -1.6337 -1.1699 -1.1699 -1.1423 -1.1423 -1.0866 -1.0866 -0.5020 -0.5020 -0.3713 -0.3713 -0.2161 -0.2161 -0.1927 -0.1927 0.7606 0.7606 1.2128 1.2128 1.4335 1.4335 1.4341 1.4341 1.5794 1.5794 1.7759 1.7759 1.8433 1.8433 1.8786 1.8786 2.1054 2.1054 2.3008 2.3008 2.3904 2.3904 2.5320 2.5320 2.6915 2.6915 2.7844 2.7844 2.8014 2.8014 2.8970 2.8970 2.9699 2.9699 3.0171 3.0171 3.0580 3.0580 3.2328 3.2328 3.7729 3.7729 3.8055 3.8055 3.9207 3.9207 5.4178 5.4178 5.8887 5.8887 8.7291 8.7291 11.4068 11.4068 11.4713 11.4713 11.5427 11.5427 11.5607 11.5607 11.7293 11.7293 13.5931 13.5931 k = 0.0676 0.0728-0.0000 ( 14587 PWs) bands (ev): -17.0041 -17.0041 -16.8552 -16.8552 -16.4056 -16.4056 -16.2725 -16.2725 -16.2692 -16.2692 -16.2517 -16.2517 -12.6915 -12.6915 -12.6678 -12.6678 -2.0904 -2.0904 -1.6330 -1.6330 -1.1517 -1.1517 -1.1304 -1.1304 -1.0768 -1.0768 -0.4979 -0.4979 -0.3782 -0.3782 -0.2135 -0.2135 -0.1924 -0.1924 0.7097 0.7097 1.2140 1.2140 1.4302 1.4302 1.4335 1.4335 1.5781 1.5781 1.7693 1.7693 1.8360 1.8360 1.8552 1.8552 2.0762 2.0762 2.3321 2.3321 2.4248 2.4248 2.5290 2.5290 2.6826 2.6826 2.7816 2.7816 2.8094 2.8094 2.8885 2.8885 2.9621 2.9621 3.0191 3.0191 3.0877 3.0877 3.2327 3.2327 3.7664 3.7664 3.7995 3.7995 3.9157 3.9157 5.4220 5.4220 5.8616 5.8616 8.7585 8.7585 11.4381 11.4381 11.4873 11.4873 11.5550 11.5550 11.5679 11.5679 11.7452 11.7452 13.6181 13.6181 k = 0.0811 0.0873 0.0000 ( 14571 PWs) bands (ev): -17.0015 -17.0015 -16.8574 -16.8574 -16.4056 -16.4056 -16.2724 -16.2724 -16.2694 -16.2694 -16.2518 -16.2518 -12.6918 -12.6918 -12.6692 -12.6692 -2.0816 -2.0816 -1.6321 -1.6321 -1.1309 -1.1309 -1.1160 -1.1160 -1.0637 -1.0637 -0.4930 -0.4930 -0.3864 -0.3864 -0.2107 -0.2107 -0.1918 -0.1918 0.6516 0.6516 1.2155 1.2155 1.4262 1.4262 1.4327 1.4327 1.5764 1.5764 1.7610 1.7610 1.8265 1.8265 1.8305 1.8305 2.0502 2.0502 2.3655 2.3655 2.4573 2.4573 2.5256 2.5256 2.6730 2.6730 2.7777 2.7777 2.8120 2.8120 2.8787 2.8787 2.9537 2.9537 3.0221 3.0221 3.1262 3.1262 3.2326 3.2326 3.7586 3.7586 3.7923 3.7923 3.9097 3.9097 5.4272 5.4272 5.8286 5.8286 8.7942 8.7942 11.4759 11.4759 11.4926 11.4926 11.5640 11.5640 11.5985 11.5985 11.7633 11.7633 13.6482 13.6482 k = 0.0946 0.1019-0.0000 ( 14587 PWs) bands (ev): -16.9984 -16.9984 -16.8600 -16.8600 -16.4056 -16.4056 -16.2722 -16.2722 -16.2696 -16.2696 -16.2520 -16.2520 -12.6921 -12.6921 -12.6708 -12.6708 -2.0714 -2.0714 -1.6311 -1.6311 -1.1090 -1.1090 -1.0989 -1.0989 -1.0458 -1.0458 -0.4872 -0.4872 -0.3959 -0.3959 -0.2080 -0.2080 -0.1910 -0.1910 0.5879 0.5879 1.2169 1.2169 1.4215 1.4215 1.4316 1.4316 1.5743 1.5743 1.7505 1.7505 1.8057 1.8057 1.8149 1.8149 2.0279 2.0279 2.3999 2.3999 2.4868 2.4868 2.5221 2.5221 2.6626 2.6626 2.7727 2.7727 2.8091 2.8091 2.8679 2.8679 2.9453 2.9453 3.0266 3.0266 3.1726 3.1726 3.2324 3.2324 3.7495 3.7495 3.7838 3.7838 3.9028 3.9028 5.4332 5.4332 5.7899 5.7899 8.8360 8.8360 11.4836 11.4836 11.5200 11.5200 11.5914 11.5914 11.6344 11.6344 11.7832 11.7832 13.6832 13.6832 k = 0.1081 0.1164-0.0000 ( 14575 PWs) bands (ev): -16.9949 -16.9949 -16.8630 -16.8630 -16.4056 -16.4056 -16.2720 -16.2720 -16.2698 -16.2698 -16.2522 -16.2522 -12.6925 -12.6925 -12.6727 -12.6727 -2.0598 -2.0598 -1.6300 -1.6300 -1.0877 -1.0877 -1.0792 -1.0792 -1.0214 -1.0214 -0.4806 -0.4806 -0.4066 -0.4066 -0.2055 -0.2055 -0.1898 -0.1898 0.5202 0.5202 1.2182 1.2182 1.4164 1.4164 1.4298 1.4298 1.5716 1.5716 1.7372 1.7372 1.7822 1.7822 1.8010 1.8010 2.0092 2.0092 2.4340 2.4340 2.5081 2.5081 2.5231 2.5231 2.6513 2.6513 2.7664 2.7664 2.8012 2.8012 2.8566 2.8566 2.9374 2.9374 3.0330 3.0330 3.2251 3.2251 3.2323 3.2323 3.7392 3.7392 3.7741 3.7741 3.8950 3.8950 5.4400 5.4400 5.7455 5.7455 8.8837 8.8837 11.4677 11.4677 11.5700 11.5700 11.6300 11.6300 11.6757 11.6757 11.8051 11.8051 13.7228 13.7228 k = 0.1216 0.1310 0.0000 ( 14555 PWs) bands (ev): -16.9910 -16.9910 -16.8663 -16.8663 -16.4056 -16.4056 -16.2718 -16.2718 -16.2700 -16.2700 -16.2524 -16.2524 -12.6929 -12.6929 -12.6747 -12.6747 -2.0470 -2.0470 -1.6289 -1.6289 -1.0680 -1.0680 -1.0570 -1.0570 -0.9898 -0.9898 -0.4732 -0.4732 -0.4186 -0.4186 -0.2032 -0.2032 -0.1881 -0.1881 0.4498 0.4498 1.2193 1.2193 1.4107 1.4107 1.4272 1.4272 1.5684 1.5684 1.7203 1.7203 1.7613 1.7613 1.7855 1.7855 1.9943 1.9943 2.4665 2.4665 2.5083 2.5083 2.5408 2.5408 2.6390 2.6390 2.7588 2.7588 2.7893 2.7893 2.8451 2.8451 2.9307 2.9307 3.0417 3.0417 3.2322 3.2322 3.2821 3.2821 3.7277 3.7277 3.7633 3.7633 3.8865 3.8865 5.4477 5.4477 5.6956 5.6956 8.9372 8.9372 11.4489 11.4489 11.6258 11.6258 11.6761 11.6761 11.7221 11.7221 11.8288 11.8288 13.7667 13.7667 k = 0.1351 0.1456-0.0000 ( 14579 PWs) bands (ev): -16.9868 -16.9868 -16.8698 -16.8698 -16.4057 -16.4057 -16.2715 -16.2715 -16.2702 -16.2702 -16.2527 -16.2527 -12.6934 -12.6934 -12.6769 -12.6769 -2.0330 -2.0330 -1.6276 -1.6276 -1.0495 -1.0495 -1.0322 -1.0322 -0.9516 -0.9516 -0.4651 -0.4651 -0.4321 -0.4321 -0.2014 -0.2014 -0.1859 -0.1859 0.3780 0.3780 1.2199 1.2199 1.4046 1.4046 1.4235 1.4235 1.5646 1.5646 1.7002 1.7002 1.7432 1.7432 1.7692 1.7692 1.9825 1.9825 2.4963 2.4963 2.5034 2.5034 2.5587 2.5587 2.6257 2.6257 2.7499 2.7499 2.7743 2.7743 2.8338 2.8338 2.9258 2.9258 3.0531 3.0531 3.2322 3.2322 3.3419 3.3419 3.7150 3.7150 3.7513 3.7513 3.8774 3.8774 5.4561 5.4561 5.6405 5.6405 8.9963 8.9963 11.4286 11.4286 11.6866 11.6866 11.7282 11.7282 11.7736 11.7736 11.8542 11.8542 13.8147 13.8147 k = 0.1486 0.1601 0.0000 ( 14575 PWs) bands (ev): -16.9821 -16.9821 -16.8737 -16.8737 -16.4058 -16.4058 -16.2713 -16.2713 -16.2705 -16.2705 -16.2530 -16.2530 -12.6939 -12.6939 -12.6793 -12.6793 -2.0179 -2.0179 -1.6264 -1.6264 -1.0313 -1.0313 -1.0050 -1.0050 -0.9077 -0.9077 -0.4564 -0.4564 -0.4471 -0.4471 -0.1998 -0.1998 -0.1832 -0.1832 0.3060 0.3060 1.2199 1.2199 1.3983 1.3983 1.4185 1.4185 1.5602 1.5602 1.6780 1.6780 1.7270 1.7270 1.7527 1.7527 1.9734 1.9734 2.4972 2.4972 2.5224 2.5224 2.5717 2.5717 2.6114 2.6114 2.7402 2.7402 2.7569 2.7569 2.8230 2.8230 2.9239 2.9239 3.0673 3.0673 3.2323 3.2323 3.4033 3.4033 3.7014 3.7014 3.7384 3.7384 3.8677 3.8677 5.4653 5.4653 5.5803 5.5803 9.0606 9.0606 11.4074 11.4074 11.7521 11.7521 11.7859 11.7859 11.8300 11.8300 11.8814 11.8814 13.8666 13.8666 k = 0.1622 0.1747 0.0000 ( 14591 PWs) bands (ev): -16.9772 -16.9772 -16.8778 -16.8778 -16.4059 -16.4059 -16.2710 -16.2710 -16.2707 -16.2707 -16.2532 -16.2532 -12.6945 -12.6945 -12.6819 -12.6819 -2.0018 -2.0018 -1.6251 -1.6251 -1.0128 -1.0128 -0.9752 -0.9752 -0.8592 -0.8592 -0.4639 -0.4639 -0.4470 -0.4470 -0.1983 -0.1983 -0.1803 -0.1803 0.2349 0.2349 1.2189 1.2189 1.3918 1.3918 1.4118 1.4118 1.5553 1.5553 1.6550 1.6550 1.7117 1.7117 1.7370 1.7370 1.9665 1.9665 2.4907 2.4907 2.5429 2.5429 2.5788 2.5788 2.5962 2.5962 2.7300 2.7300 2.7379 2.7379 2.8131 2.8131 2.9259 2.9259 3.0843 3.0843 3.2325 3.2325 3.4651 3.4651 3.6868 3.6868 3.7247 3.7247 3.8577 3.8577 5.4747 5.4747 5.5156 5.5156 9.1300 9.1300 11.3858 11.3858 11.8215 11.8215 11.8486 11.8486 11.8912 11.8912 11.9102 11.9102 13.9220 13.9220 k = 0.1757 0.1892 0.0000 ( 14591 PWs) bands (ev): -16.9720 -16.9720 -16.8821 -16.8821 -16.4060 -16.4060 -16.2711 -16.2711 -16.2706 -16.2706 -16.2535 -16.2535 -12.6951 -12.6951 -12.6846 -12.6846 -1.9849 -1.9849 -1.6239 -1.6239 -0.9938 -0.9938 -0.9431 -0.9431 -0.8066 -0.8066 -0.4829 -0.4829 -0.4371 -0.4371 -0.1967 -0.1967 -0.1771 -0.1771 0.1658 0.1658 1.2167 1.2167 1.3855 1.3855 1.4033 1.4033 1.5500 1.5500 1.6318 1.6318 1.6967 1.6967 1.7225 1.7225 1.9611 1.9611 2.4838 2.4838 2.5565 2.5565 2.5791 2.5791 2.5812 2.5812 2.7167 2.7167 2.7211 2.7211 2.8042 2.8042 2.9325 2.9325 3.1037 3.1037 3.2330 3.2330 3.5263 3.5263 3.6715 3.6715 3.7103 3.7103 3.8474 3.8474 5.4441 5.4441 5.4870 5.4870 9.2042 9.2042 11.3640 11.3640 11.8941 11.8941 11.9161 11.9161 11.9407 11.9407 11.9570 11.9570 13.9807 13.9807 k = 0.1892 0.2038-0.0000 ( 14595 PWs) bands (ev): -16.9665 -16.9665 -16.8865 -16.8865 -16.4061 -16.4061 -16.2714 -16.2714 -16.2703 -16.2703 -16.2538 -16.2538 -12.6956 -12.6956 -12.6874 -12.6874 -1.9672 -1.9672 -1.6227 -1.6227 -0.9740 -0.9740 -0.9086 -0.9086 -0.7504 -0.7504 -0.5043 -0.5043 -0.4267 -0.4267 -0.1948 -0.1948 -0.1739 -0.1739 0.0997 0.0997 1.2130 1.2130 1.3797 1.3797 1.3929 1.3929 1.5445 1.5445 1.6087 1.6087 1.6821 1.6821 1.7095 1.7095 1.9570 1.9570 2.4766 2.4766 2.5564 2.5564 2.5705 2.5705 2.5747 2.5747 2.6964 2.6964 2.7111 2.7111 2.7965 2.7965 2.9442 2.9442 3.1250 3.1250 3.2339 3.2339 3.5852 3.5852 3.6554 3.6554 3.6961 3.6961 3.8371 3.8371 5.3704 5.3704 5.4977 5.4977 9.2830 9.2830 11.3422 11.3422 11.9687 11.9687 11.9716 11.9716 11.9894 11.9894 12.0273 12.0273 14.0425 14.0425 k = 0.2027 0.2183-0.0000 ( 14607 PWs) bands (ev): -16.9607 -16.9607 -16.8911 -16.8911 -16.4063 -16.4063 -16.2717 -16.2717 -16.2700 -16.2700 -16.2542 -16.2542 -12.6963 -12.6963 -12.6902 -12.6902 -1.9489 -1.9489 -1.6217 -1.6217 -0.9535 -0.9535 -0.8718 -0.8718 -0.6912 -0.6912 -0.5287 -0.5287 -0.4160 -0.4160 -0.1922 -0.1922 -0.1706 -0.1706 0.0376 0.0376 1.2076 1.2076 1.3745 1.3745 1.3806 1.3806 1.5390 1.5390 1.5853 1.5853 1.6679 1.6679 1.6981 1.6981 1.9539 1.9539 2.4692 2.4692 2.5407 2.5407 2.5626 2.5626 2.5700 2.5700 2.6760 2.6760 2.7014 2.7014 2.7903 2.7903 2.9607 2.9607 3.1473 3.1473 3.2358 3.2358 3.6355 3.6355 3.6402 3.6402 3.6863 3.6863 3.8273 3.8273 5.2922 5.2922 5.5094 5.5094 9.3661 9.3661 11.3206 11.3206 12.0046 12.0046 12.0448 12.0448 12.0659 12.0659 12.1020 12.1020 14.1070 14.1070 k = 0.2162 0.2329-0.0000 ( 14635 PWs) bands (ev): -16.9548 -16.9548 -16.8959 -16.8959 -16.4065 -16.4065 -16.2721 -16.2721 -16.2697 -16.2697 -16.2545 -16.2545 -12.6969 -12.6969 -12.6932 -12.6932 -1.9302 -1.9302 -1.6207 -1.6207 -0.9322 -0.9322 -0.8327 -0.8327 -0.6298 -0.6298 -0.5564 -0.5564 -0.4048 -0.4048 -0.1886 -0.1886 -0.1673 -0.1673 -0.0196 -0.0196 1.2004 1.2004 1.3659 1.3659 1.3709 1.3709 1.5336 1.5336 1.5614 1.5614 1.6544 1.6544 1.6882 1.6882 1.9515 1.9515 2.4616 2.4616 2.5220 2.5220 2.5482 2.5482 2.5635 2.5635 2.6564 2.6564 2.6912 2.6912 2.7856 2.7856 2.9814 2.9814 3.1691 3.1691 3.2395 3.2395 3.6217 3.6217 3.6509 3.6509 3.7097 3.7097 3.8195 3.8195 5.2101 5.2101 5.5216 5.5216 9.4532 9.4532 11.2994 11.2994 12.0386 12.0386 12.1205 12.1205 12.1470 12.1470 12.1809 12.1809 14.1021 14.1021 k = 0.2297 0.2474 0.0000 ( 14627 PWs) bands (ev): -16.9488 -16.9488 -16.9007 -16.9007 -16.4068 -16.4068 -16.2724 -16.2724 -16.2694 -16.2694 -16.2548 -16.2548 -12.6976 -12.6976 -12.6962 -12.6962 -1.9111 -1.9111 -1.6199 -1.6199 -0.9101 -0.9101 -0.7916 -0.7916 -0.5877 -0.5877 -0.5667 -0.5667 -0.3935 -0.3935 -0.1835 -0.1835 -0.1639 -0.1639 -0.0712 -0.0712 1.1915 1.1915 1.3504 1.3504 1.3676 1.3676 1.5281 1.5281 1.5368 1.5368 1.6420 1.6420 1.6793 1.6793 1.9496 1.9496 2.4538 2.4538 2.5023 2.5023 2.5308 2.5308 2.5517 2.5517 2.6382 2.6382 2.6800 2.6800 2.7821 2.7821 3.0052 3.0052 3.1879 3.1879 3.2467 3.2467 3.6046 3.6046 3.6378 3.6378 3.7495 3.7495 3.8194 3.8194 5.1246 5.1246 5.5343 5.5343 9.5440 9.5440 11.2788 11.2788 12.0735 12.0735 12.1945 12.1945 12.2323 12.2323 12.2637 12.2637 14.0650 14.0650 k = 0.2432 0.2620 0.0000 ( 14607 PWs) bands (ev): -16.9426 -16.9426 -16.9055 -16.9055 -16.4071 -16.4071 -16.2727 -16.2727 -16.2691 -16.2691 -16.2552 -16.2552 -12.6993 -12.6993 -12.6982 -12.6982 -1.8918 -1.8918 -1.6193 -1.6193 -0.8874 -0.8874 -0.7484 -0.7484 -0.6225 -0.6225 -0.5039 -0.5039 -0.3820 -0.3820 -0.1761 -0.1761 -0.1601 -0.1601 -0.1165 -0.1165 1.1811 1.1811 1.3338 1.3338 1.3654 1.3654 1.5100 1.5100 1.5236 1.5236 1.6307 1.6307 1.6713 1.6713 1.9482 1.9482 2.4459 2.4459 2.4820 2.4820 2.5118 2.5118 2.5354 2.5354 2.6214 2.6214 2.6678 2.6678 2.7796 2.7796 3.0312 3.0312 3.2010 3.2010 3.2597 3.2597 3.5876 3.5876 3.6213 3.6213 3.7667 3.7667 3.8426 3.8426 5.0361 5.0361 5.5473 5.5473 9.6382 9.6382 11.2587 11.2587 12.1090 12.1090 12.2653 12.2653 12.3215 12.3215 12.3503 12.3503 14.0220 14.0220 k = 0.2568 0.2766 0.0000 ( 14623 PWs) bands (ev): -16.9363 -16.9363 -16.9104 -16.9104 -16.4074 -16.4074 -16.2731 -16.2731 -16.2688 -16.2688 -16.2555 -16.2555 -12.7023 -12.7023 -12.6989 -12.6989 -1.8724 -1.8724 -1.6189 -1.6189 -0.8641 -0.8641 -0.7034 -0.7034 -0.6606 -0.6606 -0.4432 -0.4432 -0.3706 -0.3706 -0.1688 -0.1688 -0.1559 -0.1559 -0.1513 -0.1513 1.1695 1.1695 1.3166 1.3166 1.3639 1.3639 1.4826 1.4826 1.5185 1.5185 1.6208 1.6208 1.6637 1.6637 1.9472 1.9472 2.4377 2.4377 2.4616 2.4616 2.4921 2.4921 2.5159 2.5159 2.6058 2.6058 2.6547 2.6547 2.7778 2.7778 3.0585 3.0585 3.2082 3.2082 3.2779 3.2779 3.5712 3.5712 3.6041 3.6041 3.7637 3.7637 3.8839 3.8839 4.9450 4.9450 5.5606 5.5606 9.7356 9.7356 11.2394 11.2394 12.1449 12.1449 12.3308 12.3308 12.4145 12.4145 12.4406 12.4406 13.8966 13.8966 k = 0.2703 0.2911-0.0000 ( 14623 PWs) bands (ev): -16.9301 -16.9301 -16.9152 -16.9152 -16.4078 -16.4078 -16.2734 -16.2734 -16.2685 -16.2685 -16.2559 -16.2559 -12.7053 -12.7053 -12.6995 -12.6995 -1.8530 -1.8530 -1.6188 -1.6188 -0.8404 -0.8404 -0.7017 -0.7017 -0.6564 -0.6564 -0.3884 -0.3884 -0.3591 -0.3591 -0.1919 -0.1919 -0.1574 -0.1574 -0.1361 -0.1361 1.1570 1.1570 1.2991 1.2991 1.3628 1.3628 1.4537 1.4537 1.5133 1.5133 1.6122 1.6122 1.6563 1.6563 1.9464 1.9464 2.4282 2.4282 2.4423 2.4423 2.4724 2.4724 2.4943 2.4943 2.5911 2.5911 2.6411 2.6411 2.7764 2.7764 3.0862 3.0862 3.2117 3.2117 3.2983 3.2983 3.5557 3.5557 3.5866 3.5866 3.7552 3.7552 3.9283 3.9283 4.8518 4.8518 5.5740 5.5740 9.8357 9.8357 11.2209 11.2209 12.1811 12.1811 12.3892 12.3892 12.5109 12.5109 12.5343 12.5343 13.7718 13.7718 k = 0.2838 0.3057-0.0000 ( 14631 PWs) bands (ev): -16.9238 -16.9238 -16.9200 -16.9200 -16.4082 -16.4082 -16.2737 -16.2737 -16.2682 -16.2682 -16.2562 -16.2562 -12.7083 -12.7083 -12.7002 -12.7002 -1.8338 -1.8338 -1.6189 -1.6189 -0.8163 -0.8163 -0.7446 -0.7446 -0.6081 -0.6081 -0.3483 -0.3483 -0.3432 -0.3432 -0.2197 -0.2197 -0.1541 -0.1541 -0.1037 -0.1037 1.1441 1.1441 1.2819 1.2819 1.3612 1.3612 1.4240 1.4240 1.5080 1.5080 1.6049 1.6049 1.6489 1.6489 1.9458 1.9458 2.4137 2.4137 2.4280 2.4280 2.4533 2.4533 2.4716 2.4716 2.5772 2.5772 2.6271 2.6271 2.7752 2.7752 3.1138 3.1138 3.2134 3.2134 3.3181 3.3181 3.5421 3.5421 3.5693 3.5693 3.7453 3.7453 3.9714 3.9714 4.7571 4.7571 5.5875 5.5875 9.9383 9.9383 11.2033 11.2033 12.2173 12.2173 12.4388 12.4388 12.6105 12.6105 12.6312 12.6312 13.6530 13.6530 k = 0.2973 0.3202 0.0000 ( 14639 PWs) bands (ev): -16.9247 -16.9247 -16.9177 -16.9177 -16.4086 -16.4086 -16.2741 -16.2741 -16.2679 -16.2679 -16.2565 -16.2565 -12.7112 -12.7112 -12.7008 -12.7008 -1.8150 -1.8150 -1.6192 -1.6192 -0.7920 -0.7920 -0.7886 -0.7886 -0.5584 -0.5584 -0.3372 -0.3372 -0.3113 -0.3113 -0.2433 -0.2433 -0.1511 -0.1511 -0.0562 -0.0562 1.1311 1.1311 1.2652 1.2652 1.3563 1.3563 1.3960 1.3960 1.5024 1.5024 1.5988 1.5988 1.6412 1.6412 1.9455 1.9455 2.3946 2.3946 2.4185 2.4185 2.4355 2.4355 2.4484 2.4484 2.5639 2.5639 2.6130 2.6130 2.7741 2.7741 3.1406 3.1406 3.2141 3.2141 3.3350 3.3350 3.5312 3.5312 3.5526 3.5526 3.7349 3.7349 4.0123 4.0123 4.6613 4.6613 5.6009 5.6009 10.0431 10.0431 11.1866 11.1866 12.2532 12.2532 12.4778 12.4778 12.7132 12.7132 12.7310 12.7310 13.5406 13.5406 k = 0.3108 0.3348 0.0000 ( 14635 PWs) bands (ev): -16.9292 -16.9292 -16.9116 -16.9116 -16.4091 -16.4091 -16.2744 -16.2744 -16.2676 -16.2676 -16.2569 -16.2569 -12.7141 -12.7141 -12.7014 -12.7014 -1.7965 -1.7965 -1.6198 -1.6198 -0.8327 -0.8327 -0.7676 -0.7676 -0.5075 -0.5075 -0.3267 -0.3267 -0.2906 -0.2906 -0.2629 -0.2629 -0.1484 -0.1484 0.0039 0.0039 1.1182 1.1182 1.2493 1.2493 1.3390 1.3390 1.3788 1.3788 1.4962 1.4962 1.5937 1.5937 1.6332 1.6332 1.9452 1.9452 2.3747 2.3747 2.4093 2.4093 2.4202 2.4202 2.4255 2.4255 2.5512 2.5512 2.5991 2.5991 2.7729 2.7729 3.1665 3.1665 3.2142 3.2142 3.3473 3.3473 3.5239 3.5239 3.5370 3.5370 3.7246 3.7246 4.0505 4.0505 4.5651 4.5651 5.6141 5.6141 10.1497 10.1497 11.1709 11.1709 12.2886 12.2886 12.5049 12.5049 12.8187 12.8187 12.8336 12.8336 13.4348 13.4348 k = 0.3243 0.3493 0.0000 ( 14655 PWs) bands (ev): -16.9336 -16.9336 -16.9057 -16.9057 -16.4096 -16.4096 -16.2747 -16.2747 -16.2673 -16.2673 -16.2572 -16.2572 -12.7168 -12.7168 -12.7020 -12.7020 -1.7787 -1.7787 -1.6207 -1.6207 -0.8762 -0.8762 -0.7433 -0.7433 -0.4558 -0.4558 -0.3169 -0.3169 -0.2816 -0.2816 -0.2753 -0.2753 -0.1457 -0.1457 0.0725 0.0725 1.1057 1.1057 1.2344 1.2344 1.3079 1.3079 1.3737 1.3737 1.4895 1.4895 1.5895 1.5895 1.6249 1.6249 1.9451 1.9451 2.3550 2.3550 2.3969 2.3969 2.4035 2.4035 2.4096 2.4096 2.5391 2.5391 2.5856 2.5856 2.7716 2.7716 3.1908 3.1908 