Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:34:28 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: ./Tl2Ni3S2.save/ file Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 49 38 10 1370 908 137 Max 50 39 11 1374 922 141 Sum 1789 1369 391 49393 32941 5023 bravais-lattice index = 14 lattice parameter (alat) = 10.5711 a.u. unit-cell volume = 807.2276 (a.u.)^3 number of atoms/cell = 7 number of atomic types = 3 number of electrons = 68.00 number of Kohn-Sham states= 82 kinetic-energy cutoff = 45.0000 Ry charge density cutoff = 236.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.571127 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.522052 celldm(5)= 0.522052 celldm(6)= 0.522052 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.522052 0.852914 0.000000 ) a(3) = ( 0.522052 0.292543 0.801174 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.612081 -0.428112 ) b(2) = ( 0.000000 1.172452 -0.428112 ) b(3) = ( 0.000000 0.000000 1.248168 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Tl read from file: /users/gautes/Pseudo/Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd969aa200d2b9b89aab382fbbb9d684 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential S 6.00 32.06500 S( 1.00) Tl 13.00 204.38330 Tl( 1.00) Ni 10.00 58.69340 Ni( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 261 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 2) = ( 0.0138889 -0.0085011 -0.0059460), wk = 0.0038314 k( 3) = ( 0.0277778 -0.0170022 -0.0118920), wk = 0.0038314 k( 4) = ( 0.0416667 -0.0255034 -0.0178380), wk = 0.0038314 k( 5) = ( 0.0555556 -0.0340045 -0.0237840), wk = 0.0038314 k( 6) = ( 0.0694444 -0.0425056 -0.0297300), wk = 0.0038314 k( 7) = ( 0.0833333 -0.0510067 -0.0356760), wk = 0.0038314 k( 8) = ( 0.0972222 -0.0595079 -0.0416220), wk = 0.0038314 k( 9) = ( 0.1111111 -0.0680090 -0.0475680), wk = 0.0038314 k( 10) = ( 0.1250000 -0.0765101 -0.0535140), wk = 0.0038314 k( 11) = ( 0.1388889 -0.0850112 -0.0594600), wk = 0.0038314 k( 12) = ( 0.1527778 -0.0935123 -0.0654060), wk = 0.0038314 k( 13) = ( 0.1666667 -0.1020135 -0.0713520), wk = 0.0038314 k( 14) = ( 0.1805556 -0.1105146 -0.0772980), wk = 0.0038314 k( 15) = ( 0.1944444 -0.1190157 -0.0832440), wk = 0.0038314 k( 16) = ( 0.2083333 -0.1275168 -0.0891900), wk = 0.0038314 k( 17) = ( 0.2222222 -0.1360180 -0.0951360), wk = 0.0038314 k( 18) = ( 0.2361111 -0.1445191 -0.1010820), wk = 0.0038314 k( 19) = ( 0.2500000 -0.1530202 -0.1070280), wk = 0.0038314 k( 20) = ( 0.2638889 -0.1615213 -0.1129740), wk = 0.0038314 k( 21) = ( 0.2777778 -0.1700224 -0.1189200), wk = 0.0038314 k( 22) = ( 0.2916667 -0.1785236 -0.1248660), wk = 0.0038314 k( 23) = ( 0.3055556 -0.1870247 -0.1308120), wk = 0.0038314 k( 24) = ( 0.3194444 -0.1955258 -0.1367580), wk = 0.0038314 k( 25) = ( 0.3333333 -0.2040269 -0.1427039), wk = 0.0038314 k( 26) = ( 0.3472222 -0.2125281 -0.1486499), wk = 0.0038314 k( 27) = ( 0.3611111 -0.2210292 -0.1545959), wk = 0.0038314 k( 28) = ( 0.3750000 -0.2295303 -0.1605419), wk = 0.0038314 k( 29) = ( 0.3888889 -0.2380314 -0.1664879), wk = 0.0038314 k( 30) = ( 0.4027778 -0.2465325 -0.1724339), wk = 0.0038314 k( 31) = ( 0.4166667 -0.2550337 -0.1783799), wk = 0.0038314 k( 32) = ( 0.4305556 -0.2635348 -0.1843259), wk = 0.0038314 k( 33) = ( 0.4444444 -0.2720359 -0.1902719), wk = 0.0038314 k( 34) = ( 0.4583333 -0.2805370 -0.1962179), wk = 0.0038314 k( 35) = ( 0.4722222 -0.2890382 -0.2021639), wk = 0.0038314 k( 36) = ( 0.4861111 -0.2975393 -0.2081099), wk = 0.0038314 k( 37) = ( 0.5000000 -0.3060404 -0.2140559), wk = 0.0038314 k( 38) = ( 0.5000000 -0.3060404 -0.2140559), wk = 0.0038314 k( 39) = ( 0.5000000 -0.2961511 -0.2281948), wk = 0.0038314 k( 40) = ( 0.5000000 -0.2862619 -0.2423337), wk = 0.0038314 k( 41) = ( 0.5000000 -0.2763726 -0.2564726), wk = 0.0038314 k( 42) = ( 0.5000000 -0.2664833 -0.2706115), wk = 0.0038314 k( 43) = ( 0.5000000 -0.2565941 -0.2847504), wk = 0.0038314 k( 44) = ( 0.5000000 -0.2467048 -0.2988893), wk = 0.0038314 k( 45) = ( 0.5000000 -0.2368156 -0.3130282), wk = 0.0038314 k( 46) = ( 0.5000000 -0.2269263 -0.3271671), wk = 0.0038314 k( 47) = ( 0.5000000 -0.2170370 -0.3413060), wk = 0.0038314 k( 48) = ( 0.5000000 -0.2071478 -0.3554449), wk = 0.0038314 k( 49) = ( 0.5000000 -0.1972585 -0.3695838), wk = 0.0038314 k( 50) = ( 0.5000000 -0.1873692 -0.3837227), wk = 0.0038314 k( 51) = ( 0.5000000 -0.1774800 -0.3978616), wk = 0.0038314 k( 52) = ( 0.5000000 -0.1675907 -0.4120004), wk = 0.0038314 k( 53) = ( 0.5000000 -0.1577015 -0.4261393), wk = 0.0038314 k( 54) = ( 0.5000000 -0.1478122 -0.4402782), wk = 0.0038314 k( 55) = ( 0.5000000 -0.1379229 -0.4544171), wk = 0.0038314 k( 56) = ( 0.5000000 -0.1280337 -0.4685560), wk = 0.0038314 k( 57) = ( 0.5000000 -0.1181444 -0.4826949), wk = 0.0038314 k( 58) = ( 0.5000000 -0.1082551 -0.4968338), wk = 0.0038314 k( 59) = ( 0.5000000 -0.0983659 -0.5109727), wk = 0.0038314 k( 60) = ( 0.5000000 -0.0884766 -0.5251116), wk = 0.0038314 k( 61) = ( 0.5000000 -0.0785873 -0.5392505), wk = 0.0038314 k( 62) = ( 0.5000000 -0.0686981 -0.5533894), wk = 0.0038314 k( 63) = ( 0.5000000 -0.0588088 -0.5675283), wk = 0.0038314 k( 64) = ( 0.5000000 -0.0489196 -0.5816672), wk = 0.0038314 k( 65) = ( 0.5000000 -0.0390303 -0.5958061), wk = 0.0038314 k( 66) = ( 0.5000000 -0.0291410 -0.6099450), wk = 0.0038314 k( 67) = ( 0.5000000 -0.0192518 -0.6240839), wk = 0.0038314 k( 68) = ( 0.7553941 0.1238636 -0.2321398), wk = 0.0038314 k( 69) = ( 0.7468809 0.1290744 -0.2178694), wk = 0.0038314 k( 70) = ( 0.7383678 0.1342851 -0.2035990), wk = 0.0038314 k( 71) = ( 0.7298547 0.1394958 -0.1893287), wk = 0.0038314 k( 72) = ( 0.7213415 0.1447065 -0.1750583), wk = 0.0038314 k( 73) = ( 0.7128284 0.1499173 -0.1607879), wk = 0.0038314 k( 74) = ( 0.7043152 0.1551280 -0.1465175), wk = 0.0038314 k( 75) = ( 0.6958021 0.1603387 -0.1322471), wk = 0.0038314 k( 76) = ( 0.6872890 0.1655494 -0.1179767), wk = 0.0038314 k( 77) = ( 0.6787758 0.1707602 -0.1037063), wk = 0.0038314 k( 78) = ( 0.6702627 0.1759709 -0.0894359), wk = 0.0038314 k( 79) = ( 0.6617496 0.1811816 -0.0751655), wk = 0.0038314 k( 80) = ( 0.6532364 0.1863924 -0.0608951), wk = 0.0038314 k( 81) = ( 0.6447233 0.1916031 -0.0466247), wk = 0.0038314 k( 82) = ( 0.6362102 0.1968138 -0.0323543), wk = 0.0038314 k( 83) = ( 0.6276970 0.2020245 -0.0180839), wk = 0.0038314 k( 84) = ( 0.6191839 0.2072353 -0.0038135), wk = 0.0038314 k( 85) = ( 0.6106708 0.2124460 0.0104569), wk = 0.0038314 k( 86) = ( 0.6021576 0.2176567 0.0247273), wk = 0.0038314 k( 87) = ( 0.5936445 0.2228674 0.0389977), wk = 0.0038314 k( 88) = ( 0.5851314 0.2280782 0.0532681), wk = 0.0038314 k( 89) = ( 0.5766182 0.2332889 0.0675385), wk = 0.0038314 k( 90) = ( 0.5681051 0.2384996 0.0818089), wk = 0.0038314 k( 91) = ( 0.5595919 0.2437103 0.0960792), wk = 0.0038314 k( 92) = ( 0.5510788 0.2489211 0.1103496), wk = 0.0038314 k( 93) = ( 0.5425657 0.2541318 0.1246200), wk = 0.0038314 k( 94) = ( 0.5340525 0.2593425 0.1388904), wk = 0.0038314 k( 95) = ( 0.5255394 0.2645533 0.1531608), wk = 0.0038314 k( 96) = ( 0.5170263 0.2697640 0.1674312), wk = 0.0038314 k( 97) = ( 0.5085131 0.2749747 0.1817016), wk = 0.0038314 k( 98) = ( 0.5000000 0.2801854 0.1959720), wk = 0.0038314 k( 99) = ( 0.5000000 0.2801854 0.1959720), wk = 0.0038314 k( 100) = ( 0.4857143 0.2721801 0.1903728), wk = 0.0038314 k( 101) = ( 0.4714286 0.2641748 0.1847736), wk = 0.0038314 k( 102) = ( 0.4571429 0.2561695 0.1791744), wk = 0.0038314 k( 103) = ( 0.4428571 0.2481642 0.1735752), wk = 0.0038314 k( 104) = ( 0.4285714 0.2401589 0.1679760), wk = 0.0038314 k( 105) = ( 0.4142857 0.2321536 0.1623768), wk = 0.0038314 k( 106) = ( 0.4000000 0.2241483 0.1567776), wk = 0.0038314 k( 107) = ( 0.3857143 0.2161431 0.1511784), wk = 0.0038314 k( 108) = ( 