3.2139 3.2139 3.3536 3.3536 3.5167 3.5167 3.5276 3.5276 3.7145 3.7145 4.0858 4.0858 4.4693 4.4693 5.6270 5.6270 10.2577 10.2577 11.1562 11.1562 12.3232 12.3232 12.5193 12.5193 12.9265 12.9265 12.9385 12.9385 13.3357 13.3357 k = 0.3378 0.3639-0.0000 ( 14663 PWs) bands (ev): -16.9378 -16.9378 -16.9000 -16.9000 -16.4101 -16.4101 -16.2750 -16.2750 -16.2670 -16.2670 -16.2575 -16.2575 -12.7195 -12.7195 -12.7026 -12.7026 -1.7615 -1.7615 -1.6219 -1.6219 -0.9182 -0.9182 -0.7193 -0.7193 -0.4037 -0.4037 -0.3078 -0.3078 -0.2939 -0.2939 -0.2683 -0.2683 -0.1430 -0.1430 0.1461 0.1461 1.0938 1.0938 1.2208 1.2208 1.2717 1.2717 1.3722 1.3722 1.4820 1.4820 1.5862 1.5862 1.6165 1.6165 1.9451 1.9451 2.3360 2.3360 2.3793 2.3793 2.3864 2.3864 2.4024 2.4024 2.5277 2.5277 2.5725 2.5725 2.7701 2.7701 3.2129 3.2129 3.2138 3.2138 3.3534 3.3534 3.5040 3.5040 3.5302 3.5302 3.7048 3.7048 4.1183 4.1183 4.3745 4.3745 5.6396 5.6396 10.3669 10.3669 11.1426 11.1426 12.3568 12.3568 12.5208 12.5208 13.0365 13.0365 13.0455 13.0455 13.2435 13.2435 k = 0.3514 0.3784-0.0000 ( 14663 PWs) bands (ev): -16.9417 -16.9417 -16.8946 -16.8946 -16.4106 -16.4106 -16.2753 -16.2753 -16.2668 -16.2668 -16.2577 -16.2577 -12.7220 -12.7220 -12.7032 -12.7032 -1.7451 -1.7451 -1.6233 -1.6233 -0.9582 -0.9582 -0.6958 -0.6958 -0.3517 -0.3517 -0.3053 -0.3053 -0.2994 -0.2994 -0.2627 -0.2627 -0.1402 -0.1402 0.2221 0.2221 1.0827 1.0827 1.2084 1.2084 1.2333 1.2333 1.3715 1.3715 1.4737 1.4737 1.5835 1.5835 1.6080 1.6080 1.9451 1.9451 2.3179 2.3179 2.3590 2.3590 2.3738 2.3738 2.3966 2.3966 2.5171 2.5171 2.5602 2.5602 2.7683 2.7683 3.2125 3.2125 3.2337 3.2337 3.3478 3.3478 3.4913 3.4913 3.5387 3.5387 3.6956 3.6956 4.1478 4.1478 4.2817 4.2817 5.6515 5.6515 10.4766 10.4766 11.1300 11.1300 12.3890 12.3890 12.5097 12.5097 13.1476 13.1476 13.1501 13.1501 13.1624 13.1624 k = 0.3649 0.3930 0.0000 ( 14683 PWs) bands (ev): -16.9455 -16.9455 -16.8894 -16.8894 -16.4111 -16.4111 -16.2755 -16.2755 -16.2665 -16.2665 -16.2580 -16.2580 -12.7243 -12.7243 -12.7037 -12.7037 -1.7297 -1.7297 -1.6249 -1.6249 -0.9958 -0.9958 -0.6730 -0.6730 -0.3164 -0.3164 -0.2987 -0.2987 -0.2921 -0.2921 -0.2586 -0.2586 -0.1369 -0.1369 0.2986 0.2986 1.0724 1.0724 1.1934 1.1934 1.1979 1.1979 1.3709 1.3709 1.4646 1.4646 1.5814 1.5814 1.5996 1.5996 1.9452 1.9452 2.3010 2.3010 2.3395 2.3395 2.3630 2.3630 2.3916 2.3916 2.5073 2.5073 2.5487 2.5487 2.7663 2.7663 3.2113 3.2113 3.2516 3.2516 3.3384 3.3384 3.4800 3.4800 3.5501 3.5501 3.6870 3.6870 4.1744 4.1744 4.1920 4.1920 5.6629 5.6629 10.5867 10.5867 11.1185 11.1185 12.4196 12.4196 12.4866 12.4866 13.0796 13.0796 13.2601 13.2601 13.2638 13.2638 k = 0.3784 0.4075-0.0000 ( 14683 PWs) bands (ev): -16.9489 -16.9489 -16.8846 -16.8846 -16.4116 -16.4116 -16.2758 -16.2758 -16.2663 -16.2663 -16.2583 -16.2583 -12.7265 -12.7265 -12.7042 -12.7042 -1.7153 -1.7153 -1.6267 -1.6267 -1.0304 -1.0304 -0.6510 -0.6510 -0.3237 -0.3237 -0.2859 -0.2859 -0.2563 -0.2563 -0.2488 -0.2488 -0.1324 -0.1324 0.3741 0.3741 1.0629 1.0629 1.1534 1.1534 1.1883 1.1883 1.3703 1.3703 1.4547 1.4547 1.5798 1.5798 1.5917 1.5917 1.9454 1.9454 2.2852 2.2852 2.3213 2.3213 2.3538 2.3538 2.3874 2.3874 2.4983 2.4983 2.5381 2.5381 2.7639 2.7639 3.2098 3.2098 3.2667 3.2667 3.3270 3.3270 3.4706 3.4706 3.5626 3.5626 3.6790 3.6790 4.1062 4.1062 4.1984 4.1984 5.6735 5.6735 10.6965 10.6965 11.1081 11.1081 12.4479 12.4479 12.4531 12.4531 13.0087 13.0087 13.3709 13.3709 13.3732 13.3732 k = 0.3919 0.4221 0.0000 ( 14679 PWs) bands (ev): -16.9520 -16.9520 -16.8802 -16.8802 -16.4121 -16.4121 -16.2760 -16.2760 -16.2661 -16.2661 -16.2585 -16.2585 -12.7285 -12.7285 -12.7046 -12.7046 -1.7021 -1.7021 -1.6287 -1.6287 -1.0619 -1.0619 -0.6303 -0.6303 -0.3305 -0.3305 -0.2809 -0.2809 -0.2531 -0.2531 -0.2044 -0.2044 -0.1246 -0.1246 0.4473 0.4473 1.0542 1.0542 1.1132 1.1132 1.1805 1.1805 1.3696 1.3696 1.4441 1.4441 1.5786 1.5786 1.5843 1.5843 1.9455 1.9455 2.2709 2.2709 2.3047 2.3047 2.3461 2.3461 2.3839 2.3839 2.4902 2.4902 2.5286 2.5286 2.7613 2.7613 3.2078 3.2078 3.2789 3.2789 3.3146 3.3146 3.4635 3.4635 3.5750 3.5750 3.6717 3.6717 4.0257 4.0257 4.2195 4.2195 5.6833 5.6833 10.8056 10.8056 11.0988 11.0988 12.4091 12.4091 12.4749 12.4749 12.9450 12.9450 13.4758 13.4758 13.4816 13.4816 k = 0.4054 0.4367-0.0000 ( 14663 PWs) bands (ev): -16.9549 -16.9549 -16.8762 -16.8762 -16.4126 -16.4126 -16.2762 -16.2762 -16.2660 -16.2660 -16.2587 -16.2587 -12.7302 -12.7302 -12.7050 -12.7050 -1.6901 -1.6901 -1.6307 -1.6307 -1.0900 -1.0900 -0.6109 -0.6109 -0.3361 -0.3361 -0.2770 -0.2770 -0.2508 -0.2508 -0.1709 -0.1709 -0.1070 -0.1070 0.5170 0.5170 1.0455 1.0455 1.0746 1.0746 1.1741 1.1741 1.3688 1.3688 1.4332 1.4332 1.5769 1.5769 1.5785 1.5785 1.9457 1.9457 2.2580 2.2580 2.2897 2.2897 2.3397 2.3397 2.3811 2.3811 2.4830 2.4830 2.5201 2.5201 2.7582 2.7582 3.2053 3.2053 3.2881 3.2881 3.3021 3.3021 3.4586 3.4586 3.5864 3.5864 3.6652 3.6652 3.9518 3.9518 4.2379 4.2379 5.6922 5.6922 10.9132 10.9132 11.0906 11.0906 12.3573 12.3573 12.4990 12.4990 12.8887 12.8887 13.5671 13.5671 13.5812 13.5812 k = 0.4189 0.4512 0.0000 ( 14683 PWs) bands (ev): -16.9574 -16.9574 -16.8726 -16.8726 -16.4130 -16.4130 -16.2764 -16.2764 -16.2658 -16.2658 -16.2589 -16.2589 -12.7318 -12.7318 -12.7053 -12.7053 -1.6794 -1.6794 -1.6328 -1.6328 -1.1145 -1.1145 -0.5933 -0.5933 -0.3408 -0.3408 -0.2741 -0.2741 -0.2488 -0.2488 -0.1545 -0.1545 -0.0750 -0.0750 0.5816 0.5816 1.0283 1.0283 1.0468 1.0468 1.1690 1.1690 1.3678 1.3678 1.4223 1.4223 1.5714 1.5714 1.5773 1.5773 1.9458 1.9458 2.2467 2.2467 2.2765 2.2765 2.3344 2.3344 2.3791 2.3791 2.4768 2.4768 2.5129 2.5129 2.7549 2.7549 3.2021 3.2021 3.2904 3.2904 3.2944 3.2944 3.4558 3.4558 3.5959 3.5959 3.6594 3.6594 3.8860 3.8860 4.2538 4.2538 5.7000 5.7000 11.0185 11.0185 11.0835 11.0835 12.2989 12.2989 12.5204 12.5204 12.8397 12.8397 13.6259 13.6259 13.6568 13.6568 k = 0.4324 0.4658-0.0000 ( 14679 PWs) bands (ev): -16.9595 -16.9595 -16.8695 -16.8695 -16.4134 -16.4134 -16.2765 -16.2765 -16.2657 -16.2657 -16.2590 -16.2590 -12.7332 -12.7332 -12.7056 -12.7056 -1.6702 -1.6702 -1.6348 -1.6348 -1.1353 -1.1353 -0.5777 -0.5777 -0.3445 -0.3445 -0.2722 -0.2722 -0.2470 -0.2470 -0.1476 -0.1476 -0.0372 -0.0372 0.6399 0.6399 0.9952 0.9952 1.0382 1.0382 1.1652 1.1652 1.3667 1.3667 1.4119 1.4119 1.5664 1.5664 1.5769 1.5769 1.9460 1.9460 2.2370 2.2370 2.2653 2.2653 2.3303 2.3303 2.3776 2.3776 2.4715 2.4715 2.5068 2.5068 2.7515 2.7515 3.1982 3.1982 3.2801 3.2801 3.2983 3.2983 3.4549 3.4549 3.6030 3.6030 3.6545 3.6545 3.8298 3.8298 4.2670 4.2670 5.7068 5.7068 11.0773 11.0773 11.1205 11.1205 12.2357 12.2357 12.5389 12.5389 12.7982 12.7982 13.6477 13.6477 13.6945 13.6945 k = 0.4459 0.4803-0.0000 ( 14659 PWs) bands (ev): -16.9613 -16.9613 -16.8670 -16.8670 -16.4137 -16.4137 -16.2767 -16.2767 -16.2656 -16.2656 -16.2591 -16.2591 -12.7343 -12.7343 -12.7059 -12.7059 -1.6624 -1.6624 -1.6367 -1.6367 -1.1525 -1.1525 -0.5643 -0.5643 -0.3475 -0.3475 -0.2711 -0.2711 -0.2454 -0.2454 -0.1443 -0.1443 -0.0008 -0.0008 0.6904 0.6904 0.9630 0.9630 1.0333 1.0333 1.1625 1.1625 1.3657 1.3657 1.4024 1.4024 1.5621 1.5621 1.5766 1.5766 1.9461 1.9461 2.2289 2.2289 2.2560 2.2560 2.3270 2.3270 2.3767 2.3767 2.4671 2.4671 2.5019 2.5019 2.7480 2.7480 3.1938 3.1938 3.2716 3.2716 3.3003 3.3003 3.4551 3.4551 3.6070 3.6070 3.6505 3.6505 3.7846 3.7846 4.2778 4.2778 5.7124 5.7124 11.0725 11.0725 11.2171 11.2171 12.1700 12.1700 12.5544 12.5544 12.7642 12.7642 13.6521 13.6521 13.7066 13.7066 k = 0.4595 0.4949 0.0000 ( 14651 PWs) bands (ev): -16.9627 -16.9627 -16.8650 -16.8650 -16.4139 -16.4139 -16.2768 -16.2768 -16.2655 -16.2655 -16.2592 -16.2592 -12.7351 -12.7351 -12.7061 -12.7061 -1.6560 -1.6560 -1.6385 -1.6385 -1.1658 -1.1658 -0.5536 -0.5536 -0.3498 -0.3498 -0.2704 -0.2704 -0.2442 -0.2442 -0.1423 -0.1423 0.0306 0.0306 0.7317 0.7317 0.9352 0.9352 1.0297 1.0297 1.1606 1.1606 1.3647 1.3647 1.3945 1.3945 1.5588 1.5588 1.5764 1.5764 1.9462 1.9462 2.2227 2.2227 2.2487 2.2487 2.3246 2.3246 2.3763 2.3763 2.4637 2.4637 2.4981 2.4981 2.7447 2.7447 3.1892 3.1892 3.2651 3.2651 3.3011 3.3011 3.4561 3.4561 3.6075 3.6075 3.6472 3.6472 3.7515 3.7515 4.2862 4.2862 5.7168 5.7168 11.0686 11.0686 11.3056 11.3056 12.1051 12.1051 12.5666 12.5666 12.7377 12.7377 13.6514 13.6514 13.7091 13.7091 k = 0.4730 0.5094-0.0000 ( 14658 PWs) bands (ev): -16.9637 -16.9637 -16.8635 -16.8635 -16.4141 -16.4141 -16.2768 -16.2768 -16.2654 -16.2654 -16.2593 -16.2593 -12.7358 -12.7358 -12.7062 -12.7062 -1.6511 -1.6511 -1.6402 -1.6402 -1.1753 -1.1753 -0.5456 -0.5456 -0.3513 -0.3513 -0.2701 -0.2701 -0.2433 -0.2433 -0.1412 -0.1412 0.0549 0.0549 0.7623 0.7623 0.9138 0.9138 1.0273 1.0273 1.1593 1.1593 1.3638 1.3638 1.3886 1.3886 1.5564 1.5564 1.5762 1.5762 1.9463 1.9463 2.2181 2.2181 2.2435 2.2435 2.3229 2.3229 2.3761 2.3761 2.4613 2.4613 2.4954 2.4954 2.7421 2.7421 3.1850 3.1850 3.2606 3.2606 3.3012 3.3012 3.4571 3.4571 3.6052 3.6052 3.6449 3.6449 3.7303 3.7303 4.2921 4.2921 5.7200 5.7200 11.0659 11.0659 11.3808 11.3808 12.0466 12.0466 12.5754 12.5754 12.7187 12.7187 13.6496 13.6496 13.7088 13.7088 k = 0.4865 0.5240 0.0000 ( 14650 PWs) bands (ev): -16.9643 -16.9643 -16.8626 -16.8626 -16.4142 -16.4142 -16.2769 -16.2769 -16.2654 -16.2654 -16.2594 -16.2594 -12.7362 -12.7362 -12.7063 -12.7063 -1.6475 -1.6475 -1.6419 -1.6419 -1.1810 -1.1810 -0.5408 -0.5408 -0.3523 -0.3523 -0.2699 -0.2699 -0.2427 -0.2427 -0.1406 -0.1406 0.0702 0.0702 0.7812 0.7812 0.9002 0.9002 1.0258 1.0258 1.1586 1.1586 1.3632 1.3632 1.3849 1.3849 1.5549 1.5549 1.5762 1.5762 1.9463 1.9463 2.2154 2.2154 2.2403 2.2403 2.3220 2.3220 2.3761 2.3761 2.4598 2.4598 2.4938 2.4938 2.7403 2.7403 3.1822 3.1822 3.2580 3.2580 3.3012 3.3012 3.4579 3.4579 3.6023 3.6023 3.6435 3.6435 3.7191 3.7191 4.2956 4.2956 5.7219 5.7219 11.0643 11.0643 11.4339 11.4339 12.0033 12.0033 12.5808 12.5808 12.7073 12.7073 13.6481 13.6481 13.7080 13.7080 k = 0.5000 0.5385 0.0000 ( 14650 PWs) bands (ev): -16.9645 -16.9645 -16.8623 -16.8623 -16.4143 -16.4143 -16.2769 -16.2769 -16.2654 -16.2654 -16.2594 -16.2594 -12.7363 -12.7363 -12.7063 -12.7063 -1.6458 -1.6458 -1.6430 -1.6430 -1.1829 -1.1829 -0.5392 -0.5392 -0.3526 -0.3526 -0.2699 -0.2699 -0.2426 -0.2426 -0.1404 -0.1404 0.0755 0.0755 0.7876 0.7876 0.8955 0.8955 1.0254 1.0254 1.1584 1.1584 1.3629 1.3629 1.3837 1.3837 1.5544 1.5544 1.5762 1.5762 1.9464 1.9464 2.2145 2.2145 2.2393 2.2393 2.3216 2.3216 2.3761 2.3761 2.4593 2.4593 2.4933 2.4933 2.7397 2.7397 3.1812 3.1812 3.2571 3.2571 3.3011 3.3011 3.4582 3.4582 3.6009 3.6009 3.6430 3.6430 3.7157 3.7157 4.2968 4.2968 5.7226 5.7226 11.0637 11.0637 11.4537 11.4537 11.9869 11.9869 12.5826 12.5826 12.7036 12.7036 13.6476 13.6476 13.7076 13.7076 k = 0.5000 0.5385 0.0000 ( 14650 PWs) bands (ev): -16.9645 -16.9645 -16.8623 -16.8623 -16.4143 -16.4143 -16.2769 -16.2769 -16.2654 -16.2654 -16.2594 -16.2594 -12.7363 -12.7363 -12.7063 -12.7063 -1.6458 -1.6458 -1.6430 -1.6430 -1.1829 -1.1829 -0.5392 -0.5392 -0.3526 -0.3526 -0.2699 -0.2699 -0.2426 -0.2426 -0.1404 -0.1404 0.0755 0.0755 0.7876 0.7876 0.8955 0.8955 1.0254 1.0254 1.1584 1.1584 1.3629 1.3629 1.3837 1.3837 1.5544 1.5544 1.5762 1.5762 1.9464 1.9464 2.2145 2.2145 2.2393 2.2393 2.3216 2.3216 2.3761 2.3761 2.4593 2.4593 2.4933 2.4933 2.7397 2.7397 3.1812 3.1812 3.2571 3.2571 3.3011 3.3011 3.4582 3.4582 3.6009 3.6009 3.6430 3.6430 3.7157 3.7157 4.2968 4.2968 5.7226 5.7226 11.0637 11.0637 11.4537 11.4537 11.9869 11.9869 12.5826 12.5826 12.7036 12.7036 13.6476 13.6476 13.7076 13.7076 k = 0.4905 0.5474 0.0130 ( 14626 PWs) bands (ev): -16.9645 -16.9645 -16.8623 -16.8623 -16.4142 -16.4142 -16.2770 -16.2770 -16.2655 -16.2655 -16.2592 -16.2592 -12.7363 -12.7363 -12.7063 -12.7063 -1.6461 -1.6461 -1.6426 -1.6426 -1.1830 -1.1830 -0.5390 -0.5390 -0.3527 -0.3527 -0.2697 -0.2697 -0.2422 -0.2422 -0.1400 -0.1400 0.0751 0.0751 0.7873 0.7873 0.8963 0.8963 1.0245 1.0245 1.1580 1.1580 1.3609 1.3609 1.3820 1.3820 1.5538 1.5538 1.5765 1.5765 1.9449 1.9449 2.2168 2.2168 2.2391 2.2391 2.3214 2.3214 2.3768 2.3768 2.4580 2.4580 2.4929 2.4929 2.7446 2.7446 3.1813 3.1813 3.2576 3.2576 3.3009 3.3009 3.4581 3.4581 3.6010 3.6010 3.6427 3.6427 3.7159 3.7159 4.2980 4.2980 5.7214 5.7214 11.0637 11.0637 11.4536 11.4536 11.9891 11.9891 12.5842 12.5842 12.7015 12.7015 13.6474 13.6474 13.7076 13.7076 k = 0.4809 0.5563 0.0260 ( 14642 PWs) bands (ev): -16.9646 -16.9646 -16.8623 -16.8623 -16.4138 -16.4138 -16.2775 -16.2775 -16.2658 -16.2658 -16.2587 -16.2587 -12.7362 -12.7362 -12.7063 -12.7063 -1.6469 -1.6469 -1.6417 -1.6417 -1.1831 -1.1831 -0.5384 -0.5384 -0.3532 -0.3532 -0.2690 -0.2690 -0.2409 -0.2409 -0.1388 -0.1388 0.0738 0.0738 0.7865 0.7865 0.8988 0.8988 1.0218 1.0218 1.1571 1.1571 1.3549 1.3549 1.3772 1.3772 1.5520 1.5520 1.5778 1.5778 1.9405 1.9405 2.2230 2.2230 2.2389 2.2389 2.3207 2.3207 2.3789 2.3789 2.4537 2.4537 2.4929 2.4929 2.7584 2.7584 3.1818 3.1818 3.2592 3.2592 3.3004 3.3004 3.4579 3.4579 3.6011 3.6011 3.6416 3.6416 3.7166 3.7166 4.3014 4.3014 5.7180 5.7180 11.0637 11.0637 11.4533 11.4533 11.9959 11.9959 12.5892 12.5892 12.6955 12.6955 13.6454 13.6454 13.7087 13.7087 k = 0.4714 0.5651 0.0391 ( 14648 PWs) bands (ev): -16.9647 -16.9647 -16.8622 -16.8622 -16.4133 -16.4133 -16.2783 -16.2783 -16.2662 -16.2662 -16.2581 -16.2581 -12.7360 -12.7360 -12.7062 -12.7062 -1.6480 -1.6480 -1.6406 -1.6406 -1.1834 -1.1834 -0.5375 -0.5375 -0.3541 -0.3541 -0.2680 -0.2680 -0.2386 -0.2386 -0.1369 -0.1369 0.0717 0.0717 0.7852 0.7852 0.9029 0.9029 1.0170 1.0170 1.1559 1.1559 1.3450 1.3450 1.3694 1.3694 1.5487 1.5487 1.5805 1.5805 1.9333 1.9333 2.2291 2.2291 2.2422 2.2422 2.3196 2.3196 2.3824 2.3824 2.4461 2.4461 2.4950 2.4950 2.7795 2.7795 3.1825 3.1825 3.2619 3.2619 3.2996 3.2996 3.4575 3.4575 3.6013 3.6013 3.6399 3.6399 3.7177 3.7177 4.3070 4.3070 5.7124 5.7124 11.0636 11.0636 11.4529 11.4529 12.0072 12.0072 12.5975 12.5975 12.6854 12.6854 13.6388 13.6388 13.7138 13.7138 k = 0.4618 0.5740 0.0521 ( 14652 PWs) bands (ev): -16.9649 -16.9649 -16.8621 -16.8621 -16.4125 -16.4125 -16.2794 -16.2794 -16.2666 -16.2666 -16.2574 -16.2574 -12.7359 -12.7359 -12.7061 -12.7061 -1.6492 -1.6492 -1.6392 -1.6392 -1.1838 -1.1838 -0.5362 -0.5362 -0.3559 -0.3559 -0.2667 -0.2667 -0.2350 -0.2350 -0.1340 -0.1340 0.0688 0.0688 0.7835 0.7835 0.9085 0.9085 1.0096 1.0096 1.1548 1.1548 1.3314 1.3314 1.3590 1.3590 1.5442 1.5442 1.5848 1.5848 1.9238 1.9238 2.2282 2.2282 2.2548 2.2548 2.3180 2.3180 2.3873 2.3873 2.4365 2.4365 2.5000 2.5000 2.8058 2.8058 3.1834 3.1834 3.2659 3.2659 3.2984 3.2984 3.4569 3.4569 3.6017 3.6017 3.6375 3.6375 3.7194 3.7194 4.3146 4.3146 5.7047 5.7047 11.0632 11.0632 11.4523 11.4523 12.0228 12.0228 12.6091 12.6091 12.6714 12.6714 13.6254 13.6254 13.7252 13.7252 k = 0.4523 0.5829 0.0651 ( 14652 PWs) bands (ev): -16.9652 -16.9652 -16.8619 -16.8619 -16.4115 -16.4115 -16.2809 -16.2809 -16.2669 -16.2669 -16.2567 -16.2567 -12.7356 -12.7356 -12.7060 -12.7060 -1.6508 -1.6508 -1.6376 -1.6376 -1.1843 -1.1843 -0.5346 -0.5346 -0.3588 -0.3588 -0.2651 -0.2651 -0.2300 -0.2300 -0.1302 -0.1302 0.0652 0.0652 0.7816 0.7816 0.9152 0.9152 0.9992 0.9992 1.1543 1.1543 1.3143 1.3143 1.3461 1.3461 1.5391 1.5391 1.5906 1.5906 1.9121 1.9121 2.2234 2.2234 2.2727 2.2727 2.3159 2.3159 2.3933 2.3933 2.4264 2.4264 2.5078 2.5078 2.8356 2.8356 3.1845 3.1845 3.2715 3.2715 3.2969 3.2969 3.4562 3.4562 3.6022 3.6022 3.6344 3.6344 3.7218 3.7218 4.3240 4.3240 5.6950 5.6950 11.0622 11.0622 11.4516 11.4516 12.0427 12.0427 12.6240 12.6240 12.6535 12.6535 13.6050 13.6050 13.7426 13.7426 k = 0.4427 0.5917 0.0781 ( 14654 PWs) bands (ev): -16.9655 -16.9655 -16.8618 -16.8618 -16.4103 -16.4103 -16.2826 -16.2826 -16.2671 -16.2671 -16.2560 -16.2560 -12.7353 -12.7353 -12.7058 -12.7058 -1.6526 -1.6526 -1.6357 -1.6357 -1.1849 -1.1849 -0.5327 -0.5327 -0.3632 -0.3632 -0.2630 -0.2630 -0.2236 -0.2236 -0.1253 -0.1253 0.0609 0.0609 0.7794 0.7794 0.9223 0.9223 0.9864 0.9864 1.1548 1.1548 1.2943 1.2943 1.3311 1.3311 1.5340 1.5340 1.5979 1.5979 1.8986 1.8986 2.2165 2.2165 2.2933 2.2933 2.3134 2.3134 2.3998 2.3998 2.4178 2.4178 2.5181 2.5181 2.8672 2.8672 3.1856 3.1856 3.2787 3.2787 3.2950 3.2950 3.4555 3.4555 3.6029 3.6029 3.6307 3.6307 3.7251 3.7251 4.3349 4.3349 5.6835 5.6835 11.0604 11.0604 11.4509 11.4509 12.0666 12.0666 12.6319 12.6319 12.6421 12.6421 13.5784 13.5784 13.7651 13.7651 k = 0.4332 0.6006 0.0912 ( 14640 PWs) bands (ev): -16.9658 -16.9658 -16.8616 -16.8616 -16.4089 -16.4089 -16.2846 -16.2846 -16.2671 -16.2671 -16.2553 -16.2553 -12.7350 -12.7350 -12.7056 -12.7056 -1.6548 -1.6548 -1.6337 -1.6337 -1.1856 -1.1856 -0.5305 -0.5305 -0.3693 -0.3693 -0.2603 -0.2603 -0.2157 -0.2157 -0.1194 -0.1194 0.0560 0.0560 0.7772 0.7772 0.9268 0.9268 0.9741 0.9741 1.1563 1.1563 1.2719 1.2719 1.3141 1.3141 1.5294 1.5294 1.6065 1.6065 1.8835 1.8835 2.2077 2.2077 2.3101 2.3101 2.3155 2.3155 2.4023 2.4023 2.4159 2.4159 2.5304 2.5304 2.8994 2.8994 3.1867 3.1867 3.2868 3.2868 3.2938 3.2938 3.4548 3.4548 3.6039 3.6039 3.6264 3.6264 3.7294 3.7294 4.3471 4.3471 5.6703 5.6703 11.0571 11.0571 11.4501 11.4501 12.0944 12.0944 12.6067 12.6067 12.6636 12.6636 13.5466 13.5466 13.7915 13.7915 k = 0.4236 0.6094 0.1042 ( 14656 PWs) bands (ev): -16.9663 -16.9663 -16.8614 -16.8614 -16.4073 -16.4073 -16.2869 -16.2869 -16.2671 -16.2671 -16.2547 -16.2547 -12.7346 -12.7346 -12.7054 -12.7054 -1.6575 -1.6575 -1.6315 -1.6315 -1.1864 -1.1864 -0.5281 -0.5281 -0.3774 -0.3774 -0.2569 -0.2569 -0.2065 -0.2065 -0.1125 -0.1125 0.0506 0.0506 0.7750 0.7750 0.9206 0.9206 0.9704 0.9704 1.1588 1.1588 1.2475 1.2475 1.2953 1.2953 1.5257 1.5257 1.6163 1.6163 1.8673 1.8673 2.1972 2.1972 2.3067 2.3067 2.3377 2.3377 2.3989 2.3989 2.4237 2.4237 2.5445 2.5445 2.9310 2.9310 3.1880 3.1880 3.2882 3.2882 3.3010 3.3010 3.4541 3.4541 3.6051 3.6051 3.6216 3.6216 3.7350 3.7350 4.3600 4.3600 5.6558 5.6558 11.0521 11.0521 11.4493 11.4493 12.1256 12.1256 12.5782 12.5782 12.6883 12.6883 13.5101 13.5101 13.8206 13.8206 k = 0.4141 0.6183 0.1172 ( 14654 PWs) bands (ev): -16.9667 -16.9667 -16.8611 -16.8611 -16.4054 -16.4054 -16.2893 -16.2893 -16.2670 -16.2670 -16.2542 -16.2542 -12.7341 -12.7341 -12.7051 -12.7051 -1.6605 -1.6605 -1.6291 -1.6291 -1.1873 -1.1873 -0.5256 -0.5256 -0.3873 -0.3873 -0.2528 -0.2528 -0.1962 -0.1962 -0.1047 -0.1047 0.0449 0.0449 0.7730 0.7730 0.9013 0.9013 0.9783 0.9783 1.1617 1.1617 1.2217 1.2217 1.2750 1.2750 1.5233 1.5233 1.6273 1.6273 1.8503 1.8503 2.1851 2.1851 2.3027 2.3027 2.3571 2.3571 2.3984 2.3984 2.4347 2.4347 2.5598 2.5598 2.9612 2.9612 3.1895 3.1895 3.2852 3.2852 3.3140 3.3140 3.4534 3.4534 3.6063 3.6063 3.6167 3.6167 3.7424 3.7424 4.3733 4.3733 5.6402 5.6402 11.0446 11.0446 11.4486 11.4486 12.1601 12.1601 12.5469 12.5469 12.7162 12.7162 13.4698 13.4698 13.8498 13.8498 k = 0.4046 0.6272 0.1302 ( 14648 PWs) bands (ev): -16.9673 -16.9673 -16.8608 -16.8608 -16.4034 -16.4034 -16.2920 -16.2920 -16.2669 -16.2669 -16.2537 -16.2537 -12.7336 -12.7336 -12.7048 -12.7048 -1.6641 -1.6641 -1.6266 -1.6266 -1.1883 -1.1883 -0.5230 -0.5230 -0.3991 -0.3991 -0.2483 -0.2483 -0.1849 -0.1849 -0.0961 -0.0961 0.0392 0.0392 0.7711 0.7711 0.8754 0.8754 0.9921 0.9921 1.1635 1.1635 1.1962 1.1962 1.2536 1.2536 1.5224 1.5224 1.6395 1.6395 1.8327 1.8327 2.1717 2.1717 2.2983 2.2983 2.3681 2.3681 2.4077 2.4077 2.4475 2.4475 2.5761 2.5761 2.9888 2.9888 3.1917 3.1917 3.2814 3.2814 3.3290 3.3290 3.4530 3.4530 3.6058 3.6058 3.6136 3.6136 3.7521 3.7521 4.3866 4.3866 5.6238 5.6238 11.0342 11.0342 11.4480 11.4480 12.1975 12.1975 12.5133 12.5133 12.7473 12.7473 13.4263 13.4263 13.8097 13.8097 k = 0.3950 0.6360 0.1433 ( 14658 PWs) bands (ev): -16.9679 -16.9679 -16.8605 -16.8605 -16.4012 -16.4012 -16.2948 -16.2948 -16.2667 -16.2667 -16.2532 -16.2532 -12.7331 -12.7331 -12.7045 -12.7045 -1.6682 -1.6682 -1.6240 -1.6240 -1.1894 -1.1894 -0.5207 -0.5207 -0.4123 -0.4123 -0.2435 -0.2435 -0.1727 -0.1727 -0.0871 -0.0871 0.0337 0.0337 0.7696 0.7696 0.8463 0.8463 1.0087 1.0087 1.1556 1.1556 1.1789 1.1789 1.2321 1.2321 1.5230 1.5230 1.6526 1.6526 1.8148 1.8148 2.1571 2.1571 2.2935 2.2935 2.3710 2.3710 2.4258 2.4258 2.4620 2.4620 2.5928 2.5928 3.0132 3.0132 3.1949 3.1949 3.2770 3.2770 3.3452 3.3452 3.4528 3.4528 3.6009 3.6009 3.6150 3.6150 3.7646 3.7646 4.3992 4.3992 5.6071 5.6071 11.0201 11.0201 11.4476 11.4476 12.2373 12.2373 12.4778 12.4778 12.7816 12.7816 13.3803 13.3803 13.7529 13.7529 k = 0.3950 0.6360 0.1433 ( 14658 PWs) bands (ev): -16.9679 -16.9679 -16.8605 -16.8605 -16.4012 -16.4012 -16.2948 -16.2948 -16.2667 -16.2667 -16.2532 -16.2532 -12.7331 -12.7331 -12.7045 -12.7045 -1.6682 -1.6682 -1.6240 -1.6240 -1.1894 -1.1894 -0.5207 -0.5207 -0.4123 -0.4123 -0.2435 -0.2435 -0.1727 -0.1727 -0.0871 -0.0871 0.0337 0.0337 0.7696 0.7696 0.8463 0.8463 1.0087 1.0087 1.1556 1.1556 1.1789 1.1789 1.2321 1.2321 1.5230 1.5230 1.6526 1.6526 1.8148 1.8148 2.1571 2.1571 2.2935 2.2935 2.3710 2.3710 2.4258 2.4258 2.4620 2.4620 2.5928 2.5928 3.0132 3.0132 3.1949 3.1949 3.2770 3.2770 3.3452 3.3452 3.4528 3.4528 3.6009 3.6009 3.6150 3.6150 3.7646 3.7646 4.3992 4.3992 5.6071 5.6071 11.0201 11.0201 11.4476 11.4476 12.2373 12.2373 12.4778 12.4778 12.7816 12.7816 13.3803 13.3803 13.7529 13.7529 k = 0.3786 0.6304 0.1515 ( 14655 PWs) bands (ev): -16.9682 -16.9682 -16.8605 -16.8605 -16.3997 -16.3997 -16.2967 -16.2967 -16.2665 -16.2665 -16.2530 -16.2530 -12.7326 -12.7326 -12.7042 -12.7042 -1.6711 -1.6711 -1.6228 -1.6228 -1.1890 -1.1890 -0.5203 -0.5203 -0.4211 -0.4211 -0.2407 -0.2407 -0.1646 -0.1646 -0.0818 -0.0818 0.0290 0.0290 0.7649 0.7649 0.8277 0.8277 1.0209 1.0209 1.1408 1.1408 1.1769 1.1769 1.2202 1.2202 1.5245 1.5245 1.6610 1.6610 1.8037 1.8037 2.1482 2.1482 2.2906 2.2906 2.3716 2.3716 2.4387 2.4387 2.4723 2.4723 2.6041 2.6041 3.0277 3.0277 3.1981 3.1981 3.2741 3.2741 3.3561 3.3561 3.4524 3.4524 3.5970 3.5970 3.6174 3.6174 3.7762 3.7762 4.4060 4.4060 5.5959 5.5959 11.0094 11.0094 11.4401 11.4401 12.2691 12.2691 12.4566 12.4566 12.8035 12.8035 13.3507 13.3507 13.7153 13.7153 k = 0.3621 0.6248 0.1597 ( 14644 PWs) bands (ev): -16.9682 -16.9682 -16.8608 -16.8608 -16.3981 -16.3981 -16.2986 -16.2986 -16.2663 -16.2663 -16.2528 -16.2528 -12.7320 -12.7320 -12.7039 -12.7039 -1.6740 -1.6740 -1.6222 -1.6222 -1.1861 -1.1861 -0.5216 -0.5216 -0.4300 -0.4300 -0.2384 -0.2384 -0.1563 -0.1563 -0.0775 -0.0775 0.0226 0.0226 0.7528 0.7528 0.8102 0.8102 1.0340 1.0340 1.1232 1.1232 1.1754 1.1754 1.2130 1.2130 1.5270 1.5270 1.6688 1.6688 1.7929 1.7929 2.1411 2.1411 2.2883 2.2883 2.3723 2.3723 2.4515 2.4515 2.4833 2.4833 2.6167 2.6167 3.0427 3.0427 3.2026 3.2026 3.2712 3.2712 3.3683 3.3683 3.4515 3.4515 3.5933 3.5933 3.6204 3.6204 3.7934 3.7934 4.4112 4.4112 5.5837 5.5837 10.9976 10.9976 11.4199 11.4199 12.3107 12.3107 12.4386 12.4386 12.8238 12.8238 13.3214 13.3214 13.6747 13.6747 k = 0.3456 0.6192 0.1680 ( 14640 PWs) bands (ev): -16.9681 -16.9681 -16.8614 -16.8614 -16.3964 -16.3964 -16.3006 -16.3006 -16.2661 -16.2661 -16.2525 -16.2525 -12.7313 -12.7313 -12.7036 -12.7036 -1.6770 -1.6770 -1.6225 -1.6225 -1.1808 -1.1808 -0.5246 -0.5246 -0.4390 -0.4390 -0.2365 -0.2365 -0.1480 -0.1480 -0.0752 -0.0752 0.0159 0.0159 0.7336 0.7336 0.7939 0.7939 1.0464 1.0464 1.1053 1.1053 1.1695 1.1695 1.2137 1.2137 1.5304 1.5304 1.6755 1.6755 1.7825 1.7825 2.1361 2.1361 2.2868 2.2868 2.3734 2.3734 2.4638 2.4638 2.4948 2.4948 2.6305 2.6305 3.0582 3.0582 3.2083 3.2083 3.2685 3.2685 3.3819 3.3819 3.4501 3.4501 3.5899 3.5899 3.6231 3.6231 3.8162 3.8162 4.4146 4.4146 5.5703 5.5703 10.9847 10.9847 11.3898 11.3898 12.3595 12.3595 12.4240 12.4240 12.8419 12.8419 13.2932 13.2932 13.6339 13.6339 k = 0.3292 0.6136 0.1762 ( 14643 PWs) bands (ev): -16.9677 -16.9677 -16.8623 -16.8623 -16.3946 -16.3946 -16.3026 -16.3026 -16.2659 -16.2659 -16.2524 -16.2524 -12.7304 -12.7304 -12.7033 -12.7033 -1.6800 -1.6800 -1.6234 -1.6234 -1.1730 -1.1730 -0.5292 -0.5292 -0.4479 -0.4479 -0.2353 -0.2353 -0.1401 -0.1401 -0.0755 -0.0755 0.0107 0.0107 0.7080 0.7080 0.7791 0.7791 1.0556 1.0556 1.0889 1.0889 1.1600 1.1600 1.2215 1.2215 1.5342 1.5342 1.6809 1.6809 1.7726 1.7726 2.1337 2.1337 2.2863 2.2863 2.3751 2.3751 2.4756 2.4756 2.5064 2.5064 2.6452 2.6452 3.0739 3.0739 3.2147 3.2147 3.2662 3.2662 3.3973 3.3973 3.4482 3.4482 3.5869 3.5869 3.6251 3.6251 3.8446 3.8446 4.4163 4.4163 5.5558 5.5558 10.9705 10.9705 11.3524 11.3524 12.4106 12.4106 12.4148 12.4148 12.8573 12.8573 13.2667 13.2667 13.5950 13.5950 k = 0.3127 0.6080 0.1845 ( 14635 PWs) bands (ev): -16.9671 -16.9671 -16.8635 -16.8635 -16.3927 -16.3927 -16.3046 -16.3046 -16.2657 -16.2657 -16.2522 -16.2522 -12.7294 -12.7294 -12.7029 -12.7029 -1.6830 -1.6830 -1.6251 -1.6251 -1.1628 -1.1628 -0.5351 -0.5351 -0.4567 -0.4567 -0.2346 -0.2346 -0.1332 -0.1332 -0.0787 -0.0787 0.0083 0.0083 0.6765 0.6765 0.7658 0.7658 1.0547 1.0547 1.0798 1.0798 1.1499 1.1499 1.2338 1.2338 1.5383 1.5383 1.6845 1.6845 1.7631 1.7631 2.1343 2.1343 2.2869 2.2869 2.3774 2.3774 2.4870 2.4870 2.5177 2.5177 2.6606 2.6606 3.0894 3.0894 3.2217 3.2217 3.2644 3.2644 3.4146 3.4146 3.4460 3.4460 3.5843 3.5843 3.6262 3.6262 3.8783 3.8783 4.4161 4.4161 5.5402 5.5402 10.9550 10.9550 11.3100 11.3100 12.4048 12.4048 12.4682 12.4682 12.8694 12.8694 13.2426 13.2426 13.5599 13.5599 k = 0.2963 0.6024 0.1927 ( 14637 PWs) bands (ev): -16.9663 -16.9663 -16.8650 -16.8650 -16.3907 -16.3907 -16.3067 -16.3067 -16.2654 -16.2654 -16.2520 -16.2520 -12.7284 -12.7284 -12.7026 -12.7026 -1.6860 -1.6860 -1.6273 -1.6273 -1.1500 -1.1500 -0.5420 -0.5420 -0.4656 -0.4656 -0.2345 -0.2345 -0.1289 -0.1289 -0.0831 -0.0831 0.0090 0.0090 0.6399 0.6399 0.7543 0.7543 1.0410 1.0410 1.0797 1.0797 1.1413 1.1413 1.2491 1.2491 1.5421 1.5421 1.6861 1.6861 1.7541 1.7541 2.1383 2.1383 2.2890 2.2890 2.3802 2.3802 2.4980 2.4980 2.5289 2.5289 2.6763 2.6763 3.1041 3.1041 3.2286 3.2286 3.2636 3.2636 3.4326 3.4326 3.4448 3.4448 3.5821 3.5821 3.6265 3.6265 3.9169 3.9169 4.4140 4.4140 5.5233 5.5233 10.9382 10.9382 11.2642 11.2642 12.4005 12.4005 12.5241 12.5241 12.8777 12.8777 13.2218 13.2218 13.5299 13.5299 k = 0.2798 0.5967 0.2010 ( 14646 PWs) bands (ev): -16.9652 -16.9652 -16.8668 -16.8668 -16.3887 -16.3887 -16.3088 -16.3088 -16.2652 -16.2652 -16.2519 -16.2519 -12.7272 -12.7272 -12.7023 -12.7023 -1.6889 -1.6889 -1.6302 -1.6302 -1.1346 -1.1346 -0.5498 -0.5498 -0.4746 -0.4746 -0.2351 -0.2351 -0.1298 -0.1298 -0.0854 -0.0854 0.0122 0.0122 0.5987 0.5987 0.7446 0.7446 1.0235 1.0235 1.0791 1.0791 1.1353 1.1353 1.2661 1.2661 1.5454 1.5454 1.6857 1.6857 1.7455 1.7455 2.1460 2.1460 2.2926 2.2926 2.3835 2.3835 2.5085 2.5085 2.5399 2.5399 2.6919 2.6919 3.1175 3.1175 3.2345 3.2345 3.2646 3.2646 3.4378 3.4378 3.4582 3.4582 3.5803 3.5803 3.6265 3.6265 3.9597 3.9597 4.4101 4.4101 5.5051 5.5051 10.9202 10.9202 11.2165 11.2165 12.3997 12.3997 12.5792 12.5792 12.8816 12.8816 13.2049 13.2049 13.5060 13.5060 k = 0.2633 0.5911 0.2092 ( 14642 PWs) bands (ev): -16.9640 -16.9640 -16.8688 -16.8688 -16.3866 -16.3866 -16.3109 -16.3109 -16.2649 -16.2649 -16.2518 -16.2518 -12.7259 -12.7259 -12.7020 -12.7020 -1.6918 -1.6918 -1.6336 -1.6336 -1.1168 -1.1168 -0.5581 -0.5581 -0.4838 -0.4838 -0.2363 -0.2363 -0.1372 -0.1372 -0.0831 -0.0831 0.0172 0.0172 0.5538 0.5538 0.7368 0.7368 1.0053 1.0053 1.0752 1.0752 1.1324 1.1324 1.2841 1.2841 1.5478 1.5478 1.6832 1.6832 1.7371 1.7371 2.1576 2.1576 2.2979 2.2979 2.3873 2.3873 2.5184 2.5184 2.5509 2.5509 2.7070 2.7070 3.1293 3.1293 3.2378 3.2378 3.2688 3.2688 3.4353 3.4353 3.4808 3.4808 3.5789 3.5789 3.6269 3.6269 4.0063 4.0063 4.4042 4.4042 5.4855 5.4855 10.9009 10.9009 11.1678 11.1678 12.4025 12.4025 12.6326 12.6326 12.8812 12.8812 13.1923 13.1923 13.4886 13.4886 k = 0.2469 0.5855 0.2175 ( 14643 PWs) bands (ev): -16.9625 -16.9625 -16.8710 -16.8710 -16.3844 -16.3844 -16.3131 -16.3131 -16.2646 -16.2646 -16.2517 -16.2517 -12.7246 -12.7246 -12.7017 -12.7017 -1.6947 -1.6947 -1.6374 -1.6374 -1.0964 -1.0964 -0.5665 -0.5665 -0.4933 -0.4933 -0.2381 -0.2381 -0.1488 -0.1488 -0.0777 -0.0777 0.0231 0.0231 0.5059 0.5059 0.7308 0.7308 0.9870 0.9870 1.0687 1.0687 1.1318 1.1318 1.3024 1.3024 1.5491 1.5491 1.6790 1.6790 1.7288 1.7288 2.1729 2.1729 2.3048 2.3048 2.3914 2.3914 2.5273 2.5273 2.5620 2.5620 2.7213 2.7213 3.1392 3.1392 3.2382 3.2382 3.2761 3.2761 3.4323 3.4323 3.5043 3.5043 3.5777 3.5777 3.6290 3.6290 4.0561 4.0561 4.3965 4.3965 5.4646 5.4646 10.8805 10.8805 11.1189 11.1189 12.4088 12.4088 12.6835 12.6835 12.8766 12.8766 13.1842 13.1842 13.4754 13.4754 k = 0.2304 0.5799 0.2257 ( 14641 PWs) bands (ev): -16.9609 -16.9609 -16.8735 -16.8735 -16.3822 -16.3822 -16.3153 -16.3153 -16.2643 -16.2643 -16.2516 -16.2516 -12.7232 -12.7232 -12.7014 -12.7014 -1.6974 -1.6974 -1.6417 -1.6417 -1.0736 -1.0736 -0.5749 -0.5749 -0.5031 -0.5031 -0.2403 -0.2403 -0.1622 -0.1622 -0.0712 -0.0712 0.0296 0.0296 0.4557 0.4557 0.7265 0.7265 0.9688 0.9688 1.0612 1.0612 1.1322 1.1322 1.3206 1.3206 1.5491 1.5491 1.6731 1.6731 1.7204 1.7204 2.1917 2.1917 2.3135 2.3135 2.3959 2.3959 2.5352 2.5352 2.5734 2.5734 2.7343 2.7343 3.1473 3.1473 3.2364 3.2364 3.2854 3.2854 3.4294 3.4294 3.5264 3.5264 3.5765 3.5765 3.6346 3.6346 4.1088 4.1088 4.3869 4.3869 5.4420 5.4420 10.8592 10.8592 11.0705 11.0705 12.4188 12.4188 12.7311 12.7311 12.8686 12.8686 13.1805 13.1805 13.4289 13.4289 k = 0.2140 0.5743 0.2340 ( 14640 PWs) bands (ev): -16.9590 -16.9590 -16.8761 -16.8761 -16.3800 -16.3800 -16.3175 -16.3175 -16.2640 -16.2640 -16.2515 -16.2515 -12.7218 -12.7218 -12.7012 -12.7012 -1.7000 -1.7000 -1.6462 -1.6462 -1.0485 -1.0485 -0.5830 -0.5830 -0.5133 -0.5133 -0.2429 -0.2429 -0.1763 -0.1763 -0.0647 -0.0647 0.0362 0.0362 0.4041 0.4041 0.7238 0.7238 0.9508 0.9508 1.0537 1.0537 1.1328 1.1328 1.3383 1.3383 1.5477 1.5477 1.6659 1.6659 1.7120 1.7120 2.2135 2.2135 2.3238 2.3238 2.4007 2.4007 2.5421 2.5421 2.5850 2.5850 2.7458 2.7458 3.1537 3.1537 3.2333 3.2333 3.2956 3.2956 3.4268 3.4268 3.5443 3.5443 3.5752 3.5752 3.6465 3.6465 4.1638 4.1638 4.3753 4.3753 5.4179 5.4179 10.8373 10.8373 11.0232 11.0232 12.4324 12.4324 12.7750 12.7750 12.8583 12.8583 13.1811 13.1811 13.3688 13.3688 k = 0.1975 0.5687 0.2422 ( 14642 PWs) bands (ev): -16.9570 -16.9570 -16.8790 -16.8790 -16.3777 -16.3777 -16.3197 -16.3197 -16.2637 -16.2637 -16.2515 -16.2515 -12.7204 -12.7204 -12.7010 -12.7010 -1.7024 -1.7024 -1.6510 -1.6510 -1.0210 -1.0210 -0.5906 -0.5906 -0.5237 -0.5237 -0.2458 -0.2458 -0.1903 -0.1903 -0.0592 -0.0592 0.0428 0.0428 0.3521 0.3521 0.7226 0.7226 0.9331 0.9331 1.0468 1.0468 1.1334 1.1334 1.3552 1.3552 1.5452 1.5452 1.6576 1.6576 1.7036 1.7036 2.2378 2.2378 2.3356 2.3356 2.4056 2.4056 2.5480 2.5480 2.5967 2.5967 2.7556 2.7556 3.1586 3.1586 3.2293 3.2293 3.3058 3.3058 3.4246 3.4246 3.5560 3.5560 3.5741 3.5741 3.6663 3.6663 4.2208 4.2208 4.3619 4.3619 5.3920 5.3920 10.8151 10.8151 10.9774 10.9774 12.4496 12.4496 12.8144 12.8144 12.8467 12.8467 13.1855 13.1855 13.3104 13.3104 k = 0.1810 0.5631 0.2504 ( 14644 PWs) bands (ev): -16.9547 -16.9547 -16.8820 -16.8820 -16.3754 -16.3754 -16.3220 -16.3220 -16.2635 -16.2635 -16.2514 -16.2514 -12.7189 -12.7189 -12.7009 -12.7009 -1.7046 -1.7046 -1.6560 -1.6560 -0.9914 -0.9914 -0.5974 -0.5974 -0.5343 -0.5343 -0.2489 -0.2489 -0.2039 -0.2039 -0.0553 -0.0553 0.0491 0.0491 0.3009 0.3009 0.7226 0.7226 0.9159 0.9159 1.0411 1.0411 1.1334 1.1334 1.3714 1.3714 1.5416 1.5416 1.6486 1.6486 1.6951 1.6951 2.2640 2.2640 2.3487 2.3487 2.4107 2.4107 2.5529 2.5529 2.6083 2.6083 2.7634 2.7634 3.1623 3.1623 3.2247 3.2247 3.3157 3.3157 3.4229 3.4229 3.5614 3.5614 3.5741 3.5741 3.6929 3.6929 4.2792 4.2792 4.3467 4.3467 5.3644 5.3644 10.7929 10.7929 10.9336 10.9336 12.4702 12.4702 12.8337 12.8337 12.8500 12.8500 13.1928 13.1928 13.2559 13.2559 k = 0.1646 0.5575 0.2587 ( 14641 PWs) bands (ev): -16.9523 -16.9523 -16.8852 -16.8852 -16.3731 -16.3731 -16.3242 -16.3242 -16.2632 -16.2632 -16.2514 -16.2514 -12.7174 -12.7174 -12.7009 -12.7009 -1.7065 -1.7065 -1.6611 -1.6611 -0.9597 -0.9597 -0.6034 -0.6034 -0.5448 -0.5448 -0.2520 -0.2520 -0.2171 -0.2171 -0.0544 -0.0544 0.0550 0.0550 0.2519 0.2519 0.7237 0.7237 0.8991 0.8991 1.0369 1.0369 1.1329 1.1329 1.3866 1.3866 1.5372 1.5372 1.6392 1.6392 1.6867 1.6867 2.2911 2.2911 2.3631 2.3631 2.4159 2.4159 2.5571 2.5571 2.6196 2.6196 2.7690 2.7690 3.1648 3.1648 3.2194 3.2194 3.3249 3.3249 3.4216 3.4216 3.5620 3.5620 3.5756 3.5756 3.7241 3.7241 4.3293 4.3293 4.3392 4.3392 5.3349 5.3349 10.7711 10.7711 10.8922 10.8922 12.4942 12.4942 12.8225 12.8225 12.8789 12.8789 13.1882 13.1882 13.2203 13.2203 k = 0.1481 0.5519 0.2669 ( 14642 PWs) bands (ev): -16.9498 -16.9498 -16.8885 -16.8885 -16.3708 -16.3708 -16.3265 -16.3265 -16.2630 -16.2630 -16.2514 -16.2514 -12.7160 -12.7160 -12.7009 -12.7009 -1.7081 -1.7081 -1.6662 -1.6662 -0.9263 -0.9263 -0.6085 -0.6085 -0.5551 -0.5551 -0.2554 -0.2554 -0.2296 -0.2296 -0.0579 -0.0579 0.0604 0.0604 0.2074 0.2074 0.7257 0.7257 0.8828 0.8828 1.0343 1.0343 1.1316 1.1316 1.4009 1.4009 1.5321 1.5321 1.6297 1.6297 1.6781 1.6781 2.3184 2.3184 2.3787 2.3787 2.4211 2.4211 2.5606 2.5606 