0.3714286 0.2081377 0.1455792), wk = 0.0038314 k( 109) = ( 0.3571429 0.2001325 0.1399800), wk = 0.0038314 k( 110) = ( 0.3428571 0.1921272 0.1343808), wk = 0.0038314 k( 111) = ( 0.3285714 0.1841219 0.1287816), wk = 0.0038314 k( 112) = ( 0.3142857 0.1761166 0.1231824), wk = 0.0038314 k( 113) = ( 0.3000000 0.1681113 0.1175832), wk = 0.0038314 k( 114) = ( 0.2857143 0.1601060 0.1119840), wk = 0.0038314 k( 115) = ( 0.2714286 0.1521007 0.1063848), wk = 0.0038314 k( 116) = ( 0.2571429 0.1440954 0.1007856), wk = 0.0038314 k( 117) = ( 0.2428571 0.1360901 0.0951864), wk = 0.0038314 k( 118) = ( 0.2285714 0.1280848 0.0895872), wk = 0.0038314 k( 119) = ( 0.2142857 0.1200795 0.0839880), wk = 0.0038314 k( 120) = ( 0.2000000 0.1120742 0.0783888), wk = 0.0038314 k( 121) = ( 0.1857143 0.1040689 0.0727896), wk = 0.0038314 k( 122) = ( 0.1714286 0.0960636 0.0671904), wk = 0.0038314 k( 123) = ( 0.1571429 0.0880583 0.0615912), wk = 0.0038314 k( 124) = ( 0.1428571 0.0800530 0.0559920), wk = 0.0038314 k( 125) = ( 0.1285714 0.0720477 0.0503928), wk = 0.0038314 k( 126) = ( 0.1142857 0.0640424 0.0447936), wk = 0.0038314 k( 127) = ( 0.1000000 0.0560371 0.0391944), wk = 0.0038314 k( 128) = ( 0.0857143 0.0480318 0.0335952), wk = 0.0038314 k( 129) = ( 0.0714286 0.0400265 0.0279960), wk = 0.0038314 k( 130) = ( 0.0571429 0.0320212 0.0223968), wk = 0.0038314 k( 131) = ( 0.0428571 0.0240159 0.0167976), wk = 0.0038314 k( 132) = ( 0.0285714 0.0160106 0.0111984), wk = 0.0038314 k( 133) = ( 0.0142857 0.0080053 0.0055992), wk = 0.0038314 k( 134) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 135) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 136) = ( 0.0086582 -0.0052995 -0.0145136), wk = 0.0038314 k( 137) = ( 0.0173164 -0.0105990 -0.0290272), wk = 0.0038314 k( 138) = ( 0.0259746 -0.0158986 -0.0435407), wk = 0.0038314 k( 139) = ( 0.0346328 -0.0211981 -0.0580543), wk = 0.0038314 k( 140) = ( 0.0432910 -0.0264976 -0.0725679), wk = 0.0038314 k( 141) = ( 0.0519493 -0.0317971 -0.0870815), wk = 0.0038314 k( 142) = ( 0.0606075 -0.0370967 -0.1015950), wk = 0.0038314 k( 143) = ( 0.0692657 -0.0423962 -0.1161086), wk = 0.0038314 k( 144) = ( 0.0779239 -0.0476957 -0.1306222), wk = 0.0038314 k( 145) = ( 0.0865821 -0.0529952 -0.1451358), wk = 0.0038314 k( 146) = ( 0.0952403 -0.0582948 -0.1596494), wk = 0.0038314 k( 147) = ( 0.1038985 -0.0635943 -0.1741629), wk = 0.0038314 k( 148) = ( 0.1125567 -0.0688938 -0.1886765), wk = 0.0038314 k( 149) = ( 0.1212149 -0.0741933 -0.2031901), wk = 0.0038314 k( 150) = ( 0.1298731 -0.0794928 -0.2177037), wk = 0.0038314 k( 151) = ( 