2.6304 2.6304 2.7724 2.7724 3.1665 3.1665 3.2138 3.2138 3.3335 3.3335 3.4206 3.4206 3.5609 3.5609 3.5776 3.5776 3.7578 3.7578 4.3108 4.3108 4.3994 4.3994 5.3033 5.3033 10.7502 10.7502 10.8534 10.8534 12.5213 12.5213 12.8121 12.8121 12.9021 12.9021 13.1455 13.1455 13.2303 13.2303 k = 0.1317 0.5463 0.2752 ( 14637 PWs) bands (ev): -16.9470 -16.9470 -16.8919 -16.8919 -16.3684 -16.3684 -16.3287 -16.3287 -16.2627 -16.2627 -16.2514 -16.2514 -12.7145 -12.7145 -12.7010 -12.7010 -1.7093 -1.7093 -1.6713 -1.6713 -0.8915 -0.8915 -0.6126 -0.6126 -0.5647 -0.5647 -0.2598 -0.2598 -0.2410 -0.2410 -0.0679 -0.0679 0.0651 0.0651 0.1699 0.1699 0.7284 0.7284 0.8672 0.8672 1.0334 1.0334 1.1294 1.1294 1.4142 1.4142 1.5265 1.5265 1.6208 1.6208 1.6695 1.6695 2.3445 2.3445 2.3954 2.3954 2.4266 2.4266 2.5635 2.5635 2.6405 2.6405 2.7734 2.7734 3.1674 3.1674 3.2079 3.2079 3.3413 3.3413 3.4194 3.4194 3.5596 3.5596 3.5793 3.5793 3.7930 3.7930 4.2903 4.2903 4.4601 4.4601 5.2697 5.2697 10.7304 10.7304 10.8176 10.8176 12.5513 12.5513 12.8033 12.8033 12.9186 12.9186 13.1002 13.1002 13.2509 13.2509 k = 0.1152 0.5406 0.2834 ( 14626 PWs) bands (ev): -16.9442 -16.9442 -16.8954 -16.8954 -16.3661 -16.3661 -16.3310 -16.3310 -16.2625 -16.2625 -16.2514 -16.2514 -12.7131 -12.7131 -12.7012 -12.7012 -1.7101 -1.7101 -1.6763 -1.6763 -0.8556 -0.8556 -0.6160 -0.6160 -0.5727 -0.5727 -0.2673 -0.2673 -0.2493 -0.2493 -0.0859 -0.0859 0.0693 0.0693 0.1417 0.1417 0.7317 0.7317 0.8523 0.8523 1.0343 1.0343 1.1263 1.1263 1.4265 1.4265 1.5208 1.5208 1.6128 1.6128 1.6608 1.6608 2.3681 2.3681 2.4130 2.4130 2.4329 2.4329 2.5658 2.5658 2.6501 2.6501 2.7720 2.7720 3.1677 3.1677 3.2020 3.2020 3.3485 3.3485 3.4181 3.4181 3.5588 3.5588 3.5806 3.5806 3.8289 3.8289 4.2681 4.2681 4.5209 4.5209 5.2340 5.2340 10.7123 10.7123 10.7849 10.7849 12.5838 12.5838 12.7967 12.7967 12.9277 12.9277 13.0582 13.0582 13.2763 13.2763 k = 0.0988 0.5350 0.2917 ( 14631 PWs) bands (ev): -16.9411 -16.9411 -16.8989 -16.8989 -16.3638 -16.3638 -16.3332 -16.3332 -16.2623 -16.2623 -16.2514 -16.2514 -12.7118 -12.7118 -12.7015 -12.7015 -1.7106 -1.7106 -1.6811 -1.6811 -0.8196 -0.8196 -0.6193 -0.6193 -0.5779 -0.5779 -0.2801 -0.2801 -0.2533 -0.2533 -0.1114 -0.1114 0.0728 0.0728 0.1232 0.1232 0.7356 0.7356 0.8382 0.8382 1.0369 1.0369 1.1222 1.1222 1.4377 1.4377 1.5151 1.5151 1.6060 1.6060 1.6521 1.6521 2.3879 2.3879 2.4275 2.4275 2.4441 2.4441 2.5675 2.5675 2.6589 2.6589 2.7682 2.7682 3.1678 3.1678 3.1962 3.1962 3.3552 3.3552 3.4161 3.4161 3.5589 3.5589 3.5815 3.5815 3.8650 3.8650 4.2444 4.2444 4.5814 4.5814 5.1961 5.1961 10.6961 10.6961 10.7558 10.7558 12.6184 12.6184 12.7926 12.7926 12.9285 12.9285 13.0208 13.0208 13.3060 13.3060 k = 0.0823 0.5294 0.2999 ( 14631 PWs) bands (ev): -16.9380 -16.9380 -16.9025 -16.9025 -16.3616 -16.3616 -16.3354 -16.3354 -16.2621 -16.2621 -16.2514 -16.2514 -12.7105 -12.7105 -12.7018 -12.7018 -1.7106 -1.7106 -1.6857 -1.6857 -0.7844 -0.7844 -0.6238 -0.6238 -0.5779 -0.5779 -0.2978 -0.2978 -0.2546 -0.2546 -0.1409 -0.1409 0.0759 0.0759 0.1125 0.1125 0.7400 0.7400 0.8248 0.8248 1.0412 1.0412 1.1170 1.1170 1.4477 1.4477 1.5094 1.5094 1.6009 1.6009 1.6435 1.6435 2.4038 2.4038 2.4346 2.4346 2.4636 2.4636 2.5685 2.5685 2.6672 2.6672 2.7623 2.7623 3.1676 3.1676 3.1907 3.1907 3.3614 3.3614 3.4136 3.4136 3.5598 3.5598 3.5820 3.5820 3.9010 3.9010 4.2191 4.2191 4.6413 4.6413 5.1560 5.1560 10.6824 10.6824 10.7302 10.7302 12.6546 12.6546 12.7914 12.7914 12.9205 12.9205 12.9887 12.9887 13.3396 13.3396 k = 0.0658 0.5238 0.3082 ( 14627 PWs) bands (ev): -16.9347 -16.9347 -16.9062 -16.9062 -16.3594 -16.3594 -16.3376 -16.3376 -16.2620 -16.2620 -16.2514 -16.2514 -12.7092 -12.7092 -12.7023 -12.7023 -1.7101 -1.7101 -1.6900 -1.6900 -0.7516 -0.7516 -0.6301 -0.6301 -0.5707 -0.5707 -0.3209 -0.3209 -0.2543 -0.2543 -0.1700 -0.1700 0.0788 0.0788 0.1068 0.1068 0.7450 0.7450 0.8124 0.8124 1.0469 1.0469 1.1109 1.1109 1.4567 1.4567 1.5039 1.5039 1.5976 1.5976 1.6350 1.6350 2.4162 2.4162 2.4388 2.4388 2.4854 2.4854 2.5687 2.5687 2.6752 2.6752 2.7545 2.7545 3.1676 3.1676 3.1857 3.1857 3.3674 3.3674 3.4104 3.4104 3.5614 3.5614 3.5820 3.5820 3.9367 3.9367 4.1924 4.1924 4.7002 4.7002 5.1137 5.1137 10.6714 10.6714 10.7084 10.7084 12.6917 12.6917 12.7933 12.7933 12.9045 12.9045 12.9614 12.9614 13.3768 13.3768 k = 0.0494 0.5182 0.3164 ( 14630 PWs) bands (ev): -16.9314 -16.9314 -16.9099 -16.9099 -16.3573 -16.3573 -16.3396 -16.3396 -16.2619 -16.2619 -16.2514 -16.2514 -12.7081 -12.7081 -12.7028 -12.7028 -1.7092 -1.7092 -1.6940 -1.6940 -0.7231 -0.7231 -0.6380 -0.6380 -0.5551 -0.5551 -0.3502 -0.3502 -0.2526 -0.2526 -0.1947 -0.1947 0.0814 0.0814 0.1038 0.1038 0.7506 0.7506 0.8008 0.8008 1.0538 1.0538 1.1038 1.1038 1.4645 1.4645 1.4986 1.4986 1.5964 1.5964 1.6269 1.6269 2.4258 2.4258 2.4416 2.4416 2.5062 2.5062 2.5677 2.5677 2.6833 2.6833 2.7450 2.7450 3.1678 3.1678 3.1812 3.1812 3.3731 3.3731 3.4066 3.4066 3.5634 3.5634 3.5817 3.5817 3.9718 3.9718 4.1643 4.1643 4.7579 4.7579 5.0691 5.0691 10.6633 10.6633 10.6905 10.6905 12.7288 12.7288 12.7988 12.7988 12.8837 12.8837 12.9361 12.9361 13.4172 13.4172 k = 0.0329 0.5126 0.3246 ( 14638 PWs) bands (ev): -16.9279 -16.9279 -16.9135 -16.9135 -16.3555 -16.3555 -16.3414 -16.3414 -16.2618 -16.2618 -16.2514 -16.2514 -12.7070 -12.7070 -12.7035 -12.7035 -1.7078 -1.7078 -1.6976 -1.6976 -0.7000 -0.7000 -0.6469 -0.6469 -0.5309 -0.5309 -0.3852 -0.3852 -0.2494 -0.2494 -0.2137 -0.2137 0.0836 0.0836 0.1021 0.1021 0.7568 0.7568 0.7903 0.7903 1.0616 1.0616 1.0959 1.0959 1.4714 1.4714 1.4934 1.4934 1.5970 1.5970 1.6195 1.6195 2.4328 2.4328 2.4433 2.4433 2.5246 2.5246 2.5649 2.5649 2.6918 2.6918 2.7346 2.7346 3.1684 3.1684 3.1774 3.1774 3.3784 3.3784 3.4024 3.4024 3.5654 3.5654 3.5810 3.5810 4.0063 4.0063 4.1349 4.1349 4.8142 4.8142 5.0224 5.0224 10.6585 10.6585 10.6765 10.6765 12.7644 12.7644 12.8088 12.8088 12.8618 12.8618 12.9099 12.9099 13.4603 13.4603 k = 0.0165 0.5070 0.3329 ( 14643 PWs) bands (ev): -16.9244 -16.9244 -16.9172 -16.9172 -16.3541 -16.3541 -16.3428 -16.3428 -16.2618 -16.2618 -16.2514 -16.2514 -12.7059 -12.7059 -12.7042 -12.7042 -1.7060 -1.7060 -1.7008 -1.7008 -0.6822 -0.6822 -0.6569 -0.6569 -0.4992 -0.4992 -0.4235 -0.4235 -0.2445 -0.2445 -0.2275 -0.2275 0.0851 0.0851 0.1012 0.1012 0.7638 0.7638 0.7806 0.7806 1.0700 1.0700 1.0875 1.0875 1.4775 1.4775 1.4883 1.4883 1.5991 1.5991 1.6133 1.6133 2.4372 2.4372 2.4441 2.4441 2.5398 2.5398 2.5598 2.5598 2.7007 2.7007 2.7240 2.7240 3.1694 3.1694 3.1743 3.1743 3.3831 3.3831 3.3985 3.3985 3.5670 3.5670 3.5804 3.5804 4.0399 4.0399 4.1043 4.1043 4.8687 4.8687 4.9737 4.9737 10.6572 10.6572 10.6665 10.6665 12.7954 12.7954 12.8247 12.8247 12.8417 12.8417 12.8816 12.8816 13.5056 13.5056 k = 0.0000 0.5014 0.3411 ( 14634 PWs) bands (ev): -16.9209 -16.9209 -16.9207 -16.9207 -16.3535 -16.3535 -16.3433 -16.3433 -16.2617 -16.2617 -16.2514 -16.2514 -12.7050 -12.7050 -12.7050 -12.7050 -1.7037 -1.7037 -1.7035 -1.7035 -0.6692 -0.6692 -0.6675 -0.6675 -0.4638 -0.4638 -0.4611 -0.4611 -0.2378 -0.2378 -0.2370 -0.2370 0.0857 0.0857 0.1009 0.1009 0.7704 0.7704 0.7732 0.7732 1.0788 1.0788 1.0788 1.0788 1.4823 1.4823 1.4838 1.4838 1.6008 1.6008 1.6103 1.6103 2.4388 2.4388 2.4442 2.4442 2.5504 2.5504 2.5527 2.5527 2.7072 2.7072 2.7169 2.7169 3.1704 3.1704 3.1726 3.1726 3.3854 3.3854 3.3964 3.3964 3.5676 3.5676 3.5801 3.5801 4.0725 4.0725 4.0728 4.0728 4.9151 4.9151 4.9293 4.9293 10.6583 10.6583 10.6615 10.6615 12.8188 12.8188 12.8188 12.8188 12.8525 12.8525 12.8527 12.8527 13.5520 13.5520 k = 0.0000 0.5014 0.3411 ( 14634 PWs) bands (ev): -16.9209 -16.9209 -16.9207 -16.9207 -16.3535 -16.3535 -16.3433 -16.3433 -16.2617 -16.2617 -16.2514 -16.2514 -12.7050 -12.7050 -12.7050 -12.7050 -1.7037 -1.7037 -1.7035 -1.7035 -0.6692 -0.6692 -0.6675 -0.6675 -0.4638 -0.4638 -0.4611 -0.4611 -0.2378 -0.2378 -0.2370 -0.2370 0.0857 0.0857 0.1009 0.1009 0.7704 0.7704 0.7732 0.7732 1.0788 1.0788 1.0788 1.0788 1.4823 1.4823 1.4838 1.4838 1.6008 1.6008 1.6103 1.6103 2.4388 2.4388 2.4442 2.4442 2.5504 2.5504 2.5527 2.5527 2.7072 2.7072 2.7169 2.7169 3.1704 3.1704 3.1726 3.1726 3.3854 3.3854 3.3964 3.3964 3.5676 3.5676 3.5801 3.5801 4.0725 4.0725 4.0728 4.0728 4.9151 4.9151 4.9293 4.9293 10.6583 10.6583 10.6615 10.6615 12.8188 12.8188 12.8188 12.8188 12.8525 12.8525 12.8527 12.8527 13.5520 13.5520 k = 0.0100 0.4921 0.3548 ( 14640 PWs) bands (ev): -16.9209 -16.9209 -16.9207 -16.9207 -16.3535 -16.3535 -16.3432 -16.3432 -16.2618 -16.2618 -16.2514 -16.2514 -12.7050 -12.7050 -12.7050 -12.7050 -1.7035 -1.7035 -1.7032 -1.7032 -0.6688 -0.6688 -0.6667 -0.6667 -0.4637 -0.4637 -0.4610 -0.4610 -0.2382 -0.2382 -0.2368 -0.2368 0.0846 0.0846 0.0998 0.0998 0.7715 0.7715 0.7743 0.7743 1.0776 1.0776 1.0801 1.0801 1.4801 1.4801 1.4824 1.4824 1.6025 1.6025 1.6119 1.6119 2.4383 2.4383 2.4438 2.4438 2.5501 2.5501 2.5531 2.5531 2.7074 2.7074 2.7173 2.7173 3.1701 3.1701 3.1724 3.1724 3.3852 3.3852 3.3964 3.3964 3.5675 3.5675 3.5801 3.5801 4.0695 4.0695 4.0700 4.0700 4.9167 4.9167 4.9309 4.9309 10.6602 10.6602 10.6634 10.6634 12.8078 12.8078 12.8146 12.8146 12.8567 12.8567 12.8637 12.8637 13.5472 13.5472 k = 0.0200 0.4828 0.3684 ( 14632 PWs) bands (ev): -16.9209 -16.9209 -16.9207 -16.9207 -16.3534 -16.3534 -16.3431 -16.3431 -16.2620 -16.2620 -16.2516 -16.2516 -12.7051 -12.7051 -12.7051 -12.7051 -1.7028 -1.7028 -1.7024 -1.7024 -0.6677 -0.6677 -0.6644 -0.6644 -0.4634 -0.4634 -0.4608 -0.4608 -0.2390 -0.2390 -0.2365 -0.2365 0.0814 0.0814 0.0965 0.0965 0.7748 0.7748 0.7775 0.7775 1.0768 1.0768 1.0816 1.0816 1.4745 1.4745 1.4782 1.4782 1.6072 1.6072 1.6163 1.6163 2.4369 2.4369 2.4427 2.4427 2.5495 2.5495 2.5540 2.5540 2.7082 2.7082 2.7186 2.7186 3.1692 3.1692 3.1716 3.1716 3.3850 3.3850 3.3963 3.3963 3.5673 3.5673 3.5802 3.5802 4.0608 4.0608 4.0616 4.0616 4.9216 4.9216 4.9357 4.9357 10.6658 10.6658 10.6690 10.6690 12.7918 12.7918 12.7999 12.7999 12.8712 12.8712 12.8798 12.8798 13.5345 13.5345 k = 0.0300 0.4735 0.3821 ( 14624 PWs) bands (ev): -16.9209 -16.9209 -16.9206 -16.9206 -16.3531 -16.3531 -16.3428 -16.3428 -16.2623 -16.2623 -16.2518 -16.2518 -12.7052 -12.7052 -12.7052 -12.7052 -1.7016 -1.7016 -1.7010 -1.7010 -0.6655 -0.6655 -0.6609 -0.6609 -0.4630 -0.4630 -0.4603 -0.4603 -0.2399 -0.2399 -0.2364 -0.2364 0.0762 0.0762 0.0913 0.0913 0.7800 0.7800 0.7824 0.7824 1.0762 1.0762 1.0832 1.0832 1.4666 1.4666 1.4716 1.4716 1.6139 1.6139 1.6226 1.6226 2.4348 2.4348 2.4410 2.4410 2.5489 2.5489 2.5550 2.5550 2.7096 2.7096 2.7205 2.7205 3.1677 3.1677 3.1703 3.1703 3.3845 3.3845 3.3962 3.3962 3.5669 3.5669 3.5802 3.5802 4.0467 4.0467 4.0479 4.0479 4.9294 4.9294 4.9434 4.9434 10.6751 10.6751 10.6784 10.6784 12.7743 12.7743 12.7825 12.7825 12.8886 12.8886 12.8975 12.8975 13.5168 13.5168 k = 0.0400 0.4642 0.3957 ( 14626 PWs) bands (ev): -16.9208 -16.9208 -16.9206 -16.9206 -16.3528 -16.3528 -16.3424 -16.3424 -16.2628 -16.2628 -16.2522 -16.2522 -12.7054 -12.7054 -12.7053 -12.7053 -1.6999 -1.6999 -1.6991 -1.6991 -0.6624 -0.6624 -0.6563 -0.6563 -0.4625 -0.4625 -0.4595 -0.4595 -0.2410 -0.2410 -0.2365 -0.2365 0.0693 0.0693 0.0842 0.0842 0.7865 0.7865 0.7886 0.7886 1.0762 1.0762 1.0850 1.0850 1.4577 1.4577 1.4638 1.4638 1.6216 1.6216 1.6299 1.6299 2.4324 2.4324 2.4390 2.4390 2.5484 2.5484 2.5558 2.5558 2.7114 2.7114 2.7228 2.7228 3.1655 3.1655 3.1685 3.1685 3.3839 3.3839 3.3960 3.3960 3.5663 3.5663 3.5803 3.5803 4.0276 4.0276 4.0293 4.0293 4.9398 4.9398 4.9536 4.9536 10.6880 10.6880 10.6912 10.6912 12.7560 12.7560 12.7640 12.7640 12.9073 12.9073 12.9161 12.9161 13.4964 13.4964 k = 0.0500 0.4550 0.4094 ( 14614 PWs) bands (ev): -16.9207 -16.9207 -16.9205 -16.9205 -16.3524 -16.3524 -16.3419 -16.3419 -16.2634 -16.2634 -16.2527 -16.2527 -12.7056 -12.7056 -12.7055 -12.7055 -1.6977 -1.6977 -1.6968 -1.6968 -0.6583 -0.6583 -0.6505 -0.6505 -0.4619 -0.4619 -0.4584 -0.4584 -0.2421 -0.2421 -0.2367 -0.2367 0.0610 0.0610 0.0757 0.0757 0.7938 0.7938 0.7957 0.7957 1.0768 1.0768 1.0869 1.0869 1.4488 1.4488 1.4557 1.4557 1.6295 1.6295 1.6376 1.6376 2.4299 2.4299 2.4370 2.4370 2.5480 2.5480 2.5563 2.5563 2.7137 2.7137 2.7255 2.7255 3.1627 3.1627 3.1659 3.1659 3.3833 3.3833 3.3959 3.3959 3.5656 3.5656 3.5803 3.5803 4.0043 4.0043 4.0063 4.0063 4.9523 4.9523 4.9659 4.9659 10.7043 10.7043 10.7076 10.7076 12.7371 12.7371 12.7446 12.7446 12.9270 12.9270 12.9356 12.9356 13.4754 13.4754 k = 0.0600 0.4457 0.4230 ( 14610 PWs) bands (ev): -16.9206 -16.9206 -16.9204 -16.9204 -16.3519 -16.3519 -16.3412 -16.3412 -16.2641 -16.2641 -16.2532 -16.2532 -12.7058 -12.7058 -12.7057 -12.7057 -1.6951 -1.6951 -1.6940 -1.6940 -0.6535 -0.6535 -0.6437 -0.6437 -0.4614 -0.4614 -0.4569 -0.4569 -0.2432 -0.2432 -0.2371 -0.2371 0.0516 0.0516 0.0661 0.0661 0.8009 0.8009 0.8031 0.8031 1.0783 1.0783 1.0891 1.0891 1.4406 1.4406 1.4481 1.4481 1.6368 1.6368 1.6448 1.6448 2.4278 2.4278 2.4353 2.4353 2.5477 2.5477 2.5566 2.5566 2.7163 2.7163 2.7282 2.7282 3.1591 3.1591 3.1627 3.1627 3.3826 3.3826 3.3957 3.3957 3.5649 3.5649 3.5802 3.5802 3.9772 3.9772 3.9796 3.9796 4.9665 4.9665 4.9799 4.9799 10.7238 10.7238 10.7271 10.7271 12.7175 12.7175 12.7245 12.7245 12.9478 12.9478 12.9561 12.9561 13.4548 13.4548 k = 0.0700 0.4364 0.4367 ( 14606 PWs) bands (ev): -16.9205 -16.9205 -16.9203 -16.9203 -16.3514 -16.3514 -16.3405 -16.3405 -16.2649 -16.2649 -16.2539 -16.2539 -12.7060 -12.7060 -12.7060 -12.7060 -1.6922 -1.6922 -1.6909 -1.6909 -0.6479 -0.6479 -0.6360 -0.6360 -0.4610 -0.4610 -0.4550 -0.4550 -0.2443 -0.2443 -0.2375 -0.2375 0.0414 0.0414 0.0556 0.0556 0.8070 0.8070 0.8102 0.8102 1.0806 1.0806 1.0914 1.0914 1.4339 1.4339 1.4417 1.4417 1.6432 1.6432 1.6512 1.6512 2.4264 2.4264 2.4343 2.4343 2.5473 2.5473 2.5566 2.5566 2.7190 2.7190 2.7309 2.7309 3.1549 3.1549 3.1586 3.1586 3.3820 3.3820 3.3955 3.3955 3.5640 3.5640 3.5799 3.5799 3.9471 3.9471 3.9498 3.9498 4.9819 4.9819 4.9951 4.9951 10.7462 10.7462 10.7496 10.7496 12.6973 12.6973 12.7038 12.7038 12.9697 12.9697 12.9777 12.9777 13.4357 13.4357 k = 0.0800 0.4271 0.4503 ( 14620 PWs) bands (ev): -16.9204 -16.9204 -16.9202 -16.9202 -16.3508 -16.3508 -16.3397 -16.3397 -16.2658 -16.2658 -16.2546 -16.2546 -12.7063 -12.7063 -12.7063 -12.7063 -1.6888 -1.6888 -1.6875 -1.6875 -0.6418 -0.6418 -0.6274 -0.6274 -0.4608 -0.4608 -0.4525 -0.4525 -0.2452 -0.2452 -0.2381 -0.2381 0.0307 0.0307 0.0446 0.0446 0.8117 0.8117 0.8165 0.8165 1.0837 1.0837 1.0937 1.0937 1.4294 1.4294 1.4372 1.4372 1.6484 1.6484 1.6564 1.6564 2.4260 2.4260 2.4343 2.4343 2.5469 2.5469 2.5563 2.5563 2.7217 2.7217 2.7332 2.7332 3.1499 3.1499 3.1538 3.1538 3.3814 3.3814 3.3953 3.3953 3.5630 3.5630 3.5794 3.5794 3.9146 3.9146 3.9176 3.9176 4.9980 4.9980 5.0111 5.0111 10.7714 10.7714 10.7748 10.7748 12.6765 12.6765 12.6826 12.6826 12.9926 12.9926 13.0002 13.0002 13.4186 13.4186 k = 0.0900 0.4178 0.4639 ( 14618 PWs) bands (ev): -16.9203 -16.9203 -16.9200 -16.9200 -16.3501 -16.3501 -16.3388 -16.3388 -16.2668 -16.2668 -16.2554 -16.2554 -12.7066 -12.7066 -12.7065 -12.7065 -1.6852 -1.6852 -1.6838 -1.6838 -0.6353 -0.6353 -0.6182 -0.6182 -0.4607 -0.4607 -0.4496 -0.4496 -0.2459 -0.2459 -0.2388 -0.2388 0.0197 0.0197 0.0334 0.0334 0.8144 0.8144 0.8213 0.8213 1.0873 1.0873 1.0959 1.0959 1.4276 1.4276 1.4351 1.4351 1.6521 1.6521 1.6603 1.6603 2.4270 2.4270 2.4356 2.4356 2.5464 2.5464 2.5557 2.5557 2.7241 2.7241 2.7353 2.7353 3.1441 3.1441 3.1481 3.1481 3.3810 3.3810 3.3952 3.3952 3.5618 3.5618 3.5785 3.5785 3.8805 3.8805 3.8838 3.8838 5.0146 5.0146 5.0274 5.0274 10.7989 10.7989 10.8023 10.8023 12.6554 12.6554 12.6610 12.6610 13.0164 13.0164 13.0237 13.0237 13.4038 13.4038 k = 0.1000 0.4085 0.4776 ( 14618 PWs) bands (ev): -16.9201 -16.9201 -16.9199 -16.9199 -16.3493 -16.3493 -16.3378 -16.3378 -16.2679 -16.2679 -16.2562 -16.2562 -12.7069 -12.7069 -12.7069 -12.7069 -1.6814 -1.6814 -1.6798 -1.6798 -0.6285 -0.6285 -0.6083 -0.6083 -0.4607 -0.4607 -0.4462 -0.4462 -0.2463 -0.2463 -0.2394 -0.2394 0.0088 0.0088 0.0221 0.0221 0.8149 0.8149 0.8243 0.8243 1.0909 1.0909 1.0979 1.0979 1.4290 1.4290 1.4359 1.4359 1.6543 1.6543 1.6627 1.6627 2.4294 2.4294 2.4384 2.4384 2.5459 2.5459 2.5550 2.5550 2.7260 2.7260 2.7368 2.7368 3.1375 3.1375 3.1416 3.1416 3.3806 3.3806 3.3949 3.3949 3.5604 3.5604 3.5772 3.5772 3.8454 3.8454 3.8491 3.8491 5.0311 5.0311 5.0438 5.0438 10.8284 10.8284 10.8319 10.8319 12.6340 12.6340 12.6391 12.6391 13.0409 13.0409 13.0479 13.0479 13.3919 13.3919 k = 0.1100 0.3993 0.4912 ( 14616 PWs) bands (ev): -16.9200 -16.9200 -16.9198 -16.9198 -16.3485 -16.3485 -16.3367 -16.3367 -16.2691 -16.2691 -16.2571 -16.2571 -12.7072 -12.7072 -12.7072 -12.7072 -1.6774 -1.6774 -1.6757 -1.6757 -0.6215 -0.6215 -0.5981 -0.5981 -0.4610 -0.4610 -0.4424 -0.4424 -0.2463 -0.2463 -0.2400 -0.2400 -0.0018 -0.0018 0.0111 0.0111 0.8133 0.8133 0.8253 0.8253 1.0937 1.0937 1.0997 1.0997 1.4337 1.4337 1.4401 1.4401 1.6551 1.6551 1.6637 1.6637 2.4335 2.4335 2.4429 2.4429 2.5453 2.5453 2.5541 2.5541 2.7274 2.7274 2.7377 2.7377 3.1302 3.1302 3.1343 3.1343 3.3804 3.3804 3.3946 3.3946 3.5586 3.5586 3.5753 3.5753 3.8102 3.8102 3.8141 3.8141 5.0475 5.0475 5.0600 5.0600 10.8596 10.8596 10.8631 10.8631 12.6124 12.6124 12.6172 12.6172 13.0657 13.0657 13.0724 13.0724 13.3834 13.3834 k = 0.1200 0.3900 0.5049 ( 14618 PWs) bands (ev): -16.9199 -16.9199 -16.9196 -16.9196 -16.3477 -16.3477 -16.3355 -16.3355 -16.2704 -16.2704 -16.2580 -16.2580 -12.7076 -12.7076 -12.7075 -12.7075 -1.6733 -1.6733 -1.6716 -1.6716 -0.6145 -0.6145 -0.5877 -0.5877 -0.4614 -0.4614 -0.4382 -0.4382 -0.2458 -0.2458 -0.2404 -0.2404 -0.0121 -0.0121 0.0005 0.0005 0.8097 0.8097 0.8241 0.8241 1.0947 1.0947 1.1016 1.1016 1.4416 1.4416 1.4478 1.4478 1.6546 1.6546 1.6633 1.6633 2.4393 2.4393 2.4491 2.4491 2.5446 2.5446 2.5530 2.5530 2.7281 2.7281 2.7379 2.7379 3.1222 3.1222 3.1263 3.1263 3.3801 3.3801 3.3941 3.3941 3.5563 3.5563 3.5724 3.5724 3.7756 3.7756 3.7798 3.7798 5.0634 5.0634 5.0757 5.0757 10.8920 10.8920 10.8955 10.8955 12.5909 12.5909 12.5953 12.5953 13.0901 13.0901 13.0966 13.0966 13.3789 13.3789 k = 0.1300 0.3807 0.5185 ( 14616 PWs) bands (ev): -16.9197 -16.9197 -16.9195 -16.9195 -16.3469 -16.3469 -16.3343 -16.3343 -16.2717 -16.2717 -16.2590 -16.2590 -12.7079 -12.7079 -12.7079 -12.7079 -1.6691 -1.6691 -1.6674 -1.6674 -0.6077 -0.6077 -0.5774 -0.5774 -0.4619 -0.4619 -0.4337 -0.4337 -0.2448 -0.2448 -0.2405 -0.2405 -0.0219 -0.0219 -0.0096 -0.0096 0.8044 0.8044 0.8210 0.8210 1.0942 1.0942 1.1032 1.1032 1.4524 1.4524 1.4589 1.4589 1.6531 1.6531 1.6617 1.6617 2.4467 2.4467 2.4570 2.4570 2.5440 2.5440 2.5520 2.5520 2.7278 2.7278 2.7373 2.7373 3.1137 3.1137 3.1175 3.1175 3.3797 3.3797 3.3933 3.3933 3.5531 3.5531 3.5681 3.5681 3.7427 3.7427 3.7470 3.7470 5.0786 5.0786 5.0908 5.0908 10.9251 10.9251 10.9287 10.9287 12.5696 12.5696 12.5737 12.5737 13.1133 13.1133 13.1196 13.1196 13.3793 13.3793 k = 0.1400 0.3714 0.5322 ( 14616 PWs) bands (ev): -16.9196 -16.9196 -16.9193 -16.9193 -16.3460 -16.3460 -16.3331 -16.3331 -16.2731 -16.2731 -16.2600 -16.2600 -12.7083 -12.7083 -12.7082 -12.7082 -1.6650 -1.6650 -1.6632 -1.6632 -0.6011 -0.6011 -0.5673 -0.5673 -0.4623 -0.4623 -0.4292 -0.4292 -0.2433 -0.2433 -0.2403 -0.2403 -0.0310 -0.0310 -0.0191 -0.0191 0.7976 0.7976 0.8160 0.8160 1.0926 1.0926 1.1039 1.1039 1.4657 1.4657 1.4726 1.4726 1.6508 1.6508 1.6592 1.6592 2.4558 2.4558 2.4665 2.4665 2.5433 2.5433 2.5509 2.5509 2.7265 2.7265 2.7359 2.7359 3.1046 3.1046 3.1082 3.1082 3.3790 3.3790 3.3920 3.3920 3.5488 3.5488 3.5620 3.5620 3.7124 3.7124 3.7170 3.7170 5.0930 5.0930 5.1051 5.1051 10.9585 10.9585 10.9621 10.9621 12.5486 12.5486 12.5525 12.5525 13.1342 13.1342 13.1404 13.1404 13.3857 13.3857 k = 0.1500 0.3621 0.5458 ( 14616 PWs) bands (ev): -16.9194 -16.9194 -16.9192 -16.9192 -16.3451 -16.3451 -16.3318 -16.3318 -16.2745 -16.2745 -16.2610 -16.2610 -12.7086 -12.7086 -12.7085 -12.7085 -1.6609 -1.6609 -1.6592 -1.6592 -0.5947 -0.5947 -0.5580 -0.5580 -0.4625 -0.4625 -0.4248 -0.4248 -0.2415 -0.2415 -0.2394 -0.2394 -0.0395 -0.0395 -0.0278 -0.0278 0.7899 0.7899 0.8095 0.8095 1.0902 1.0902 1.1035 1.1035 1.4809 1.4809 1.4883 1.4883 1.6481 1.6481 1.6563 1.6563 2.4663 2.4663 2.4774 2.4774 2.5427 2.5427 2.5499 2.5499 2.7241 2.7241 2.7334 2.7334 3.0953 3.0953 3.0984 3.0984 3.3779 3.3779 3.3902 3.3902 3.5427 3.5427 3.5536 3.5536 3.6857 3.6857 3.6910 3.6910 5.1065 5.1065 5.1184 5.1184 10.9916 10.9916 10.9953 10.9953 12.5283 12.5283 12.5320 12.5320 13.1520 13.1520 13.1578 13.1578 13.3991 13.3991 k = 0.1600 0.3528 0.5595 ( 14624 PWs) bands (ev): -16.9193 -16.9193 -16.9190 -16.9190 -16.3443 -16.3443 -16.3305 -16.3305 -16.2759 -16.2759 -16.2619 -16.2619 -12.7089 -12.7089 -12.7088 -12.7088 -1.6570 -1.6570 -1.6553 -1.6553 -0.5887 -0.5887 -0.5497 -0.5497 -0.4622 -0.4622 -0.4208 -0.4208 -0.2397 -0.2397 -0.2375 -0.2375 -0.0472 -0.0472 -0.0357 -0.0357 0.7814 0.7814 0.8018 0.8018 1.0875 1.0875 1.1022 1.1022 1.4970 1.4970 1.5047 1.5047 1.6457 1.6457 1.6533 1.6533 2.4781 2.4781 2.4896 2.4896 2.5421 2.5421 2.5491 2.5491 2.7205 2.7205 2.7298 2.7298 3.0857 3.0857 3.0884 3.0884 3.3760 3.3760 3.3875 3.3875 3.5345 3.5345 3.5426 3.5426 3.6636 3.6636 3.6701 3.6701 5.1189 5.1189 5.1308 5.1308 11.0239 11.0239 11.0277 11.0277 12.5088 12.5088 12.5124 12.5124 13.1660 13.1660 13.1713 13.1713 13.4199 13.4199 k = 0.1700 0.3435 0.5731 ( 14624 PWs) bands (ev): -16.9192 -16.9192 -16.9189 -16.9189 -16.3435 -16.3435 -16.3292 -16.3292 -16.2772 -16.2772 -16.2628 -16.2628 -12.7092 -12.7092 -12.7091 -12.7091 -1.6533 -1.6533 -1.6517 -1.6517 -0.5829 -0.5829 -0.5429 -0.5429 -0.4612 -0.4612 -0.4174 -0.4174 -0.2379 -0.2379 -0.2346 -0.2346 -0.0540 -0.0540 -0.0429 -0.0429 0.7728 0.7728 0.7931 0.7931 1.0847 1.0847 1.1000 1.1000 1.5131 1.5131 1.5207 1.5207 1.6441 1.6441 1.6510 1.6510 2.4909 2.4909 2.5027 2.5027 2.5417 2.5417 2.5486 2.5486 2.7157 2.7157 2.7250 2.7250 3.0762 3.0762 3.0783 3.0783 3.3732 3.3732 3.3839 3.3839 3.5237 3.5237 3.5302 3.5302 3.6464 3.6464 3.6546 3.6546 5.1302 5.1302 5.1420 5.1420 11.0550 11.0550 11.0588 11.0588 12.4903 12.4903 12.4938 12.4938 13.1763 13.1763 13.1808 13.1808 13.4480 13.4480 k = 0.1800 0.3343 0.5868 ( 14628 PWs) bands (ev): -16.9191 -16.9191 -16.9188 -16.9188 -16.3427 -16.3427 -16.3280 -16.3280 -16.2786 -16.2786 -16.2637 -16.2637 -12.7095 -12.7095 -12.7094 -12.7094 -1.6498 -1.6498 -1.6484 -1.6484 -0.5774 -0.5774 -0.5378 -0.5378 -0.4592 -0.4592 -0.4148 -0.4148 -0.2356 -0.2356 -0.2314 -0.2314 -0.0601 -0.0601 -0.0491 -0.0491 0.7642 0.7642 0.7840 0.7840 1.0821 1.0821 1.0973 1.0973 1.5279 1.5279 1.5352 1.5352 1.6438 1.6438 1.6501 1.6501 2.5042 2.5042 2.5163 2.5163 2.5418 2.5418 2.5488 2.5488 2.7097 2.7097 2.7190 2.7190 3.0668 3.0668 3.0684 3.0684 3.3691 3.3691 3.3792 3.3792 3.5109 3.5109 3.5179 3.5179 3.6339 3.6339 3.6438 3.6438 5.1403 5.1403 5.1520 5.1520 11.0841 11.0841 11.0880 11.0880 12.4732 12.4732 12.4766 12.4766 13.1833 13.1833 13.1870 13.1870 13.4823 13.4823 k = 0.1900 0.3250 0.6004 ( 14622 PWs) bands (ev): -16.9190 -16.9190 -16.9187 -16.9187 -16.3420 -16.3420 -16.3268 -16.3268 -16.2798 -16.2798 -16.2645 -16.2645 -12.7097 -12.7097 -12.7096 -12.7096 -1.6467 -1.6467 -1.6454 -1.6454 -0.5722 -0.5722 -0.5347 -0.5347 -0.4560 -0.4560 -0.4132 -0.4132 -0.2330 -0.2330 -0.2280 -0.2280 -0.0653 -0.0653 -0.0546 -0.0546 0.7561 0.7561 0.7747 0.7747 1.0798 1.0798 1.0942 1.0942 1.5401 1.5401 1.5472 1.5472 1.6452 1.6452 1.6514 1.6514 2.5171 2.5171 2.5288 2.5288 2.5431 2.5431 2.5506 2.5506 2.7023 2.7023 2.7117 2.7117 3.0579 3.0579 3.0590 3.0590 3.3638 3.3638 3.3734 3.3734 3.4981 3.4981 3.5065 3.5065 3.6254 3.6254 3.6364 3.6364 5.1492 5.1492 5.1607 5.1607 11.1108 11.1108 11.1147 11.1147 12.4576 12.4576 12.4609 12.4609 13.1879 13.1879 13.1909 13.1909 13.5216 13.5216 k = 0.2000 0.3157 0.6140 ( 14620 PWs) bands (ev): -16.9189 -16.9189 -16.9186 -16.9186 -16.3414 -16.3414 -16.3257 -16.3257 -16.2810 -16.2810 -16.2652 -16.2652 -12.7099 -12.7099 -12.7098 -12.7098 -1.6440 -1.6440 -1.6429 -1.6429 -0.5673 -0.5673 -0.5334 -0.5334 -0.4518 -0.4518 -0.4127 -0.4127 -0.2301 -0.2301 -0.2247 -0.2247 -0.0697 -0.0697 -0.0591 -0.0591 0.7488 0.7488 0.7658 0.7658 1.0780 1.0780 1.0911 1.0911 1.5489 1.5489 1.5562 1.5562 1.6484 1.6484 1.6553 1.6553 2.5274 2.5274 2.5359 2.5359 2.5491 2.5491 2.5569 2.5569 2.6937 2.6937 2.7031 2.7031 3.0496 3.0496 3.0504 3.0504 3.3575 3.3575 3.3666 3.3666 3.4871 3.4871 3.4966 3.4966 3.6198 3.6198 3.6314 3.6314 5.1567 5.1567 5.1682 5.1682 11.1345 11.1345 11.1384 11.1384 12.4438 12.4438 12.4471 12.4471 13.1908 13.1908 13.1931 13.1931 13.5645 13.5645 k = 0.2100 0.3064 0.6277 ( 14618 PWs) bands (ev): -16.9188 -16.9188 -16.9185 -16.9185 -16.3408 -16.3408 -16.3247 -16.3247 -16.2820 -16.2820 -16.2658 -16.2658 -12.7101 -12.7101 -12.7100 -12.7100 -1.6416 -1.6416 -1.6407 -1.6407 -0.5625 -0.5625 -0.5337 -0.5337 -0.4467 -0.4467 -0.4133 -0.4133 -0.2271 -0.2271 -0.2218 -0.2218 -0.0732 -0.0732 -0.0628 -0.0628 0.7426 0.7426 0.7576 0.7576 1.0767 1.0767 1.0879 1.0879 1.5544 1.5544 1.5621 1.5621 1.6530 1.6530 1.6612 1.6612 2.5327 2.5327 2.5378 2.5378 2.5600 2.5600 2.5690 2.5690 2.6840 2.6840 2.6934 2.6934 3.0422 3.0422 3.0428 3.0428 3.3510 3.3510 3.3594 3.3594 3.4788 3.4788 3.4885 3.4885 3.6161 3.6161 3.6279 3.6279 5.1629 5.1629 5.1744 5.1744 11.1547 11.1547 11.1587 11.1587 12.4321 12.4321 12.4354 12.4354 13.1926 13.1926 13.1943 13.1943 13.6095 13.6095 k = 0.2200 0.2971 0.6413 ( 14606 PWs) bands (ev): -16.9187 -16.9187 -16.9184 -16.9184 -16.3404 -16.3404 -16.3240 -16.3240 -16.2829 -16.2829 -16.2663 -16.2663 -12.7103 -12.7103 -12.7102 -12.7102 -1.6398 -1.6398 -1.6390 -1.6390 -0.5579 -0.5579 -0.5353 -0.5353 -0.4413 -0.4413 -0.4149 -0.4149 -0.2242 -0.2242 -0.2194 -0.2194 -0.0760 -0.0760 -0.0657 -0.0657 0.7378 0.7378 0.7505 0.7505 1.0761 1.0761 1.0850 1.0850 1.5572 1.5572 1.5656 1.5656 1.6581 1.6581 1.6675 1.6675 2.5346 2.5346 2.5384 2.5384 2.5732 2.5732 2.5832 2.5832 2.6735 2.6735 2.6828 2.6828 3.0360 3.0360 3.0367 3.0367 3.3449 3.3449 3.3526 3.3526 3.4730 3.4730 3.4824 3.4824 3.6138 3.6138 3.6256 3.6256 5.1678 5.1678 5.1792 5.1792 11.1710 11.1710 11.1750 11.1750 12.4227 12.4227 12.4259 12.4259 13.1936 13.1936 13.1949 13.1949 13.6545 13.6545 k = 0.2300 0.2878 0.6550 ( 14602 PWs) bands (ev): -16.9187 -16.9187 -16.9184 -16.9184 -16.3401 -16.3401 -16.3234 -16.3234 -16.2835 -16.2835 -16.2666 -16.2666 -12.7104 -12.7104 -12.7103 -12.7103 -1.6384 -1.6384 -1.6378 -1.6378 -0.5536 -0.5536 -0.5377 -0.5377 -0.4358 -0.4358 -0.4176 -0.4176 -0.2218 -0.2218 -0.2178 -0.2178 -0.0779 -0.0779 -0.0678 -0.0678 0.7345 0.7345 0.7449 0.7449 1.0760 1.0760 1.0825 1.0825 1.5585 1.5585 1.5674 1.5674 1.6629 1.6629 1.6731 1.6731 2.5352 2.5352 2.5386 2.5386 2.5865 2.5865 2.5972 2.5972 2.6627 2.6627 2.6719 2.6719 3.0314 3.0314 3.0320 3.0320 3.3399 3.3399 3.3471 3.3471 3.4694 3.4694 3.4781 3.4781 3.6124 3.6124 3.6241 3.6241 5.1712 5.1712 5.1827 5.1827 11.1829 11.1829 11.1869 11.1869 12.4158 12.4158 12.4190 12.4190 13.1943 13.1943 13.1951 13.1951 13.6962 13.6962 k = 0.2400 0.2786 0.6686 ( 14606 PWs) bands (ev): -16.9187 -16.9187 -16.9184 -16.9184 -16.3399 -16.3399 -16.3230 -16.3230 -16.2839 -16.2839 -16.2668 -16.2668 -12.7104 -12.7104 -12.7103 -12.7103 -1.6375 -1.6375 -1.6371 -1.6371 -0.5497 -0.5497 -0.5406 -0.5406 -0.4304 -0.4304 -0.4211 -0.4211 -0.2201 -0.2201 -0.2169 -0.2169 -0.0790 -0.0790 -0.0690 -0.0690 0.7326 0.7326 0.7412 0.7412 1.0763 1.0763 1.0805 1.0805 1.5590 1.5590 1.5682 1.5682 1.6661 1.6661 1.6768 1.6768 2.5354 2.5354 2.5387 2.5387 2.5975 2.5975 2.6088 2.6088 2.6532 2.6532 2.6623 2.6623 3.0286 3.0286 3.0291 3.0291 3.3367 3.3367 3.3434 3.3434 3.4674 3.4674 3.4755 3.4755 3.6117 3.6117 3.6233 3.6233 5.1733 5.1733 5.1847 5.1847 11.1902 11.1902 11.1942 11.1942 12.4116 12.4116 12.4148 12.4148 13.1946 13.1946 13.1951 13.1951 13.7289 13.7289 k = 0.2500 0.2693 0.6823 ( 14620 PWs) bands (ev): -16.9186 -16.9186 -16.9184 -16.9184 -16.3398 -16.3398 -16.3229 -16.3229 -16.2840 -16.2840 -16.2669 -16.2669 -12.7105 -12.7105 -12.7104 -12.7104 -1.6372 -1.6372 -1.6369 -1.6369 -0.5474 -0.5474 -0.5426 -0.5426 -0.4259 -0.4259 -0.4251 -0.4251 -0.2194 -0.2194 -0.2166 -0.2166 -0.0794 -0.0794 -0.0694 -0.0694 0.7320 0.7320 0.7399 0.7399 1.0767 1.0767 1.0796 1.0796 1.5592 1.5592 1.5684 1.5684 1.6673 1.6673 1.6781 1.6781 2.5354 2.5354 2.5387 2.5387 2.6022 2.6022 2.6140 2.6140 2.6489 2.6489 2.6579 2.6579 3.0276 3.0276 3.0281 3.0281 3.3356 3.3356 3.3422 3.3422 3.4668 3.4668 3.4747 3.4747 3.6114 3.6114 3.6230 3.6230 5.1740 5.1740 5.1854 5.1854 11.1927 11.1927 11.1967 11.1967 12.4102 12.4102 12.4134 12.4134 13.1948 13.1948 13.1950 13.1950 13.7434 13.7434 k = 0.2500 0.2693 0.6823 ( 14620 PWs) bands (ev): -16.9186 -16.9186 -16.9184 -16.9184 -16.3398 -16.3398 -16.3229 -16.3229 -16.2840 -16.2840 -16.2669 -16.2669 -12.7105 -12.7105 -12.7104 -12.7104 -1.6372 -1.6372 -1.6369 -1.6369 -0.5474 -0.5474 -0.5426 -0.5426 -0.4259 -0.4259 -0.4251 -0.4251 -0.2194 -0.2194 -0.2166 -0.2166 -0.0794 -0.0794 -0.0694 -0.0694 0.7320 0.7320 0.7399 0.7399 1.0767 1.0767 1.0796 1.0796 1.5592 1.5592 1.5684 1.5684 1.6673 1.6673 1.6781 1.6781 2.5354 2.5354 2.5387 2.5387 2.6022 2.6022 2.6140 2.6140 2.6489 2.6489 2.6579 2.6579 3.0276 3.0276 3.0281 3.0281 3.3356 3.3356 3.3422 3.3422 3.4668 3.4668 3.4747 3.4747 3.6114 3.6114 3.6230 3.6230 5.1740 5.1740 5.1854 5.1854 11.1927 11.1927 11.1967 11.1967 12.4102 12.4102 12.4134 12.4134 13.1948 13.1948 13.1950 13.1950 13.7434 13.7434 k = 0.2589 0.2789 0.6681 ( 14616 PWs) bands (ev): -16.9221 -16.9221 -16.9149 -16.9149 -16.3396 -16.3396 -16.3232 -16.3232 -16.2833 -16.2833 -16.2675 -16.2675 -12.7110 -12.7110 -12.7098 -12.7098 -1.6424 -1.6424 -1.6321 -1.6321 -0.5702 -0.5702 -0.5288 -0.5288 -0.4409 -0.4409 -0.4024 -0.4024 -0.2223 -0.2223 -0.2128 -0.2128 -0.0797 -0.0797 -0.0676 -0.0676 0.7164 0.7164 0.7558 0.7558 1.0755 1.0755 1.0821 1.0821 1.5500 1.5500 1.5767 1.5767 1.6679 1.6679 1.6774 1.6774 2.5260 2.5260 2.5462 2.5462 2.5892 2.5892 2.6200 2.6200 2.6360 2.6360 2.6768 2.6768 3.0162 3.0162 3.0404 3.0404 3.3373 3.3373 3.3409 3.3409 3.4657 3.4657 3.4772 3.4772 3.6111 3.6111 3.6240 3.6240 5.1417 5.1417 5.2168 5.2168 11.1862 11.1862 11.2005 11.2005 12.3830 12.3830 12.4424 12.4424 13.1174 13.1174 13.2732 13.2732 13.7153 13.7153 k = 0.2679 0.2885 0.6540 ( 14608 PWs) bands (ev): -16.9256 -16.9256 -16.9114 -16.9114 -16.3394 -16.3394 -16.3237 -16.3237 -16.2824 -16.2824 -16.2680 -16.2680 -12.7116 -12.7116 -12.7091 -12.7091 -1.6478 -1.6478 -1.6276 -1.6276 -0.6024 -0.6024 -0.5217 -0.5217 -0.4491 -0.4491 -0.3738 -0.3738 -0.2260 -0.2260 -0.2055 -0.2055 -0.0782 -0.0782 -0.0645 -0.0645 0.7012 0.7012 0.7713 0.7713 1.0747 1.0747 1.0876 1.0876 1.5387 1.5387 1.5860 1.5860 1.6597 1.6597 1.6847 1.6847 2.5124 2.5124 2.5524 2.5524 2.5769 2.5769 2.6133 2.6133 2.6308 2.6308 2.7000 2.7000 3.0066 3.0066 3.0527 3.0527 3.3349 3.3349 3.3457 3.3457 3.4618 3.4618 3.4840 3.4840 3.6107 3.6107 3.6259 3.6259 5.0986 5.0986 5.2567 5.2567 11.1769 11.1769 11.2030 11.2030 12.3550 12.3550 12.4749 12.4749 13.0418 13.0418 13.3513 13.3513 13.6737 13.6737 k = 0.2768 0.2981 0.6399 ( 14608 PWs) bands (ev): -16.9291 -16.9291 -16.9079 -16.9079 -16.3393 -16.3393 -16.3245 -16.3245 -16.2812 -16.2812 -16.2686 -16.2686 -12.7122 -12.7122 -12.7084 -12.7084 -1.6533 -1.6533 -1.6237 -1.6237 -0.6388 -0.6388 -0.5200 -0.5200 -0.4533 -0.4533 -0.3432 -0.3432 -0.2290 -0.2290 -0.1960 -0.1960 -0.0743 -0.0743 -0.0606 -0.0606 0.6869 0.6869 0.7858 0.7858 1.0748 1.0748 1.0947 1.0947 1.5270 1.5270 1.5943 1.5943 1.6526 1.6526 1.6905 1.6905 2.4976 2.4976 2.5443 2.5443 2.5748 2.5748 2.6002 2.6002 2.6306 2.6306 2.7237 2.7237 2.9990 2.9990 3.0647 3.0647 3.3337 3.3337 3.3513 3.3513 3.4589 3.4589 3.4908 3.4908 3.6104 3.6104 3.6286 3.6286 5.0554 5.0554 5.2945 5.2945 11.1677 11.1677 11.2020 11.2020 12.3296 12.3296 12.5065 12.5065 12.9689 12.9689 13.4265 13.4265 13.6305 13.6305 k = 0.2857 0.3077 0.6257 ( 14616 PWs) bands (ev): -16.9324 -16.9324 -16.9045 -16.9045 -16.3393 -16.3393 -16.3253 -16.3253 -16.2799 -16.2799 -16.2691 -16.2691 -12.7129 -12.7129 -12.7077 -12.7077 -1.6586 -1.6586 -1.6203 -1.6203 -0.6771 -0.6771 -0.5214 -0.5214 -0.4559 -0.4559 -0.3142 -0.3142 -0.2309 -0.2309 -0.1838 -0.1838 -0.0667 -0.0667 -0.0560 -0.0560 0.6735 0.6735 0.7990 0.7990 1.0752 1.0752 1.1034 1.1034 1.5152 1.5152 1.6010 1.6010 1.6467 1.6467 1.6955 1.6955 2.4814 2.4814 2.5258 2.5258 2.5768 2.5768 2.5899 2.5899 2.6305 2.6305 2.7465 2.7465 2.9935 2.9935 3.0761 3.0761 3.3336 3.3336 3.3582 3.3582 3.4574 3.4574 3.4972 3.4972 3.6100 3.6100 3.6322 3.6322 5.0122 5.0122 5.3301 5.3301 11.1587 11.1587 11.1986 11.1986 12.3070 12.3070 12.5363 12.5363 12.8994 12.8994 13.4854 13.4854 13.6032 13.6032 k = 0.2946 0.3174 0.6116 ( 14610 PWs) bands (ev): -16.9357 -16.9357 -16.9012 -16.9012 -16.3394 -16.3394 -16.3261 -16.3261 -16.2786 -16.2786 -16.2695 -16.2695 -12.7135 -12.7135 -12.7070 -12.7070 -1.6637 -1.6637 -1.6174 -1.6174 -0.7158 -0.7158 -0.5242 -0.5242 -0.4580 -0.4580 -0.2896 -0.2896 -0.2315 -0.2315 -0.1697 -0.1697 -0.0539 -0.0539 -0.0508 -0.0508 0.6614 0.6614 0.8110 0.8110 1.0754 1.0754 1.1135 