0.1385313 -0.0847924 -0.2322173), wk = 0.0038314 k( 152) = ( 0.1471896 -0.0900919 -0.2467308), wk = 0.0038314 k( 153) = ( 0.1558478 -0.0953914 -0.2612444), wk = 0.0038314 k( 154) = ( 0.1645060 -0.1006909 -0.2757580), wk = 0.0038314 k( 155) = ( 0.1731642 -0.1059905 -0.2902716), wk = 0.0038314 k( 156) = ( 0.1818224 -0.1112900 -0.3047851), wk = 0.0038314 k( 157) = ( 0.1904806 -0.1165895 -0.3192987), wk = 0.0038314 k( 158) = ( 0.1991388 -0.1218890 -0.3338123), wk = 0.0038314 k( 159) = ( 0.2077970 -0.1271886 -0.3483259), wk = 0.0038314 k( 160) = ( 0.2164552 -0.1324881 -0.3628394), wk = 0.0038314 k( 161) = ( 0.2251134 -0.1377876 -0.3773530), wk = 0.0038314 k( 162) = ( 0.2337716 -0.1430871 -0.3918666), wk = 0.0038314 k( 163) = ( 0.2424298 -0.1483866 -0.4063802), wk = 0.0038314 k( 164) = ( 0.2510881 -0.1536862 -0.4208938), wk = 0.0038314 k( 165) = ( 0.2597463 -0.1589857 -0.4354073), wk = 0.0038314 k( 166) = ( 0.2684045 -0.1642852 -0.4499209), wk = 0.0038314 k( 167) = ( 0.2770627 -0.1695847 -0.4644345), wk = 0.0038314 k( 168) = ( 0.2857209 -0.1748843 -0.4789481), wk = 0.0038314 k( 169) = ( 0.2943791 -0.1801838 -0.4934617), wk = 0.0038314 k( 170) = ( 0.3030373 -0.1854833 -0.5079752), wk = 0.0038314 k( 171) = ( 0.3116955 -0.1907828 -0.5224888), wk = 0.0038314 k( 172) = ( 0.3203537 -0.1960824 -0.5370024), wk = 0.0038314 k( 173) = ( 0.3290119 -0.2013819 -0.5515160), wk = 0.0038314 k( 174) = ( 0.3376701 -0.2066814 -0.5660295), wk = 0.0038314 k( 175) = ( 0.3463283 -0.2119809 -0.5805431), wk = 0.0038314 k( 176) = ( 0.3549866 -0.2172805 -0.5950567), wk = 0.0038314 k( 177) = ( 0.3636448 -0.2225800 -0.6095703), wk = 0.0038314 k( 178) = ( 0.3723030 -0.2278795 -0.6240839), wk = 0.0038314 k( 179) = ( 0.6276970 0.0523059 -0.4281118), wk = 0.0038314 k( 180) = ( 0.6191839 0.0674979 -0.4281118), wk = 0.0038314 k( 181) = ( 0.6106708 0.0826899 -0.4281118), wk = 0.0038314 k( 182) = ( 0.6021576 0.0978818 -0.4281118), wk = 0.0038314 k( 183) = ( 0.5936445 0.1130738 -0.4281118), wk = 0.0038314 k( 184) = ( 0.5851314 0.1282658 -0.4281118), wk = 0.0038314 k( 185) = ( 0.5766182 0.1434577 -0.4281118), wk = 0.0038314 k( 186) = ( 0.5681051 0.1586497 -0.4281118), wk = 0.0038314 k( 187) = ( 0.5595919 0.1738417 -0.4281118), wk = 0.0038314 k( 188) = ( 0.5510788 0.1890336 -0.4281118), wk = 0.0038314 k( 189) = ( 0.5425657 0.2042256 -0.4281118), wk = 0.0038314 k( 190) = ( 0.5340525 0.2194176 -0.4281118), wk = 0.0038314 k( 191) = ( 0.5255394 0.2346095 -0.4281118), wk = 0.0038314 k( 192) = ( 0.5170263 0.2498015 -0.4281118), wk = 0.0038314 k( 193) = ( 0.5085131 0.2649935 -0.4281118), wk = 0.0038314 k( 194) = ( 0.5000000 0.2801854 -0.4281118), wk = 0.0038314 k( 195) = ( 0.5000000 0.2801854 -0.4281118), wk = 0.0038314 k( 196) = ( 0.5091212 0.2852967 -0.4141139), wk = 0.0038314 k( 197) = ( 0.5182424 0.2904080 -0.4001158), wk = 0.0038314 k( 198) = ( 0.5273636 0.2955192 -0.3861178), wk = 0.0038314 k( 199) = ( 0.5364849 0.3006305 -0.3721199), wk = 0.0038314 k( 200) = ( 0.5456061 0.3057418 -0.3581218), wk = 0.0038314 k( 201) = ( 0.5547273 0.3108530 -0.3441238), wk = 0.0038314 k( 202) = ( 0.5638485 0.3159643 -0.3301258), wk = 0.0038314 k( 203) = ( 0.5729697 0.3210755 -0.3161278), wk = 0.0038314 k( 204) = ( 0.5820909 0.3261868 -0.3021298), wk = 0.0038314 k( 205) = ( 0.5912122 0.3312981 -0.2881318), wk = 0.0038314 k( 206) = ( 0.6003334 0.3364093 -0.2741338), wk = 0.0038314 k( 207) = ( 0.6094546 0.3415206 -0.2601358), wk = 0.0038314 k( 208) = ( 0.6185758 0.3466319 -0.2461378), wk = 0.0038314 k( 209) = ( 0.6276970 0.3517431 -0.2321398), wk = 0.0038314 k( 210) = ( 0.6276970 0.3517431 -0.2321398), wk = 0.0038314 k( 211) = ( 0.6227856 0.3489909 -0.2156740), wk = 0.0038314 k( 212) = ( 0.6178742 0.3462387 -0.1992082), wk = 0.0038314 k( 213) = ( 0.6129628 0.3434865 -0.1827423), wk = 0.0038314 k( 214) = ( 0.6080513 0.3407343 -0.1662765), wk = 0.0038314 k( 215) = ( 0.6031399 0.3379820 -0.1498106), wk = 0.0038314 k( 216) = ( 0.5982285 0.3352298 -0.1333448), wk = 0.0038314 k( 217) = ( 0.5933171 0.3324776 -0.1168790), wk = 0.0038314 k( 218) = ( 0.5884056 0.3297254 -0.1004131), wk = 0.0038314 k( 219) = ( 0.5834942 0.3269732 -0.0839473), wk = 0.0038314 k( 220) = ( 0.5785828 0.3242209 -0.0674814), wk = 0.0038314 k( 221) = ( 0.5736714 0.3214687 -0.0510156), wk = 0.0038314 k( 222) = ( 0.5687599 0.3187165 -0.0345498), wk = 0.0038314 k( 223) = ( 0.5638485 0.3159643 -0.0180839), wk = 0.0038314 k( 224) = ( 0.5589371 0.3132121 -0.0016181), wk = 0.0038314 k( 225) = ( 0.5540257 0.3104598 0.0148478), wk = 0.0038314 k( 226) = ( 0.5491142 0.3077076 0.0313136), wk = 0.0038314 k( 227) = ( 0.5442028 0.3049554 0.0477794), wk = 0.0038314 k( 228) = ( 0.5392914 0.3022032 0.0642453), wk = 0.0038314 k( 229) = ( 0.5343800 0.2994510 0.0807111), wk = 0.0038314 k( 230) = ( 0.5294686 0.2966988 0.0971770), wk = 0.0038314 k( 231) = ( 0.5245571 0.2939465 0.1136428), wk = 0.0038314 k( 232) = ( 0.5196457 0.2911943 0.1301087), wk = 0.0038314 k( 233) = ( 0.5147343 0.2884421 0.1465745), wk = 0.0038314 k( 234) = ( 0.5098229 0.2856899 0.1630403), wk = 0.0038314 k( 235) = ( 0.5049114 0.2829376 0.1795062), wk = 0.0038314 k( 236) = ( 0.5000000 0.2801854 