1.1135 1.5034 1.5034 1.6059 1.6059 1.6421 1.6421 1.7005 1.7005 2.4635 2.4635 2.5044 2.5044 2.5683 2.5683 2.5909 2.5909 2.6300 2.6300 2.7676 2.7676 2.9900 2.9900 3.0868 3.0868 3.3338 3.3338 3.3663 3.3663 3.4570 3.4570 3.5032 3.5032 3.6097 3.6097 3.6365 3.6365 4.9695 4.9695 5.3633 5.3633 11.1500 11.1500 11.1938 11.1938 12.2873 12.2873 12.5636 12.5636 12.8341 12.8341 13.4896 13.4896 13.6317 13.6317 k = 0.3036 0.3270 0.5975 ( 14609 PWs) bands (ev): -16.9389 -16.9389 -16.8980 -16.8980 -16.3398 -16.3398 -16.3268 -16.3268 -16.2771 -16.2771 -16.2699 -16.2699 -12.7141 -12.7141 -12.7064 -12.7064 -1.6687 -1.6687 -1.6149 -1.6149 -0.7541 -0.7541 -0.5276 -0.5276 -0.4603 -0.4603 -0.2706 -0.2706 -0.2303 -0.2303 -0.1554 -0.1554 -0.0453 -0.0453 -0.0339 -0.0339 0.6505 0.6505 0.8216 0.8216 1.0742 1.0742 1.1251 1.1251 1.4917 1.4917 1.6090 1.6090 1.6390 1.6390 1.7059 1.7059 2.4432 2.4432 2.4820 2.4820 2.5566 2.5566 2.5955 2.5955 2.6291 2.6291 2.7868 2.7868 2.9882 2.9882 3.0966 3.0966 3.3342 3.3342 3.3753 3.3753 3.4577 3.4577 3.5088 3.5088 3.6095 3.6095 3.6415 3.6415 4.9273 4.9273 5.3940 5.3940 11.1416 11.1416 11.1885 11.1885 12.2705 12.2705 12.5882 12.5882 12.7734 12.7734 13.4582 13.4582 13.6960 13.6960 k = 0.3125 0.3366 0.5833 ( 14612 PWs) bands (ev): -16.9420 -16.9420 -16.8948 -16.8948 -16.3405 -16.3405 -16.3272 -16.3272 -16.2756 -16.2756 -16.2703 -16.2703 -12.7148 -12.7148 -12.7058 -12.7058 -1.6734 -1.6734 -1.6127 -1.6127 -0.7917 -0.7917 -0.5311 -0.5311 -0.4627 -0.4627 -0.2572 -0.2572 -0.2268 -0.2268 -0.1433 -0.1433 -0.0395 -0.0395 -0.0056 -0.0056 0.6409 0.6409 0.8312 0.8312 1.0710 1.0710 1.1380 1.1380 1.4802 1.4802 1.6104 1.6104 1.6374 1.6374 1.7117 1.7117 2.4203 2.4203 2.4593 2.4593 2.5458 2.5458 2.5996 2.5996 2.6277 2.6277 2.8036 2.8036 2.9879 2.9879 3.1054 3.1054 3.3346 3.3346 3.3846 3.3846 3.4596 3.4596 3.5141 3.5141 3.6095 3.6095 3.6472 3.6472 4.8862 4.8862 5.4220 5.4220 11.1335 11.1335 11.1834 11.1834 12.2567 12.2567 12.6098 12.6098 12.7179 12.7179 13.4227 13.4227 13.7631 13.7631 k = 0.3214 0.3462 0.5692 ( 14614 PWs) bands (ev): -16.9449 -16.9449 -16.8917 -16.8917 -16.3416 -16.3416 -16.3273 -16.3273 -16.2741 -16.2741 -16.2706 -16.2706 -12.7154 -12.7154 -12.7052 -12.7052 -1.6778 -1.6778 -1.6108 -1.6108 -0.8282 -0.8282 -0.5344 -0.5344 -0.4654 -0.4654 -0.2485 -0.2485 -0.2207 -0.2207 -0.1343 -0.1343 -0.0333 -0.0333 0.0301 0.0301 0.6328 0.6328 0.8398 0.8398 1.0653 1.0653 1.1519 1.1519 1.4690 1.4690 1.6103 1.6103 1.6377 1.6377 1.7178 1.7178 2.3950 2.3950 2.4365 2.4365 2.5366 2.5366 2.6026 2.6026 2.6260 2.6260 2.8181 2.8181 2.9887 2.9887 3.1132 3.1132 3.3349 3.3349 3.3932 3.3932 3.4625 3.4625 3.5195 3.5195 3.6099 3.6099 3.6535 3.6535 4.8463 4.8463 5.4473 5.4473 11.1258 11.1258 11.1790 11.1790 12.2457 12.2457 12.6284 12.6284 12.6680 12.6680 13.3894 13.3894 13.8228 13.8228 k = 0.3304 0.3558 0.5551 ( 14608 PWs) bands (ev): -16.9478 -16.9478 -16.8887 -16.8887 -16.3431 -16.3431 -16.3272 -16.3272 -16.2727 -16.2727 -16.2708 -16.2708 -12.7161 -12.7161 -12.7046 -12.7046 -1.6818 -1.6818 -1.6092 -1.6092 -0.8635 -0.8635 -0.5374 -0.5374 -0.4681 -0.4681 -0.2428 -0.2428 -0.2126 -0.2126 -0.1278 -0.1278 -0.0269 -0.0269 0.0711 0.0711 0.6261 0.6261 0.8479 0.8479 1.0566 1.0566 1.1665 1.1665 1.4583 1.4583 1.6092 1.6092 1.6401 1.6401 1.7239 1.7239 2.3681 2.3681 2.4134 2.4134 2.5293 2.5293 2.6046 2.6046 2.6239 2.6239 2.8300 2.8300 2.9904 2.9904 3.1198 3.1198 3.3352 3.3352 3.4007 3.4007 3.4657 3.4657 3.5250 3.5250 3.6107 3.6107 3.6603 3.6603 4.8081 4.8081 5.4697 5.4697 11.1184 11.1184 11.1757 11.1757 12.2372 12.2372 12.6240 12.6240 12.6446 12.6446 13.3603 13.3603 13.8683 13.8683 k = 0.3393 0.3654 0.5409 ( 14614 PWs) bands (ev): -16.9505 -16.9505 -16.8858 -16.8858 -16.3448 -16.3448 -16.3268 -16.3268 -16.2713 -16.2713 -16.2710 -16.2710 -12.7168 -12.7168 -12.7041 -12.7041 -1.6855 -1.6855 -1.6078 -1.6078 -0.8973 -0.8973 -0.5400 -0.5400 -0.4707 -0.4707 -0.2385 -0.2385 -0.2037 -0.2037 -0.1231 -0.1231 -0.0202 -0.0202 0.1157 0.1157 0.6209 0.6209 0.8557 0.8557 1.0450 1.0450 1.1813 1.1813 1.4481 1.4481 1.6073 1.6073 1.6446 1.6446 1.7297 1.7297 2.3402 2.3402 2.3898 2.3898 2.5241 2.5241 2.6056 2.6056 2.6214 2.6214 2.8394 2.8394 2.9926 2.9926 3.1252 3.1252 3.3355 3.3355 3.4065 3.4065 3.4685 3.4685 3.5312 3.5312 3.6122 3.6122 3.6677 3.6677 4.7720 4.7720 5.4894 5.4894 11.1115 11.1115 11.1741 11.1741 12.2310 12.2310 12.5873 12.5873 12.6578 12.6578 13.3358 13.3358 13.8973 13.8973 k = 0.3482 0.3751 0.5268 ( 14612 PWs) bands (ev): -16.9530 -16.9530 -16.8830 -16.8830 -16.3468 -16.3468 -16.3261 -16.3261 -16.2712 -16.2712 -16.2698 -16.2698 -12.7176 -12.7176 -12.7036 -12.7036 -1.6887 -1.6887 -1.6065 -1.6065 -0.9295 -0.9295 -0.5420 -0.5420 -0.4730 -0.4730 -0.2347 -0.2347 -0.1946 -0.1946 -0.1196 -0.1196 -0.0132 -0.0132 0.1623 0.1623 0.6173 0.6173 0.8633 0.8633 1.0306 1.0306 1.1960 1.1960 1.4384 1.4384 1.6049 1.6049 1.6510 1.6510 1.7350 1.7350 2.3121 2.3121 2.3656 2.3656 2.5209 2.5209 2.6055 2.6055 2.6187 2.6187 2.8463 2.8463 2.9949 2.9949 3.1293 3.1293 3.3358 3.3358 3.4109 3.4109 3.4699 3.4699 3.5378 3.5378 3.6142 3.6142 3.6756 3.6756 4.7383 4.7383 5.5063 5.5063 11.1049 11.1049 11.1743 11.1743 12.2266 12.2266 12.5579 12.5579 12.6687 12.6687 13.3163 13.3163 13.9132 13.9132 k = 0.3571 0.3847 0.5127 ( 14612 PWs) bands (ev): -16.9555 -16.9555 -16.8803 -16.8803 -16.3489 -16.3489 -16.3253 -16.3253 -16.2713 -16.2713 -16.2685 -16.2685 -12.7183 -12.7183 -12.7032 -12.7032 -1.6915 -1.6915 -1.6053 -1.6053 -0.9602 -0.9602 -0.5433 -0.5433 -0.4750 -0.4750 -0.2312 -0.2312 -0.1858 -0.1858 -0.1168 -0.1168 -0.0059 -0.0059 0.2101 0.2101 0.6152 0.6152 0.8708 0.8708 1.0140 1.0140 1.2101 1.2101 1.4294 1.4294 1.6022 1.6022 1.6589 1.6589 1.7396 1.7396 2.2843 2.2843 2.3410 2.3410 2.5195 2.5195 2.6046 2.6046 2.6157 2.6157 2.8505 2.8505 2.9971 2.9971 3.1321 3.1321 3.3361 3.3361 3.4142 3.4142 3.4694 3.4694 3.5447 3.5447 3.6167 3.6167 3.6840 3.6840 4.7074 4.7074 5.5206 5.5206 11.0988 11.0988 11.1767 11.1767 12.2233 12.2233 12.5368 12.5368 12.6774 12.6774 13.3020 13.3020 13.9183 13.9183 k = 0.3661 0.3943 0.4985 ( 14619 PWs) bands (ev): -16.9577 -16.9577 -16.8777 -16.8777 -16.3512 -16.3512 -16.3244 -16.3244 -16.2713 -16.2713 -16.2672 -16.2672 -12.7191 -12.7191 -12.7028 -12.7028 -1.6938 -1.6938 -1.6042 -1.6042 -0.9891 -0.9891 -0.5440 -0.5440 -0.4764 -0.4764 -0.2277 -0.2277 -0.1774 -0.1774 -0.1144 -0.1144 0.0017 0.0017 0.2583 0.2583 0.6147 0.6147 0.8783 0.8783 0.9956 0.9956 1.2233 1.2233 1.4210 1.4210 1.5994 1.5994 1.6678 1.6678 1.7434 1.7434 2.2576 2.2576 2.3163 2.3163 2.5198 2.5198 2.6028 2.6028 2.6125 2.6125 2.8519 2.8519 2.9992 2.9992 3.1338 3.1338 3.3364 3.3364 3.4164 3.4164 3.4671 3.4671 3.5514 3.5514 3.6193 3.6193 3.6927 3.6927 4.6797 4.6797 5.5322 5.5322 11.0930 11.0930 11.1814 11.1814 12.2205 12.2205 12.5247 12.5247 12.6840 12.6840 13.2928 13.2928 13.9116 13.9116 k = 0.3750 0.4039 0.4844 ( 14625 PWs) bands (ev): -16.9598 -16.9598 -16.8753 -16.8753 -16.3536 -16.3536 -16.3234 -16.3234 -16.2713 -16.2713 -16.2660 -16.2660 -12.7199 -12.7199 -12.7025 -12.7025 -1.6957 -1.6957 -1.6032 -1.6032 -1.0162 -1.0162 -0.5441 -0.5441 -0.4772 -0.4772 -0.2244 -0.2244 -0.1698 -0.1698 -0.1119 -0.1119 0.0096 0.0096 0.3064 0.3064 0.6157 0.6157 0.8855 0.8855 0.9766 0.9766 1.2349 1.2349 1.4132 1.4132 1.5967 1.5967 1.6772 1.6772 1.7464 1.7464 2.2325 2.2325 2.2917 2.2917 2.5215 2.5215 2.6003 2.6003 2.6090 2.6090 2.8506 2.8506 3.0010 3.0010 3.1343 3.1343 3.3365 3.3365 3.4179 3.4179 3.4633 3.4633 3.5574 3.5574 3.6220 3.6220 3.7014 3.7014 4.6552 4.6552 5.5413 5.5413 11.0876 11.0876 11.1886 11.1886 12.2179 12.2179 12.5221 12.5221 12.6886 12.6886 13.2887 13.2887 13.8916 13.8916 k = 0.3839 0.4135 0.4703 ( 14621 PWs) bands (ev): -16.9617 -16.9617 -16.8730 -16.8730 -16.3560 -16.3560 -16.3223 -16.3223 -16.2713 -16.2713 -16.2648 -16.2648 -12.7208 -12.7208 -12.7023 -12.7023 -1.6970 -1.6970 -1.6023 -1.6023 -1.0416 -1.0416 -0.5434 -0.5434 -0.4775 -0.4775 -0.2212 -0.2212 -0.1635 -0.1635 -0.1090 -0.1090 0.0178 0.0178 0.3539 0.3539 0.6184 0.6184 0.8917 0.8917 0.9585 0.9585 1.2447 1.2447 1.4061 1.4061 1.5943 1.5943 1.6860 1.6860 1.7487 1.7487 2.2095 2.2095 2.2677 2.2677 2.5243 2.5243 2.5971 2.5971 2.6052 2.6052 2.8462 2.8462 3.0028 3.0028 3.1338 3.1338 3.3364 3.3364 3.4186 3.4186 3.4586 3.4586 3.5624 3.5624 3.6244 3.6244 3.7097 3.7097 4.6343 4.6343 5.5482 5.5482 11.0826 11.0826 11.1983 11.1983 12.2151 12.2151 12.5291 12.5291 12.6912 12.6912 13.2896 13.2896 13.8583 13.8583 k = 0.3929 0.4231 0.4561 ( 14620 PWs) bands (ev): -16.9635 -16.9635 -16.8708 -16.8708 -16.3586 -16.3586 -16.3211 -16.3211 -16.2711 -16.2711 -16.2638 -16.2638 -12.7216 -12.7216 -12.7021 -12.7021 -1.6979 -1.6979 -1.6014 -1.6014 -1.0650 -1.0650 -0.5420 -0.5420 -0.4772 -0.4772 -0.2183 -0.2183 -0.1588 -0.1588 -0.1053 -0.1053 0.0261 0.0261 0.4003 0.4003 0.6227 0.6227 0.8945 0.8945 0.9443 0.9443 1.2521 1.2521 1.3996 1.3996 1.5925 1.5925 1.6936 1.6936 1.7506 1.7506 2.1892 2.1892 2.2446 2.2446 2.5279 2.5279 2.5934 2.5934 2.6011 2.6011 2.8388 2.8388 3.0045 3.0045 3.1323 3.1323 3.3360 3.3360 3.4183 3.4183 3.4536 3.4536 3.5665 3.5665 3.6264 3.6264 3.7173 3.7173 4.6168 4.6168 5.5530 5.5530 11.0779 11.0779 11.2105 11.2105 12.2126 12.2126 12.5453 12.5453 12.6916 12.6916 13.2952 13.2952 13.8134 13.8134 k = 0.4018 0.4328 0.4420 ( 14621 PWs) bands (ev): -16.9651 -16.9651 -16.8688 -16.8688 -16.3611 -16.3611 -16.3198 -16.3198 -16.2710 -16.2710 -16.2628 -16.2628 -12.7225 -12.7225 -12.7020 -12.7020 -1.6983 -1.6983 -1.6006 -1.6006 -1.0866 -1.0866 -0.5400 -0.5400 -0.4762 -0.4762 -0.2158 -0.2158 -0.1559 -0.1559 -0.1005 -0.1005 0.0343 0.0343 0.4452 0.4452 0.6286 0.6286 0.8897 0.8897 0.9389 0.9389 1.2568 1.2568 1.3936 1.3936 1.5915 1.5915 1.6988 1.6988 1.7524 1.7524 2.1721 2.1721 2.2229 2.2229 2.5319 2.5319 2.5893 2.5893 2.5967 2.5967 2.8283 2.8283 3.0063 3.0063 3.1301 3.1301 3.3350 3.3350 3.4166 3.4166 3.4493 3.4493 3.5696 3.5696 3.6278 3.6278 3.7239 3.7239 4.6027 4.6027 5.5560 5.5560 11.0736 11.0736 11.2250 11.2250 12.2108 12.2108 12.5702 12.5702 12.6896 12.6896 13.3054 13.3054 13.7592 13.7592 k = 0.4107 0.4424 0.4279 ( 14621 PWs) bands (ev): -16.9665 -16.9665 -16.8670 -16.8670 -16.3637 -16.3637 -16.3185 -16.3185 -16.2707 -16.2707 -16.2619 -16.2619 -12.7234 -12.7234 -12.7019 -12.7019 -1.6983 -1.6983 -1.6000 -1.6000 -1.1062 -1.1062 -0.5373 -0.5373 -0.4747 -0.4747 -0.2138 -0.2138 -0.1547 -0.1547 -0.0947 -0.0947 0.0423 0.0423 0.4882 0.4882 0.6362 0.6362 0.8778 0.8778 0.9425 0.9425 1.2583 1.2583 1.3879 1.3879 1.5916 1.5916 1.7010 1.7010 1.7543 1.7543 2.1584 2.1584 2.2031 2.2031 2.5361 2.5361 2.5850 2.5850 2.5920 2.5920 2.8148 2.8148 3.0081 3.0081 3.1274 3.1274 3.3334 3.3334 3.4134 3.4134 3.4462 3.4462 3.5718 3.5718 3.6288 3.6288 3.7292 3.7292 4.5916 4.5916 5.5576 5.5576 11.0697 11.0697 11.2417 11.2417 12.2103 12.2103 12.6030 12.6030 12.6849 12.6849 13.3195 13.3195 13.6978 13.6978 k = 0.4196 0.4520 0.4137 ( 14612 PWs) bands (ev): -16.9677 -16.9677 -16.8653 -16.8653 -16.3664 -16.3664 -16.3172 -16.3172 -16.2705 -16.2705 -16.2611 -16.2611 -12.7243 -12.7243 -12.7019 -12.7019 -1.6978 -1.6978 -1.5994 -1.5994 -1.1238 -1.1238 -0.5341 -0.5341 -0.4727 -0.4727 -0.2123 -0.2123 -0.1550 -0.1550 -0.0880 -0.0880 0.0496 0.0496 0.5286 0.5286 0.6455 0.6455 0.8640 0.8640 0.9507 0.9507 1.2565 1.2565 1.3826 1.3826 1.5928 1.5928 1.7002 1.7002 1.7561 1.7561 2.1484 2.1484 2.1858 2.1858 2.5397 2.5397 2.5805 2.5805 2.5871 2.5871 2.7984 2.7984 3.0098 3.0098 3.1245 3.1245 3.3310 3.3310 3.4087 3.4087 3.4446 3.4446 3.5732 3.5732 3.6292 3.6292 3.7333 3.7333 4.5830 4.5830 5.5579 5.5579 11.0663 11.0663 11.2603 11.2603 12.2116 12.2116 12.6429 12.6429 12.6772 12.6772 13.3372 13.3372 13.6316 13.6316 k = 0.4286 0.4616 0.3996 ( 14622 PWs) bands (ev): -16.9687 -16.9687 -16.8638 -16.8638 -16.3690 -16.3690 -16.3158 -16.3158 -16.2701 -16.2701 -16.2603 -16.2603 -12.7251 -12.7251 -12.7020 -12.7020 -1.6969 -1.6969 -1.5991 -1.5991 -1.1395 -1.1395 -0.5304 -0.5304 -0.4701 -0.4701 -0.2115 -0.2115 -0.1564 -0.1564 -0.0806 -0.0806 0.0559 0.0559 0.5661 0.5661 0.6568 0.6568 0.8514 0.8514 0.9609 0.9609 1.2512 1.2512 1.3777 1.3777 1.5949 1.5949 1.6970 1.6970 1.7572 1.7572 2.1416 2.1416 2.1717 2.1717 2.5423 2.5423 2.5760 2.5760 2.5824 2.5824 2.7796 2.7796 3.0114 3.0114 3.1217 3.1217 3.3277 3.3277 3.4034 3.4034 3.4440 3.4440 3.5741 3.5741 3.6291 3.6291 3.7361 3.7361 4.5765 4.5765 5.5574 5.5574 11.0633 11.0633 11.2806 11.2806 12.2151 12.2151 12.6658 12.6658 12.6894 12.6894 13.3573 13.3573 13.5629 13.5629 k = 0.4375 0.4712 0.3854 ( 14616 PWs) bands (ev): -16.9696 -16.9696 -16.8625 -16.8625 -16.3716 -16.3716 -16.3143 -16.3143 -16.2698 -16.2698 -16.2597 -16.2597 -12.7260 -12.7260 -12.7021 -12.7021 -1.6957 -1.6957 -1.5989 -1.5989 -1.1531 -1.1531 -0.5264 -0.5264 -0.4670 -0.4670 -0.2114 -0.2114 -0.1586 -0.1586 -0.0728 -0.0728 0.0610 0.0610 0.5997 0.5997 0.6702 0.6702 0.8415 0.8415 0.9722 0.9722 1.2422 1.2422 1.3733 1.3733 1.5973 1.5973 1.6929 1.6929 1.7567 1.7567 2.1373 2.1373 2.1618 2.1618 2.5428 2.5428 2.5714 2.5714 2.5785 2.5785 2.7585 2.7585 3.0125 3.0125 3.1194 3.1194 3.3236 3.3236 3.3980 3.3980 3.4442 3.4442 3.5746 3.5746 3.6284 3.6284 3.7378 3.7378 4.5713 4.5713 5.5565 5.5565 11.0608 11.0608 11.3020 11.3020 12.2211 12.2211 12.6505 12.6505 12.7415 12.7415 13.3780 13.3780 13.4946 13.4946 k = 0.4464 0.4808 0.3713 ( 14628 PWs) bands (ev): -16.9702 -16.9702 -16.8614 -16.8614 -16.3742 -16.3742 -16.3129 -16.3129 -16.2694 -16.2694 -16.2591 -16.2591 -12.7268 -12.7268 -12.7022 -12.7022 -1.6941 -1.6941 -1.5990 -1.5990 -1.1648 -1.1648 -0.5223 -0.5223 -0.4635 -0.4635 -0.2120 -0.2120 -0.1614 -0.1614 -0.0648 -0.0648 0.0643 0.0643 0.6290 0.6290 0.6860 0.6860 0.8353 0.8353 0.9841 0.9841 1.2297 1.2297 1.3695 1.3695 1.5991 1.5991 1.6895 1.6895 1.7542 1.7542 2.1343 2.1343 2.1572 2.1572 2.5406 2.5406 2.5660 2.5660 2.5767 2.5767 2.7355 2.7355 3.0131 3.0131 3.1179 3.1179 3.3188 3.3188 3.3929 3.3929 3.4448 3.4448 3.5749 3.5749 3.6272 3.6272 3.7387 3.7387 4.5667 4.5667 5.5554 5.5554 11.0588 11.0588 11.3241 11.3241 12.2298 12.2298 12.6309 12.6309 12.7989 12.7989 13.3865 13.3865 13.4402 13.4402 k = 0.4554 0.4905 0.3572 ( 14631 PWs) bands (ev): -16.9707 -16.9707 -16.8604 -16.8604 -16.3768 -16.3768 -16.3113 -16.3113 -16.2689 -16.2689 -16.2586 -16.2586 -12.7276 -12.7276 -12.7024 -12.7024 -1.6922 -1.6922 -1.5994 -1.5994 -1.1745 -1.1745 -0.5182 -0.5182 -0.4595 -0.4595 -0.2134 -0.2134 -0.1646 -0.1646 -0.0568 -0.0568 0.0658 0.0658 0.6536 0.6536 0.7038 0.7038 0.8332 0.8332 0.9964 0.9964 1.2141 1.2141 1.3666 1.3666 1.5991 1.5991 1.6883 1.6883 1.7494 1.7494 2.1320 2.1320 2.1580 2.1580 2.5360 2.5360 2.5596 2.5596 2.5766 2.5766 2.7111 2.7111 3.0131 3.0131 3.1177 3.1177 3.3135 3.3135 3.3883 3.3883 3.4455 3.4455 3.5752 3.5752 3.6256 3.6256 3.7389 3.7389 4.5623 4.5623 5.5544 5.5544 11.0573 11.0573 11.3462 11.3462 12.2413 12.2413 12.6067 12.6067 12.8607 12.8607 13.3405 13.3405 13.4425 13.4425 k = 0.4643 0.5001 0.3430 ( 14630 PWs) bands (ev): -16.9710 -16.9710 -16.8597 -16.8597 -16.3793 -16.3793 -16.3098 -16.3098 -16.2685 -16.2685 -16.2582 -16.2582 -12.7284 -12.7284 -12.7026 -12.7026 -1.6901 -1.6901 -1.6001 -1.6001 -1.1822 -1.1822 -0.5145 -0.5145 -0.4549 -0.4549 -0.2156 -0.2156 -0.1680 -0.1680 -0.0492 -0.0492 0.0652 0.0652 0.6743 0.6743 0.7226 0.7226 0.8356 0.8356 1.0090 1.0090 1.1958 1.1958 1.3645 1.3645 1.5965 1.5965 1.6906 1.6906 1.7424 1.7424 2.1313 2.1313 2.1629 2.1629 2.5295 2.5295 2.5524 2.5524 2.5771 2.5771 2.6858 2.6858 3.0123 3.0123 3.1187 3.1187 3.3080 3.3080 3.3841 3.3841 3.4463 3.4463 3.5757 3.5757 3.6236 3.6236 3.7387 3.7387 4.5572 4.5572 5.5540 5.5540 11.0563 11.0563 11.3676 11.3676 12.2556 12.2556 12.5780 12.5780 12.9264 12.9264 13.2774 13.2774 13.4639 13.4639 k = 0.4732 0.5097 0.3289 ( 14627 PWs) bands (ev): -16.9711 -16.9711 -16.8592 -16.8592 -16.3818 -16.3818 -16.3083 -16.3083 -16.2680 -16.2680 -16.2579 -16.2579 -12.7291 -12.7291 -12.7028 -12.7028 -1.6876 -1.6876 -1.6012 -1.6012 -1.1879 -1.1879 -0.5113 -0.5113 -0.4498 -0.4498 -0.2185 -0.2185 -0.1714 -0.1714 -0.0423 -0.0423 0.0627 0.0627 0.6921 0.6921 0.7409 0.7409 0.8425 0.8425 1.0217 1.0217 1.1755 1.1755 1.3633 1.3633 1.5914 1.5914 1.6962 1.6962 1.7337 1.7337 2.1326 2.1326 2.1705 2.1705 2.5216 2.5216 2.5445 2.5445 2.5774 2.5774 2.6603 2.6603 3.0111 3.0111 3.1212 3.1212 3.3027 3.3027 3.3803 3.3803 3.4472 3.4472 3.5765 3.5765 3.6214 3.6214 3.7383 3.7383 4.5511 4.5511 5.5542 5.5542 11.0559 11.0559 11.3873 11.3873 12.2728 12.2728 12.5454 12.5454 12.9952 12.9952 13.2154 13.2154 13.4860 13.4860 k = 0.4821 0.5193 0.3148 ( 14636 PWs) bands (ev): -16.9711 -16.9711 -16.8589 -16.8589 -16.3843 -16.3843 -16.3067 -16.3067 -16.2674 -16.2674 -16.2576 -16.2576 -12.7298 -12.7298 -12.7030 -12.7030 -1.6850 -1.6850 -1.6028 -1.6028 -1.1918 -1.1918 -0.5090 -0.5090 -0.4441 -0.4441 -0.2221 -0.2221 -0.1747 -0.1747 -0.0365 -0.0365 0.0586 0.0586 0.7078 0.7078 0.7578 0.7578 0.8537 0.8537 1.0343 1.0343 1.1543 1.1543 1.3629 1.3629 1.5845 1.5845 1.7033 1.7033 1.7251 1.7251 2.1360 2.1360 2.1800 2.1800 2.5129 2.5129 2.5356 2.5356 2.5766 2.5766 2.6356 2.6356 3.0096 3.0096 3.1248 3.1248 3.2978 3.2978 3.3767 3.3767 3.4480 3.4480 3.5779 3.5779 3.6191 3.6191 3.7380 3.7380 4.5435 4.5435 5.5554 5.5554 11.0560 11.0560 11.4042 11.4042 12.2929 12.2929 12.5098 12.5098 13.0660 13.0660 13.1566 13.1566 13.5062 13.5062 k = 0.4911 0.5289 0.3006 ( 14624 PWs) bands (ev): -16.9708 -16.9708 -16.8588 -16.8588 -16.3866 -16.3866 -16.3051 -16.3051 -16.2669 -16.2669 -16.2574 -16.2574 -12.7303 -12.7303 -12.7032 -12.7032 -1.6823 -1.6823 -1.6048 -1.6048 -1.1937 -1.1937 -0.5078 -0.5078 -0.4378 -0.4378 -0.2262 -0.2262 -0.1779 -0.1779 -0.0325 -0.0325 0.0532 0.0532 0.7210 0.7210 0.7734 0.7734 0.8688 0.8688 1.0462 1.0462 1.1332 1.1332 1.3633 1.3633 1.5770 1.5770 1.7028 1.7028 1.7250 1.7250 2.1413 2.1413 2.1907 2.1907 2.5034 2.5034 2.5253 2.5253 2.5737 2.5737 2.6134 2.6134 3.0079 3.0079 3.1296 3.1296 3.2934 3.2934 3.3732 3.3732 3.4488 3.4488 3.5799 3.5799 3.6170 3.6170 3.7380 3.7380 4.5342 4.5342 5.5576 5.5576 11.0566 11.0566 11.4168 11.4168 12.3158 12.3158 12.4730 12.4730 13.0986 13.0986 13.1406 13.1406 13.5238 13.5238 k = 0.5000 0.5385 0.2865 ( 14622 PWs) bands (ev): -16.9704 -16.9704 -16.8590 -16.8590 -16.3889 -16.3889 -16.3035 -16.3035 -16.2663 -16.2663 -16.2573 -16.2573 -12.7308 -12.7308 -12.7035 -12.7035 -1.6793 -1.6793 -1.6073 -1.6073 -1.1938 -1.1938 -0.5079 -0.5079 -0.4310 -0.4310 -0.2308 -0.2308 -0.1810 -0.1810 -0.0310 -0.0310 0.0471 0.0471 0.7305 0.7305 0.7887 0.7887 0.8875 0.8875 1.0562 1.0562 1.1145 1.1145 1.3644 1.3644 1.5695 1.5695 1.6922 1.6922 1.7359 1.7359 2.1482 2.1482 2.2022 2.2022 2.4933 2.4933 2.5130 2.5130 2.5665 2.5665 2.5969 2.5969 3.0061 3.0061 3.1353 3.1353 3.2897 3.2897 3.3696 3.3696 3.4494 3.4494 3.5827 3.5827 3.6152 3.6152 3.7387 3.7387 4.5229 4.5229 5.5609 5.5609 11.0578 11.0578 11.4236 11.4236 12.3414 12.3414 12.4368 12.4368 13.0471 13.0471 13.2118 13.2118 13.5384 13.5384 k = 0.5000 0.5385 0.2865 ( 14622 PWs) bands (ev): -16.9704 -16.9704 -16.8590 -16.8590 -16.3889 -16.3889 -16.3035 -16.3035 -16.2663 -16.2663 -16.2573 -16.2573 -12.7308 -12.7308 -12.7035 -12.7035 -1.6793 -1.6793 -1.6073 -1.6073 -1.1938 -1.1938 -0.5079 -0.5079 -0.4310 -0.4310 -0.2308 -0.2308 -0.1810 -0.1810 -0.0310 -0.0310 0.0471 0.0471 0.7305 0.7305 0.7887 0.7887 0.8875 0.8875 1.0562 1.0562 1.1145 1.1145 1.3644 1.3644 1.5695 1.5695 1.6922 1.6922 1.7359 1.7359 2.1482 2.1482 2.2022 2.2022 2.4933 2.4933 2.5130 2.5130 2.5665 2.5665 2.5969 2.5969 3.0061 3.0061 3.1353 3.1353 3.2897 3.2897 3.3696 3.3696 3.4494 3.4494 3.5827 3.5827 3.6152 3.6152 3.7387 3.7387 4.5229 4.5229 5.5609 5.5609 11.0578 11.0578 11.4236 11.4236 12.3414 12.3414 12.4368 12.4368 13.0471 13.0471 13.2118 13.2118 13.5384 13.5384 k = 0.5000 0.5385 0.2674 ( 14614 PWs) bands (ev): -16.9697 -16.9697 -16.8594 -16.8594 -16.3919 -16.3919 -16.3013 -16.3013 -16.2656 -16.2656 -16.2573 -16.2573 -12.7314 -12.7314 -12.7038 -12.7038 -1.6754 -1.6754 -1.6110 -1.6110 -1.1926 -1.1926 -0.5095 -0.5095 -0.4212 -0.4212 -0.2369 -0.2369 -0.1851 -0.1851 -0.0329 -0.0329 0.0396 0.0396 0.7390 0.7390 0.8112 0.8112 0.9172 0.9172 1.0635 1.0635 1.0964 1.0964 1.3663 1.3663 1.5601 1.5601 1.6760 1.6760 1.7538 1.7538 2.1584 2.1584 2.2179 2.2179 2.4787 2.4787 2.4952 2.4952 2.5481 2.5481 2.5842 2.5842 3.0020 3.0020 3.1438 3.1438 3.2854 3.2854 3.3639 3.3639 3.4501 3.4501 3.5873 3.5873 3.6131 3.6131 3.7398 3.7398 4.5049 4.5049 5.5679 5.5679 11.0595 11.0595 11.4281 11.4281 12.3775 12.3775 12.3898 12.3898 12.9812 12.9812 13.3080 13.3080 13.5564 13.5564 k = 0.5000 0.5385 0.2483 ( 14614 PWs) bands (ev): -16.9691 -16.9691 -16.8597 -16.8597 -16.3948 -16.3948 -16.2991 -16.2991 -16.2648 -16.2648 -16.2574 -16.2574 -12.7320 -12.7320 -12.7041 -12.7041 -1.6717 -1.6717 -1.6146 -1.6146 -1.1915 -1.1915 -0.5118 -0.5118 -0.4112 -0.4112 -0.2424 -0.2424 -0.1892 -0.1892 -0.0393 -0.0393 0.0352 0.0352 0.7458 0.7458 0.8352 0.8352 0.9508 0.9508 1.0563 1.0563 1.0940 1.0940 1.3681 1.3681 1.5518 1.5518 1.6611 1.6611 1.7721 1.7721 2.1685 2.1685 2.2329 2.2329 2.4628 2.4628 2.4788 2.4788 2.5241 2.5241 2.5757 2.5757 2.9946 2.9946 3.1523 3.1523 3.2818 3.2818 3.3567 3.3567 3.4507 3.4507 3.5923 3.5923 3.6113 3.6113 3.7399 3.7399 4.4844 4.4844 5.5781 5.5781 11.0609 11.0609 11.4321 11.4321 12.3430 12.3430 12.4138 12.4138 12.9210 12.9210 13.4011 13.4011 13.5742 13.5742 k = 0.5000 0.5385 0.2292 ( 14632 PWs) bands (ev): -16.9685 -16.9685 -16.8601 -16.8601 -16.3975 -16.3975 -16.2969 -16.2969 -16.2641 -16.2641 -16.2576 -16.2576 -12.7326 -12.7326 -12.7044 -12.7044 -1.6682 -1.6682 -1.6181 -1.6181 -1.1904 -1.1904 -0.5147 -0.5147 -0.4013 -0.4013 -0.2473 -0.2473 -0.1935 -0.1935 -0.0502 -0.0502 0.0345 0.0345 0.7516 0.7516 0.8594 0.8594 0.9851 0.9851 1.0423 1.0423 1.1019 1.1019 1.3698 1.3698 1.5449 1.5449 1.6474 1.6474 1.7907 1.7907 2.1781 2.1781 2.2471 2.2471 2.4451 2.4451 2.4640 2.4640 2.4996 2.4996 2.5675 2.5675 2.9842 2.9842 3.1603 3.1603 3.2791 3.2791 3.3485 3.3485 3.4513 3.4513 3.5975 3.5975 3.6097 3.6097 3.7391 3.7391 4.4624 4.4624 5.5908 5.5908 11.0620 11.0620 11.4358 11.4358 12.2975 12.2975 12.4490 12.4490 12.8665 12.8665 13.4864 13.4864 13.5923 13.5923 k = 0.5000 0.5385 0.2101 ( 14632 PWs) bands (ev): -16.9679 -16.9679 -16.8604 -16.8604 -16.4000 -16.4000 -16.2947 -16.2947 -16.2635 -16.2635 -16.2579 -16.2579 -12.7331 -12.7331 -12.7047 -12.7047 -1.6650 -1.6650 -1.6215 -1.6215 -1.1893 -1.1893 -0.5177 -0.5177 -0.3921 -0.3921 -0.2516 -0.2516 -0.1980 -0.1980 -0.0638 -0.0638 0.0368 0.0368 0.7569 0.7569 0.8828 0.8828 1.0038 1.0038 1.0459 1.0459 1.1114 1.1114 1.3714 1.3714 1.5394 1.5394 1.6349 1.6349 1.8094 1.8094 2.1873 2.1873 2.2604 2.2604 2.4251 2.4251 2.4514 2.4514 2.4770 2.4770 2.5586 2.5586 2.9709 2.9709 3.1674 3.1674 3.2772 3.2772 3.3394 3.3394 3.4519 3.4519 3.6027 3.6027 3.6086 3.6086 3.7375 3.7375 4.4398 4.4398 5.6053 5.6053 11.0629 11.0629 11.4390 11.4390 12.2535 12.2535 12.4834 12.4834 12.8176 12.8176 13.5554 13.5554 13.6137 13.6137 k = 0.5000 0.5385 0.1910 ( 14640 PWs) bands (ev): -16.9673 -16.9673 -16.8607 -16.8607 -16.4024 -16.4024 -16.2925 -16.2925 -16.2629 -16.2629 -16.2583 -16.2583 -12.7336 -12.7336 -12.7050 -12.7050 -1.6620 -1.6620 -1.6246 -1.6246 -1.1883 -1.1883 -0.5209 -0.5209 -0.3836 -0.3836 -0.2552 -0.2552 -0.2027 -0.2027 -0.0782 -0.0782 0.0407 0.0407 0.7617 0.7617 0.9041 0.9041 0.9950 0.9950 1.0795 1.0795 1.1210 1.1210 1.3729 1.3729 1.5357 1.5357 1.6238 1.6238 1.8280 1.8280 2.1958 2.1958 2.2725 2.2725 2.4022 2.4022 2.4410 2.4410 2.4576 2.4576 2.5490 2.5490 2.9545 2.9545 3.1732 3.1732 3.2760 3.2760 3.3300 3.3300 3.4525 3.4525 3.6055 3.6055 3.6101 3.6101 3.7354 3.7354 4.4173 4.4173 5.6208 5.6208 11.0635 11.0635 11.4419 11.4419 12.2115 12.2115 12.5165 12.5165 12.7741 12.7741 13.5947 13.5947 13.6446 13.6446 k = 0.5000 0.5385 0.1719 ( 14644 PWs) bands (ev): -16.9668 -16.9668 -16.8610 -16.8610 -16.4046 -16.4046 -16.2903 -16.2903 -16.2623 -16.2623 -16.2588 -16.2588 -12.7341 -12.7341 -12.7052 -12.7052 -1.6592 -1.6592 -1.6276 -1.6276 -1.1873 -1.1873 -0.5239 -0.5239 -0.3762 -0.3762 -0.2582 -0.2582 -0.2077 -0.2077 -0.0922 -0.0922 0.0455 0.0455 0.7661 0.7661 0.9219 0.9219 0.9836 0.9836 1.1158 1.1158 1.1338 1.1338 1.3742 1.3742 1.5337 1.5337 1.6139 1.6139 1.8462 1.8462 2.2036 2.2036 2.2834 2.2834 2.3771 2.3771 2.4328 2.4328 2.4421 2.4421 2.5388 2.5388 2.9353 2.9353 3.1776 3.1776 3.2754 3.2754 3.3209 3.3209 3.4532 3.4532 3.6050 3.6050 3.6151 3.6151 3.7328 3.7328 4.3958 4.3958 5.6367 5.6367 11.0639 11.0639 11.4443 11.4443 12.1719 12.1719 12.5480 12.5480 12.7357 12.7357 13.6127 13.6127 13.6734 13.6734 k = 0.5000 0.5385 0.1528 ( 14648 PWs) bands (ev): -16.9663 -16.9663 -16.8613 -16.8613 -16.4065 -16.4065 -16.2882 -16.2882 -16.2618 -16.2618 -16.2594 -16.2594 -12.7346 -12.7346 -12.7054 -12.7054 -1.6568 -1.6568 -1.6304 -1.6304 -1.1864 -1.1864 -0.5269 -0.5269 -0.3698 -0.3698 -0.2606 -0.2606 -0.2130 -0.2130 -0.1046 -0.1046 0.0506 0.0506 0.7703 0.7703 0.9322 0.9322 0.9779 0.9779 1.1319 1.1319 1.1663 1.1663 1.3755 1.3755 1.5336 1.5336 1.6053 1.6053 1.8638 1.8638 2.2106 2.2106 2.2929 2.2929 2.3511 2.3511 2.4241 2.4241 2.4325 2.4325 2.5286 2.5286 2.9132 2.9132 3.1806 3.1806 3.2749 3.2749 3.3126 3.3126 3.4540 3.4540 3.6041 3.6041 3.6203 3.6203 3.7299 3.7299 4.3757 4.3757 5.6523 5.6523 11.0641 11.0641 11.4465 11.4465 12.1352 12.1352 12.5777 12.5777 12.7022 12.7022 13.6238 13.6238 13.6901 13.6901 k = 0.5000 0.5385 0.1337 ( 14652 PWs) bands (ev): -16.9659 -16.9659 -16.8615 -16.8615 -16.4083 -16.4083 -16.2862 -16.2862 -16.2615 -16.2615 -16.2599 -16.2599 -12.7349 -12.7349 -12.7056 -12.7056 -1.6545 -1.6545 -1.6329 -1.6329 -1.1856 -1.1856 -0.5296 -0.5296 -0.3646 -0.3646 -0.2626 -0.2626 -0.2186 -0.2186 -0.1151 -0.1151 0.0556 0.0556 0.7740 0.7740 0.9316 0.9316 0.9821 0.9821 1.1392 1.1392 1.2055 1.2055 1.3767 1.3767 1.5350 1.5350 1.5979 1.5979 1.8805 1.8805 2.2168 2.2168 2.3006 2.3006 2.3255 2.3255 2.4136 2.4136 2.4300 2.4300 2.5187 2.5187 2.8885 2.8885 3.1824 3.1824 3.2739 3.2739 3.3060 3.3060 3.4547 3.4547 3.6033 3.6033 3.6252 3.6252 3.7270 3.7270 4.3575 4.3575 5.6672 5.6672 11.0642 11.0642 11.4483 11.4483 12.1019 12.1019 12.6050 12.6050 12.6732 12.6732 13.6317 13.6317 13.6982 13.6982 k = 0.5000 0.5385 0.1146 ( 14638 PWs) bands (ev): -16.9655 -16.9655 -16.8617 -16.8617 -16.4099 -16.4099 -16.2842 -16.2842 -16.2617 -16.2617 -16.2602 -16.2602 -12.7353 -12.7353 -12.7058 -12.7058 -1.6525 -1.6525 -1.6352 -1.6352 -1.1849 -1.1849 -0.5320 -0.5320 -0.3605 -0.3605 -0.2642 -0.2642 -0.2243 -0.2243 -0.1234 -0.1234 0.0604 0.0604 0.7774 0.7774 0.9248 0.9248 0.9916 0.9916 1.1448 1.1448 1.2431 1.2431 1.3778 1.3778 1.5378 1.5378 1.5917 1.5917 1.8960 1.8960 2.2221 2.2221 2.2983 2.2983 2.3096 2.3096 2.4038 2.4038 2.4314 2.4314 2.5096 2.5096 2.8619 2.8619 3.1832 3.1832 3.2718 3.2718 3.3018 3.3018 3.4555 3.4555 3.6027 3.6027 3.6297 3.6297 3.7243 3.7243 4.3415 4.3415 5.6809 5.6809 11.0642 11.0642 11.4498 11.4498 12.0723 12.0723 12.6297 12.6297 12.6486 12.6486 13.6376 13.6376 13.7021 13.7021 k = 0.5000 0.5385 0.0955 ( 14638 PWs) bands (ev): -16.9652 -16.9652 -16.8619 -16.8619 -16.4112 -16.4112 -16.2824 -16.2824 -16.2623 -16.2623 -16.2601 -16.2601 -12.7356 -12.7356 -12.7060 -12.7060 -1.6508 -1.6508 -1.6372 -1.6372 -1.1843 -1.1843 -0.5341 -0.5341 -0.3575 -0.3575 -0.2656 -0.2656 -0.2296 -0.2296 -0.1296 -0.1296 0.0648 0.0648 0.7804 0.7804 0.9168 0.9168 1.0016 1.0016 1.1492 1.1492 1.2774 1.2774 1.3789 1.3789 1.5414 1.5414 1.5866 1.5866 1.9101 1.9101 2.2265 2.2265 2.2768 2.2768 2.3134 2.3134 2.3953 2.3953 2.4358 2.4358 2.5018 2.5018 2.8341 2.8341 3.1833 3.1833 3.2686 3.2686 3.2999 3.2999 3.4562 3.4562 3.6021 3.6021 3.6336 3.6336 3.7218 3.7218 4.3278 4.3278 5.6931 5.6931 11.0641 11.0641 11.4510 11.4510 12.0467 12.0467 12.6281 12.6281 12.6514 12.6514 13.6417 13.6417 13.7041 13.7041 k = 0.5000 0.5385 0.0764 ( 14642 PWs) bands (ev): -16.9649 -16.9649 -16.8621 -16.8621 -16.4123 -16.4123 -16.2807 -16.2807 -16.2631 -16.2631 -16.2599 -16.2599 -12.7358 -12.7358 -12.7061 -12.7061 -1.6493 -1.6493 -1.6390 -1.6390 -1.1838 -1.1838 -0.5359 -0.5359 -0.3553 -0.3553 -0.2668 -0.2668 -0.2343 -0.2343 -0.1341 -0.1341 0.0685 0.0685 0.7829 0.7829 0.9095 0.9095 1.0101 1.0101 1.1527 1.1527 1.3072 1.3072 1.3798 1.3798 1.5454 1.5454 1.5827 1.5827 1.9224 1.9224 2.2296 2.2296 2.2574 2.2574 2.3168 2.3168 2.3884 2.3884 2.4421 2.4421 2.4959 2.4959 2.8066 2.8066 3.1829 3.1829 3.2650 3.2650 3.2996 3.2996 3.4569 3.4569 3.6017 3.6017 3.6370 3.6370 3.7196 3.7196 4.3166 4.3166 5.7034 5.7034 11.0640 11.0640 11.4520 11.4520 12.0254 12.0254 12.6115 12.6115 12.6697 12.6697 13.6444 13.6444 13.7054 13.7054 k = 0.5000 0.5385 0.0573 ( 14650 PWs) bands (ev): -16.9647 -16.9647 -16.8622 -16.8622 -16.4132 -16.4132 -16.2792 -16.2792 -16.2639 -16.2639 -16.2597 -16.2597 -12.7360 -12.7360 -12.7062 -12.7062 -1.6480 -1.6480 -1.6404 -1.6404 -1.1834 -1.1834 -0.5373 -0.5373 -0.3540 -0.3540 -0.2680 -0.2680 -0.2380 -0.2380 -0.1371 -0.1371 0.0715 0.0715 0.7849 0.7849 0.9035 0.9035 1.0168 1.0168 1.1552 1.1552 1.3314 1.3314 1.3808 1.3808 1.5490 1.5490 1.5797 1.5797 1.9325 1.9325 2.2299 2.2299 2.2433 2.2433 2.3192 2.3192 2.3830 2.3830 2.4491 2.4491 2.4923 2.4923 2.7809 2.7809 3.1823 3.1823 3.2617 3.2617 3.3000 3.3000 3.4574 3.4574 3.6013 3.6013 3.6396 3.6396 3.7179 3.7179 4.3079 4.3079 5.7117 5.7117 11.0639 11.0639 11.4528 11.4528 12.0087 12.0087 12.5988 12.5988 12.6843 12.6843 13.6461 13.6461 13.7063 13.7063 k = 0.5000 0.5385 0.0382 ( 14638 PWs) bands (ev): -16.9646 -16.9646 -16.8623 -16.8623 -16.4138 -16.4138 -16.2780 -16.2780 -16.2646 -16.2646 -16.2595 -16.2595 -12.7362 -12.7362 -12.7063 -12.7063 -1.6470 -1.6470 -1.6417 -1.6417 -1.1831 -1.1831 -0.5384 -0.5384 -0.3531 -0.3531 -0.2690 -0.2690 -0.2406 -0.2406 -0.1390 -0.1390 0.0737 0.0737 0.7864 0.7864 0.8991 0.8991 1.0216 1.0216 1.1570 1.1570 1.3492 1.3492 1.3819 1.3819 1.5519 1.5519 1.5777 1.5777 1.9400 1.9400 2.2236 2.2236 2.2390 2.2390 2.3207 2.3207 2.3792 2.3792 2.4549 2.4549 2.4915 2.4915 2.7594 2.7594 3.1817 3.1817 3.2592 3.2592 3.3005 3.3005 3.4579 3.4579 3.6011 3.6011 3.6415 3.6415 3.7167 3.7167 4.3017 4.3017 5.7177 5.7177 11.0638 11.0638 11.4533 11.4533 11.9966 11.9966 12.5897 12.5897 12.6949 12.6949 13.6470 13.6470 13.7070 13.7070 k = 0.5000 0.5385 0.0191 ( 14636 PWs) bands (ev): -16.9645 -16.9645 -16.8623 -16.8623 -16.4142 -16.4142 -16.2772 -16.2772 -16.2652 -16.2652 -16.2594 -16.2594 -12.7363 -12.7363 -12.7063 -12.7063 -1.6461 -1.6461 -1.6426 -1.6426 -1.1830 -1.1830 -0.5390 -0.5390 -0.3527 -0.3527 -0.2696 -0.2696 -0.2421 -0.2421 -0.1400 -0.1400 0.0750 0.0750 0.7873 0.7873 0.8964 0.8964 1.0244 1.0244 1.1581 1.1581 1.3596 1.3596 1.3831 1.3831 1.5538 1.5538 1.5765 1.5765 1.9448 1.9448 2.2170 2.2170 2.2391 2.2391 2.3214 2.3214 2.3769 2.3769 2.4583 2.4583 2.4925 2.4925 2.7449 2.7449 3.1813 3.1813 3.2577 3.2577 3.3010 3.3010 3.4581 3.4581 3.6010 3.6010 3.6426 3.6426 3.7160 3.7160 4.2980 4.2980 5.7213 5.7213 11.0637 11.0637 11.4536 11.4536 11.9893 11.9893 12.5843 12.5843 12.7014 12.7014 13.6475 13.6475 13.7075 13.7075 k = 0.5000 0.5385 0.0000 ( 14650 PWs) bands (ev): -16.9645 -16.9645 -16.8623 -16.8623 -16.4143 -16.4143 -16.2769 -16.2769 -16.2654 -16.2654 -16.2594 -16.2594 -12.7363 -12.7363 -12.7063 -12.7063 -1.6458 -1.6458 -1.6430 -1.6430 -1.1829 -1.1829 -0.5392 -0.5392 -0.3526 -0.3526 -0.2699 -0.2699 -0.2426 -0.2426 -0.1404 -0.1404 0.0755 0.0755 0.7876 0.7876 0.8955 0.8955 1.0254 1.0254 1.1584 1.1584 1.3629 1.3629 1.3837 1.3837 1.5544 1.5544 1.5762 1.5762 1.9464 1.9464 2.2145 2.2145 2.2393 2.2393 2.3216 2.3216 2.3761 2.3761 2.4593 2.4593 2.4933 2.4933 2.7397 2.7397 3.1812 3.1812 3.2571 3.2571 3.3011 3.3011 3.4582 3.4582 3.6009 3.6009 3.6430 3.6430 3.7157 3.7157 4.2968 4.2968 5.7226 5.7226 11.0637 11.0637 11.4537 11.4537 11.9869 11.9869 12.5826 12.5826 12.7036 12.7036 13.6476 13.6476 13.7076 13.7076 k = 0.0000 0.0000 0.6823 ( 14632 PWs) bands (ev): -16.9802 -16.9802 -16.8534 -16.8534 -16.3455 -16.3455 -16.3194 -16.3194 -16.2946 -16.2946 -16.2562 -16.2562 -12.7220 -12.7220 -12.6987 -12.6987 -1.7475 -1.7475 -1.5561 -1.5561 -1.2056 -1.2056 -0.6435 -0.6435 -0.4496 -0.4496 -0.2313 -0.2313 -0.1612 -0.1612 -0.0483 -0.0483 0.0563 0.0563 0.4300 0.4300 0.7003 0.7003 0.7957 0.7957 1.1851 1.1851 1.3240 1.3240 1.5268 1.5268 1.6590 1.6590 1.7925 1.7925 1.8189 1.8189 2.1195 2.1195 2.2473 2.2473 2.3427 2.3427 2.4882 2.4882 2.7464 2.7464 2.8117 2.8117 2.9167 2.9167 2.9634 2.9634 3.1999 3.1999 3.3838 3.3838 3.4695 3.4695 3.5666 3.5666 3.6289 3.6289 3.7234 3.7234 4.4181 4.4181 5.8780 5.8780 11.0003 11.0003 11.3273 11.3273 11.7658 11.7658 12.1127 12.1127 13.1668 13.1668 13.4161 13.4161 14.2399 14.2401 k = 0.0132 0.0142 0.6823 ( 14618 PWs) bands (ev): -16.9800 -16.9800 -16.8537 -16.8537 -16.3455 -16.3455 -16.3194 -16.3194 -16.2946 -16.2946 -16.2563 -16.2563 -12.7220 -12.7220 -12.6987 -12.6987 -1.7471 -1.7471 -1.5563 -1.5563 -1.2035 -1.2035 -0.6429 -0.6429 -0.4494 -0.4494 -0.2312 -0.2312 -0.1617 -0.1617 -0.0489 -0.0489 0.0556 0.0556 