0.1959720), wk = 0.0038314 k( 237) = ( 0.5000000 -0.3060404 -0.2140559), wk = 0.0038314 k( 238) = ( 0.5106414 -0.2943660 -0.2058904), wk = 0.0038314 k( 239) = ( 0.5212828 -0.2826916 -0.1977249), wk = 0.0038314 k( 240) = ( 0.5319243 -0.2710172 -0.1895594), wk = 0.0038314 k( 241) = ( 0.5425657 -0.2593428 -0.1813939), wk = 0.0038314 k( 242) = ( 0.5532071 -0.2476684 -0.1732284), wk = 0.0038314 k( 243) = ( 0.5638485 -0.2359940 -0.1650629), wk = 0.0038314 k( 244) = ( 0.5744899 -0.2243196 -0.1568974), wk = 0.0038314 k( 245) = ( 0.5851314 -0.2126453 -0.1487319), wk = 0.0038314 k( 246) = ( 0.5957728 -0.2009709 -0.1405664), wk = 0.0038314 k( 247) = ( 0.6064142 -0.1892965 -0.1324009), wk = 0.0038314 k( 248) = ( 0.6170556 -0.1776221 -0.1242354), wk = 0.0038314 k( 249) = ( 0.6276970 -0.1659477 -0.1160699), wk = 0.0038314 k( 250) = ( 0.6383385 -0.1542733 -0.1079044), wk = 0.0038314 k( 251) = ( 0.6489799 -0.1425989 -0.0997389), wk = 0.0038314 k( 252) = ( 0.6596213 -0.1309245 -0.0915734), wk = 0.0038314 k( 253) = ( 0.6702627 -0.1192501 -0.0834079), wk = 0.0038314 k( 254) = ( 0.6809041 -0.1075757 -0.0752424), wk = 0.0038314 k( 255) = ( 0.6915455 -0.0959013 -0.0670769), wk = 0.0038314 k( 256) = ( 0.7021870 -0.0842269 -0.0589114), wk = 0.0038314 k( 257) = ( 0.7128284 -0.0725525 -0.0507459), wk = 0.0038314 k( 258) = ( 0.7234698 -0.0608781 -0.0425804), wk = 0.0038314 k( 259) = ( 0.7341112 -0.0492037 -0.0344149), wk = 0.0038314 k( 260) = ( 0.7447526 -0.0375294 -0.0262494), wk = 0.0038314 k( 261) = ( 0.7553941 -0.0258550 -0.0180839), wk = 0.0038314 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 2) = ( 0.0138889 0.0000000 0.0000000), wk = 0.0038314 k( 3) = ( 0.0277778 0.0000000 0.0000000), wk = 0.0038314 k( 4) = ( 0.0416667 0.0000000 0.0000000), wk = 0.0038314 k( 5) = ( 0.0555556 0.0000000 0.0000000), wk = 0.0038314 k( 6) = ( 0.0694444 0.0000000 0.0000000), wk = 0.0038314 k( 7) = ( 0.0833333 0.0000000 0.0000000), wk = 0.0038314 k( 8) = ( 0.0972222 0.0000000 0.0000000), wk = 0.0038314 k( 9) = ( 0.1111111 0.0000000 0.0000000), wk = 0.0038314 k( 10) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0038314 k( 11) = ( 0.1388889 0.0000000 0.0000000), wk = 0.0038314 k( 12) = ( 0.1527778 0.0000000 0.0000000), wk = 0.0038314 k( 13) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0038314 k( 14) = ( 0.1805556 0.0000000 0.0000000), wk = 0.0038314 k( 15) = ( 0.1944444 0.0000000 0.0000000), wk = 0.0038314 k( 16) = ( 0.2083333 0.0000000 0.0000000), wk = 0.0038314 k( 17) = ( 0.2222222 0.0000000 0.0000000), wk = 0.0038314 k( 18) = ( 0.2361111 0.0000000 