0.4310 0.4310 0.6946 0.6946 0.7960 0.7960 1.1846 1.1846 1.3250 1.3250 1.5269 1.5269 1.6487 1.6487 1.7808 1.7808 1.8397 1.8397 2.1132 2.1132 2.2551 2.2551 2.3439 2.3439 2.4868 2.4868 2.7505 2.7505 2.8108 2.8108 2.9158 2.9158 2.9653 2.9653 3.1997 3.1997 3.3837 3.3837 3.4691 3.4691 3.5665 3.5665 3.6287 3.6287 3.7227 3.7227 4.4204 4.4204 5.8758 5.8758 11.0009 11.0009 11.3270 11.3270 11.7688 11.7688 12.1148 12.1148 13.1621 13.1621 13.4181 13.4181 14.2370 14.2370 k = 0.0263 0.0283 0.6823 ( 14620 PWs) bands (ev): -16.9794 -16.9794 -16.8544 -16.8544 -16.3454 -16.3454 -16.3195 -16.3195 -16.2945 -16.2945 -16.2564 -16.2564 -12.7219 -12.7219 -12.6989 -12.6989 -1.7459 -1.7459 -1.5570 -1.5570 -1.1969 -1.1969 -0.6413 -0.6413 -0.4490 -0.4490 -0.2310 -0.2310 -0.1632 -0.1632 -0.0507 -0.0507 0.0535 0.0535 0.4340 0.4340 0.6780 0.6780 0.7968 0.7968 1.1832 1.1832 1.3279 1.3279 1.5270 1.5270 1.6219 1.6219 1.7688 1.7688 1.8739 1.8739 2.0985 2.0985 2.2744 2.2744 2.3476 2.3476 2.4834 2.4834 2.7620 2.7620 2.8082 2.8082 2.9133 2.9133 2.9708 2.9708 3.1992 3.1992 3.3835 3.3835 3.4678 3.4678 3.5660 3.5660 3.6282 3.6282 3.7206 3.7206 4.4271 4.4271 5.8695 5.8695 11.0030 11.0030 11.3262 11.3262 11.7780 11.7780 12.1214 12.1214 13.1487 13.1487 13.4236 13.4236 14.2284 14.2285 k = 0.0395 0.0425 0.6823 ( 14632 PWs) bands (ev): -16.9784 -16.9784 -16.8555 -16.8555 -16.3452 -16.3452 -16.3195 -16.3195 -16.2943 -16.2943 -16.2566 -16.2566 -12.7217 -12.7217 -12.6991 -12.6991 -1.7438 -1.7438 -1.5581 -1.5581 -1.1861 -1.1861 -0.6386 -0.6386 -0.4483 -0.4483 -0.2306 -0.2306 -0.1657 -0.1657 -0.0537 -0.0537 0.0500 0.0500 0.4390 0.4390 0.6509 0.6509 0.7982 0.7982 1.1808 1.1808 1.3328 1.3328 1.5260 1.5260 1.5875 1.5875 1.7603 1.7603 1.9085 1.9085 2.0828 2.0828 2.2992 2.2992 2.3541 2.3541 2.4794 2.4794 2.7782 2.7782 2.8040 2.8040 2.9095 2.9095 2.9803 2.9803 3.1984 3.1984 3.3831 3.3831 3.4657 3.4657 3.5653 3.5653 3.6274 3.6274 3.7171 3.7171 4.4385 4.4385 5.8588 5.8588 11.0064 11.0064 11.3249 11.3249 11.7930 11.7930 12.1324 12.1324 13.1276 13.1276 13.4319 13.4319 14.2143 14.2143 k = 0.0526 0.0567 0.6823 ( 14650 PWs) bands (ev): -16.9770 -16.9770 -16.8571 -16.8571 -16.3451 -16.3451 -16.3196 -16.3196 -16.2940 -16.2940 -16.2568 -16.2568 -12.7214 -12.7214 -12.6993 -12.6993 -1.7409 -1.7409 -1.5597 -1.5597 -1.1709 -1.1709 -0.6348 -0.6348 -0.4473 -0.4473 -0.2302 -0.2302 -0.1692 -0.1692 -0.0577 -0.0577 0.0452 0.0452 0.4459 0.4459 0.6142 0.6142 0.8000 0.8000 1.1774 1.1774 1.3394 1.3394 1.5174 1.5174 1.5568 1.5568 1.7528 1.7528 1.9355 1.9355 2.0747 2.0747 2.3251 2.3251 2.3642 2.3642 2.4766 2.4766 2.7945 2.7945 2.7996 2.7996 2.9051 2.9051 2.9941 2.9941 3.1972 3.1972 3.3826 3.3826 3.4628 3.4628 3.5643 3.5643 3.6263 3.6263 3.7123 3.7123 4.4544 4.4544 5.8440 5.8440 11.0111 11.0111 11.3230 11.3230 11.8136 11.8136 12.1482 12.1482 13.0999 13.0999 13.4422 13.4422 14.1952 14.1952 k = 0.0658 0.0709 0.6823 ( 14630 PWs) bands (ev): -16.9751 -16.9751 -16.8591 -16.8591 -16.3448 -16.3448 -16.3197 -16.3197 -16.2937 -16.2937 -16.2571 -16.2571 -12.7211 -12.7211 -12.6997 -12.6997 -1.7373 -1.7373 -1.5617 -1.5617 -1.1515 -1.1515 -0.6299 -0.6299 -0.4461 -0.4461 -0.2298 -0.2298 -0.1735 -0.1735 -0.0627 -0.0627 0.0392 0.0392 0.4548 0.4548 0.5691 0.5691 0.8023 0.8023 1.1731 1.1731 1.3475 1.3475 1.4876 1.4876 1.5463 1.5463 1.7451 1.7451 1.9455 1.9455 2.0837 2.0837 2.3483 2.3483 2.3794 2.3794 2.4763 2.4763 2.7906 2.7906 2.8118 2.8118 2.9007 2.9007 3.0126 3.0126 3.1955 3.1955 3.3820 3.3820 3.4592 3.4592 3.5630 3.5630 3.6251 3.6251 3.7063 3.7063 4.4751 4.4751 5.8250 5.8250 11.0171 11.0171 11.3205 11.3205 11.8393 11.8393 12.1692 12.1692 13.0669 13.0669 13.4539 13.4539 14.1718 14.1718 k = 0.0789 0.0850 0.6823 ( 14622 PWs) bands (ev): -16.9729 -16.9729 -16.8615 -16.8615 -16.3446 -16.3446 -16.3198 -16.3198 -16.2933 -16.2933 -16.2575 -16.2575 -12.7206 -12.7206 -12.7001 -12.7001 -1.7329 -1.7329 -1.5641 -1.5641 -1.1279 -1.1279 -0.6240 -0.6240 -0.4448 -0.4448 -0.2294 -0.2294 -0.1787 -0.1787 -0.0684 -0.0684 0.0321 0.0321 0.4655 0.4655 0.5166 0.5166 0.8050 0.8050 1.1679 1.1679 1.3567 1.3567 1.4477 1.4477 1.5466 1.5466 1.7368 1.7368 1.9376 1.9376 2.1107 2.1107 2.3668 2.3668 2.3997 2.3997 2.4801 2.4801 2.7824 2.7824 2.8221 2.8221 2.8977 2.8977 3.0357 3.0357 3.1936 3.1936 3.3813 3.3813 3.4548 3.4548 3.5613 3.5613 3.6237 3.6237 3.6993 3.6993 4.5005 4.5005 5.8018 5.8018 11.0243 11.0243 11.3172 11.3172 11.8696 11.8696 12.1957 12.1957 13.0296 13.0296 13.4666 13.4666 14.1450 14.1450 k = 0.0921 0.0992 0.6823 ( 14630 PWs) bands (ev): -16.9704 -16.9704 -16.8643 -16.8643 -16.3443 -16.3443 -16.3200 -16.3200 -16.2929 -16.2929 -16.2580 -16.2580 -12.7202 -12.7202 -12.7006 -12.7006 -1.7279 -1.7279 -1.5671 -1.5671 -1.1001 -1.1001 -0.6172 -0.6172 -0.4434 -0.4434 -0.2291 -0.2291 -0.1845 -0.1845 -0.0748 -0.0748 0.0242 0.0242 0.4579 0.4579 0.4785 0.4785 0.8079 0.8079 1.1618 1.1618 1.3644 1.3644 1.4087 1.4087 1.5497 1.5497 1.7275 1.7275 1.9201 1.9201 2.1473 2.1473 2.3831 2.3831 2.4208 2.4208 2.4892 2.4892 2.7730 2.7730 2.8255 2.8255 2.8973 2.8973 3.0621 3.0621 3.1915 3.1915 3.3806 3.3806 3.4500 3.4500 3.5592 3.5592 3.6222 3.6222 3.6915 3.6915 4.5307 4.5307 5.7746 5.7746 11.0328 11.0328 11.3133 11.3133 11.9037 11.9037 12.2284 12.2284 12.9888 12.9888 13.4803 13.4803 14.1155 14.1155 k = 0.1053 0.1134 0.6823 ( 14608 PWs) bands (ev): -16.9674 -16.9674 -16.8675 -16.8675 -16.3439 -16.3439 -16.3201 -16.3201 -16.2924 -16.2924 -16.2585 -16.2585 -12.7196 -12.7196 -12.7012 -12.7012 -1.7222 -1.7222 -1.5705 -1.5705 -1.0683 -1.0683 -0.6095 -0.6095 -0.4421 -0.4421 -0.2291 -0.2291 -0.1908 -0.1908 -0.0816 -0.0816 0.0155 0.0155 0.3947 0.3947 0.4928 0.4928 0.8110 0.8110 1.1548 1.1548 1.3506 1.3506 1.3926 1.3926 1.5542 1.5542 1.7173 1.7173 1.8988 1.8988 2.1875 2.1875 2.3995 2.3995 2.4390 2.4390 2.5042 2.5042 2.7627 2.7627 2.8223 2.8223 2.8996 2.8996 3.0895 3.0895 3.1900 3.1900 3.3798 3.3798 3.4447 3.4447 3.5567 3.5567 3.6207 3.6207 3.6830 3.6830 4.5656 4.5656 5.7433 5.7433 11.0424 11.0424 11.3085 11.3085 11.9407 11.9407 12.2679 12.2679 12.9453 12.9453 13.4947 13.4947 14.0841 14.0841 k = 0.1184 0.1276 0.6823 ( 14596 PWs) bands (ev): -16.9642 -16.9642 -16.8710 -16.8710 -16.3436 -16.3436 -16.3203 -16.3203 -16.2918 -16.2918 -16.2590 -16.2590 -12.7190 -12.7190 -12.7018 -12.7018 -1.7159 -1.7159 -1.5744 -1.5744 -1.0326 -1.0326 -0.6009 -0.6009 -0.4409 -0.4409 -0.2297 -0.2297 -0.1975 -0.1975 -0.0887 -0.0887 0.0062 0.0062 0.3279 0.3279 0.5091 0.5091 0.8139 0.8139 1.1471 1.1471 1.3133 1.3133 1.4022 1.4022 1.5596 1.5596 1.7063 1.7063 1.8762 1.8762 2.2286 2.2286 2.4170 2.4170 2.4542 2.4542 2.5234 2.5234 2.7516 2.7516 2.8140 2.8140 2.9038 2.9038 3.1144 3.1144 3.1909 3.1909 3.3790 3.3790 3.4394 3.4394 3.5535 3.5535 3.6193 3.6193 3.6741 3.6741 4.6053 4.6053 5.7082 5.7082 11.0530 11.0530 11.3029 11.3029 11.9798 11.9798 12.3149 12.3149 12.8996 12.8996 13.5098 13.5098 14.0514 14.0514 k = 0.1316 0.1417 0.6823 ( 14610 PWs) bands (ev): -16.9606 -16.9606 -16.8749 -16.8749 -16.3432 -16.3432 -16.3205 -16.3205 -16.2912 -16.2912 -16.2597 -16.2597 -12.7183 -12.7183 -12.7025 -12.7025 -1.7092 -1.7092 -1.5787 -1.5787 -0.9932 -0.9932 -0.5915 -0.5915 -0.4400 -0.4400 -0.2310 -0.2310 -0.2042 -0.2042 -0.0958 -0.0958 -0.0034 -0.0034 0.2587 0.2587 0.5271 0.5271 0.8164 0.8164 1.1385 1.1385 1.2742 1.2742 1.4162 1.4162 1.5658 1.5658 1.6944 1.6944 1.8534 1.8534 2.2692 2.2692 2.4357 2.4357 2.4681 2.4681 2.5437 2.5437 2.7398 2.7398 2.8024 2.8024 2.9092 2.9092 3.1310 3.1310 3.1983 3.1983 3.3781 3.3781 3.4343 3.4343 3.5496 3.5496 3.6179 3.6179 3.6651 3.6651 4.6494 4.6494 5.6694 5.6694 11.0646 11.0646 11.2963 11.2963 12.0203 12.0203 12.3699 12.3699 12.8523 12.8523 13.5256 13.5256 14.0179 14.0179 k = 0.1447 0.1559 0.6823 ( 14610 PWs) bands (ev): -16.9567 -16.9567 -16.8790 -16.8790 -16.3428 -16.3428 -16.3207 -16.3207 -16.2905 -16.2905 -16.2603 -16.2603 -12.7176 -12.7176 -12.7032 -12.7032 -1.7019 -1.7019 -1.5835 -1.5835 -0.9501 -0.9501 -0.5815 -0.5815 -0.4395 -0.4395 -0.2336 -0.2336 -0.2106 -0.2106 -0.1029 -0.1029 -0.0132 -0.0132 0.1887 0.1887 0.5468 0.5468 0.8180 0.8180 1.1294 1.1294 1.2367 1.2367 1.4318 1.4318 1.5729 1.5729 1.6819 1.6819 1.8308 1.8308 2.3086 2.3086 2.4557 2.4557 2.4822 2.4822 2.5624 2.5624 2.7274 2.7274 2.7888 2.7888 2.9156 2.9156 3.1356 3.1356 3.2148 3.2148 3.3770 3.3770 3.4300 3.4300 3.5449 3.5449 3.6167 3.6167 3.6565 3.6565 4.6976 4.6976 5.6269 5.6269 11.0771 11.0771 11.2888 11.2888 12.0615 12.0615 12.4332 12.4332 12.8039 12.8039 13.5419 13.5419 13.9839 13.9839 k = 0.1579 0.1701 0.6823 ( 14602 PWs) bands (ev): -16.9526 -16.9526 -16.8834 -16.8834 -16.3424 -16.3424 -16.3210 -16.3210 -16.2898 -16.2898 -16.2611 -16.2611 -12.7168 -12.7168 -12.7040 -12.7040 -1.6944 -1.6944 -1.5888 -1.5888 -0.9036 -0.9036 -0.5710 -0.5710 -0.4397 -0.4397 -0.2380 -0.2380 -0.2164 -0.2164 -0.1103 -0.1103 -0.0230 -0.0230 0.1196 0.1196 0.5679 0.5679 0.8183 0.8183 1.1196 1.1196 1.2020 1.2020 1.4482 1.4482 1.5807 1.5807 1.6687 1.6687 1.8088 1.8088 2.3460 2.3460 2.4769 2.4769 2.4971 2.4971 2.5776 2.5776 2.7144 2.7144 2.7740 2.7740 2.9233 2.9233 3.1316 3.1316 3.2361 3.2361 3.3754 3.3754 3.4271 3.4271 3.5392 3.5392 3.6156 3.6156 3.6484 3.6484 4.7497 4.7497 5.5809 5.5809 11.0904 11.0904 11.2804 11.2804 12.1032 12.1032 12.5048 12.5048 12.7547 12.7547 13.5584 13.5584 13.9491 13.9491 k = 0.1711 0.1842 0.6823 ( 14614 PWs) bands (ev): -16.9482 -16.9482 -16.8880 -16.8880 -16.3420 -16.3420 -16.3212 -16.3212 -16.2891 -16.2891 -16.2618 -16.2618 -12.7160 -12.7160 -12.7048 -12.7048 -1.6865 -1.6865 -1.5945 -1.5945 -0.8539 -0.8539 -0.5602 -0.5602 -0.4407 -0.4407 -0.2450 -0.2450 -0.2212 -0.2212 -0.1188 -0.1188 -0.0326 -0.0326 0.0540 0.0540 0.5905 0.5905 0.8164 0.8164 1.1095 1.1095 1.1711 1.1711 1.4651 1.4651 1.5894 1.5894 1.6552 1.6552 1.7875 1.7875 2.3811 2.3811 2.4985 2.4985 2.5138 2.5138 2.5881 2.5881 2.7010 2.7010 2.7583 2.7583 2.9327 2.9327 3.1229 3.1229 3.2575 3.2575 3.3731 3.3731 3.4261 3.4261 3.5323 3.5323 3.6146 3.6146 3.6412 3.6412 4.8051 4.8051 5.5317 5.5317 11.1043 11.1043 11.2709 11.2709 12.1452 12.1452 12.5843 12.5843 12.7051 12.7051 13.5741 13.5741 13.9082 13.9082 k = 0.1842 0.1984 0.6823 ( 14616 PWs) bands (ev): -16.9436 -16.9436 -16.8929 -16.8929 -16.3416 -16.3416 -16.3215 -16.3215 -16.2883 -16.2883 -16.2626 -16.2626 -12.7151 -12.7151 -12.7057 -12.7057 -1.6784 -1.6784 -1.6007 -1.6007 -0.8015 -0.8015 -0.5493 -0.5493 -0.4426 -0.4426 -0.2560 -0.2560 -0.2249 -0.2249 -0.1307 -0.1307 -0.0419 -0.0419 -0.0032 -0.0032 0.6142 0.6142 0.8117 0.8117 1.0993 1.0993 1.1448 1.1448 1.4822 1.4822 1.5987 1.5987 1.6415 1.6415 1.7669 1.7669 2.4136 2.4136 2.5194 2.5194 2.5331 2.5331 2.5931 2.5931 2.6869 2.6869 2.7422 2.7422 2.9442 2.9442 3.1112 3.1112 3.2771 3.2771 3.3699 3.3699 3.4276 3.4276 3.5243 3.5243 3.6138 3.6138 3.6352 3.6352 4.8632 4.8632 5.4795 5.4795 11.1187 11.1187 11.2605 11.2605 12.1876 12.1876 12.6552 12.6552 12.6717 12.6717 13.5859 13.5859 13.8258 13.8258 k = 0.1974 0.2126 0.6823 ( 14634 PWs) bands (ev): -16.9388 -16.9388 -16.8978 -16.8978 -16.3412 -16.3412 -16.3217 -16.3217 -16.2875 -16.2875 -16.2634 -16.2634 -12.7142 -12.7142 -12.7066 -12.7066 -1.6701 -1.6701 -1.6073 -1.6073 -0.7469 -0.7469 -0.5390 -0.5390 -0.4451 -0.4451 -0.2739 -0.2739 -0.2273 -0.2273 -0.1497 -0.1497 -0.0514 -0.0514 -0.0435 -0.0435 0.6389 0.6389 0.8033 0.8033 1.0898 1.0898 1.1234 1.1234 1.4994 1.4994 1.6075 1.6075 1.6291 1.6291 1.7472 1.7472 2.4433 2.4433 2.5385 2.5385 2.5548 2.5548 2.5933 2.5933 2.6721 2.6721 2.7255 2.7255 2.9579 2.9579 3.0973 3.0973 3.2938 3.2938 3.3658 3.3658 3.4318 3.4318 3.5152 3.5152 3.6131 3.6131 3.6303 3.6303 4.9236 4.9236 5.4246 5.4246 11.1335 11.1335 11.2491 11.2491 12.2306 12.2306 12.6059 12.6059 12.7655 12.7655 13.5810 13.5810 13.7377 13.7377 k = 0.2105 0.2268 0.6823 ( 14638 PWs) bands (ev): -16.9338 -16.9338 -16.9029 -16.9029 -16.3408 -16.3408 -16.3220 -16.3220 -16.2866 -16.2866 -16.2643 -16.2643 -12.7133 -12.7133 -12.7075 -12.7075 -1.6618 -1.6618 -1.6142 -1.6142 -0.6909 -0.6909 -0.5299 -0.5299 -0.4478 -0.4478 -0.3030 -0.3030 -0.2282 -0.2282 -0.1740 -0.1740 -0.0668 -0.0668 -0.0575 -0.0575 0.6643 0.6643 0.7910 0.7910 1.0819 1.0819 1.1067 1.1067 1.5164 1.5164 1.6063 1.6063 1.6273 1.6273 1.7283 1.7283 2.4703 2.4703 2.5562 2.5562 2.5735 2.5735 2.5938 2.5938 2.6564 2.6564 2.7082 2.7082 2.9736 2.9736 3.0817 3.0817 3.3077 3.3077 3.3610 3.3610 3.4384 3.4384 3.5053 3.5053 3.6126 3.6126 3.6267 3.6267 4.9855 4.9855 5.3673 5.3673 11.1485 11.1485 11.2369 11.2369 12.2743 12.2743 12.5568 12.5568 12.8658 12.8658 13.5241 13.5241 13.6982 13.6982 k = 0.2237 0.2409 0.6823 ( 14616 PWs) bands (ev): -16.9288 -16.9288 -16.9081 -16.9081 -16.3404 -16.3404 -16.3223 -16.3223 -16.2858 -16.2858 -16.2651 -16.2651 -12.7124 -12.7124 -12.7084 -12.7084 -1.6535 -1.6535 -1.6215 -1.6215 -0.6353 -0.6353 -0.5243 -0.5243 -0.4487 -0.4487 -0.3439 -0.3439 -0.2273 -0.2273 -0.1946 -0.1946 -0.0751 -0.0751 -0.0643 -0.0643 0.6899 0.6899 0.7746 0.7746 1.0769 1.0769 1.0941 1.0941 1.5330 1.5330 1.5934 1.5934 1.6382 1.6382 1.7105 1.7105 2.4947 2.4947 2.5652 2.5652 2.5806 2.5806 2.6098 2.6098 2.6401 2.6401 2.6898 2.6898 2.9909 2.9909 3.0648 3.0648 3.3190 3.3190 3.3554 3.3554 3.4471 3.4471 3.4948 3.4948 3.6121 3.6121 3.6244 3.6244 5.0484 5.0484 5.3079 5.3079 11.1636 11.1636 11.2240 11.2240 12.3187 12.3187 12.5083 12.5083 12.9714 12.9714 13.4230 13.4230 13.7027 13.7027 k = 0.2368 0.2551 0.6823 ( 14608 PWs) bands (ev): -16.9236 -16.9236 -16.9134 -16.9134 -16.3401 -16.3401 -16.3226 -16.3226 -16.2849 -16.2849 -16.2660 -16.2660 -12.7114 -12.7114 -12.7094 -12.7094 -1.6453 -1.6453 -1.6291 -1.6291 -0.5840 -0.5840 -0.5268 -0.5268 -0.4437 -0.4437 -0.3890 -0.3890 -0.2243 -0.2243 -0.2084 -0.2084 -0.0779 -0.0779 -0.0688 -0.0688 0.7153 0.7153 0.7548 0.7548 1.0754 1.0754 1.0848 1.0848 1.5491 1.5491 1.5785 1.5785 1.6521 1.6521 1.6936 1.6936 2.5165 2.5165 2.5549 2.5549 2.5965 2.5965 2.6189 2.6189 2.6364 2.6364 2.6700 2.6700 3.0091 3.0091 3.0467 3.0467 3.3281 3.3281 3.3492 3.3492 3.4571 3.4571 3.4841 3.4841 3.6118 3.6118 3.6231 3.6231 5.1117 5.1117 5.2469 5.2469 11.1785 11.1785 11.2103 11.2103 12.3640 12.3640 12.4605 12.4605 13.0816 13.0816 13.3098 13.3098 13.7211 13.7211 k = 0.2500 0.2693 0.6823 ( 14620 PWs) bands (ev): -16.9186 -16.9186 -16.9184 -16.9184 -16.3398 -16.3398 -16.3229 -16.3229 -16.2840 -16.2840 -16.2669 -16.2669 -12.7105 -12.7105 -12.7104 -12.7104 -1.6372 -1.6372 -1.6369 -1.6369 -0.5474 -0.5474 -0.5426 -0.5426 -0.4259 -0.4259 -0.4251 -0.4251 -0.2194 -0.2194 -0.2166 -0.2166 -0.0794 -0.0794 -0.0694 -0.0694 0.7320 0.7320 0.7399 0.7399 1.0767 1.0767 1.0796 1.0796 1.5592 1.5592 1.5684 1.5684 1.6673 1.6673 1.6781 1.6781 2.5354 2.5354 2.5387 2.5387 2.6022 2.6022 2.6140 2.6140 2.6489 2.6489 2.6579 2.6579 3.0276 3.0276 3.0281 3.0281 3.3356 3.3356 3.3422 3.3422 3.4668 3.4668 3.4747 3.4747 3.6114 3.6114 3.6230 3.6230 5.1740 5.1740 5.1854 5.1854 11.1927 11.1927 11.1967 11.1967 12.4102 12.4102 12.4134 12.4134 13.1948 13.1948 13.1950 13.1950 13.7434 13.7434 Writing output data file CsAgF3.save init_run : 0.56s CPU 0.76s WALL ( 1 calls) electrons : 729.18s CPU 735.91s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 729.17s CPU 735.89s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.22s CPU 0.26s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.30s CPU 0.40s WALL ( 275 calls) cegterg : 675.36s CPU 680.27s WALL ( 454 calls) Called by sum_band: Called by *egterg: h_psi : 398.02s CPU 401.01s WALL ( 7487 calls) s_psi : 24.62s CPU 24.46s WALL ( 7487 calls) g_psi : 1.40s CPU 1.31s WALL ( 6758 calls) cdiaghg : 170.26s CPU 172.40s WALL ( 7033 calls) cegterg:over : 46.14s CPU 46.20s WALL ( 6758 calls) cegterg:upda : 41.90s CPU 41.99s WALL ( 6758 calls) cegterg:last : 19.75s CPU 19.73s WALL ( 1004 calls) cdiaghg:chol : 10.49s CPU 10.59s WALL ( 7033 calls) cdiaghg:inve : 7.75s CPU 7.90s WALL ( 7033 calls) cdiaghg:para : 14.27s CPU 14.24s WALL ( 14066 calls) Called by h_psi: h_psi:vloc : 327.06s CPU 329.40s WALL ( 7487 calls) h_psi:vnl : 69.06s CPU 69.58s WALL ( 7487 calls) add_vuspsi : 37.36s CPU 37.61s WALL ( 7487 calls) General routines calbec : 31.66s CPU 31.94s WALL ( 7487 calls) fft : 0.00s CPU 0.01s WALL ( 15 calls) fftw : 308.52s CPU 311.34s WALL ( 1283692 calls) davcio : 0.24s CPU 1.02s WALL ( 550 calls) Parallel routines fft_scatter : 97.72s CPU 99.00s WALL ( 1283707 calls) PWSCF : 13m 7.43s CPU 13m37.53s WALL This run was terminated on: 18:40:12 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=