0.0000000), wk = 0.0038314 k( 19) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0038314 k( 20) = ( 0.2638889 0.0000000 0.0000000), wk = 0.0038314 k( 21) = ( 0.2777778 0.0000000 0.0000000), wk = 0.0038314 k( 22) = ( 0.2916667 0.0000000 0.0000000), wk = 0.0038314 k( 23) = ( 0.3055556 0.0000000 0.0000000), wk = 0.0038314 k( 24) = ( 0.3194444 0.0000000 0.0000000), wk = 0.0038314 k( 25) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0038314 k( 26) = ( 0.3472222 0.0000000 0.0000000), wk = 0.0038314 k( 27) = ( 0.3611111 0.0000000 0.0000000), wk = 0.0038314 k( 28) = ( 0.3750000 0.0000000 0.0000000), wk = 0.0038314 k( 29) = ( 0.3888889 0.0000000 0.0000000), wk = 0.0038314 k( 30) = ( 0.4027778 0.0000000 0.0000000), wk = 0.0038314 k( 31) = ( 0.4166667 0.0000000 0.0000000), wk = 0.0038314 k( 32) = ( 0.4305556 0.0000000 0.0000000), wk = 0.0038314 k( 33) = ( 0.4444444 0.0000000 0.0000000), wk = 0.0038314 k( 34) = ( 0.4583333 0.0000000 0.0000000), wk = 0.0038314 k( 35) = ( 0.4722222 0.0000000 0.0000000), wk = 0.0038314 k( 36) = ( 0.4861111 0.0000000 0.0000000), wk = 0.0038314 k( 37) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0038314 k( 38) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0038314 k( 39) = ( 0.5000000 0.0084347 -0.0084347), wk = 0.0038314 k( 40) = ( 0.5000000 0.0168694 -0.0168694), wk = 0.0038314 k( 41) = ( 0.5000000 0.0253041 -0.0253041), wk = 0.0038314 k( 42) = ( 0.5000000 0.0337388 -0.0337387), wk = 0.0038314 k( 43) = ( 0.5000000 0.0421734 -0.0421734), wk = 0.0038314 k( 44) = ( 0.5000000 0.0506081 -0.0506081), wk = 0.0038314 k( 45) = ( 0.5000000 0.0590428 -0.0590428), wk = 0.0038314 k( 46) = ( 0.5000000 0.0674775 -0.0674775), wk = 0.0038314 k( 47) = ( 0.5000000 0.0759122 -0.0759122), wk = 0.0038314 k( 48) = ( 0.5000000 0.0843469 -0.0843469), wk = 0.0038314 k( 49) = ( 0.5000000 0.0927816 -0.0927816), wk = 0.0038314 k( 50) = ( 0.5000000 0.1012163 -0.1012162), wk = 0.0038314 k( 51) = ( 0.5000000 0.1096509 -0.1096509), wk = 0.0038314 k( 52) = ( 0.5000000 0.1180856 -0.1180856), wk = 0.0038314 k( 53) = ( 0.5000000 0.1265203 -0.1265203), wk = 0.0038314 k( 54) = ( 0.5000000 0.1349550 -0.1349550), wk = 0.0038314 k( 55) = ( 0.5000000 0.1433897 -0.1433897), wk = 0.0038314 k( 56) = ( 0.5000000 0.1518244 -0.1518244), wk = 0.0038314 k( 57) = ( 0.5000000 0.1602591 -0.1602591), wk = 0.0038314 k( 58) = ( 0.5000000 0.1686938 -0.1686937), wk = 0.0038314 k( 59) = ( 0.5000000 0.1771284 -0.1771284), wk = 0.0038314 k( 60) = ( 0.5000000 0.1855631 -0.1855631), wk = 0.0038314 k( 61) = ( 0.5000000 0.1939978 -0.1939978), wk = 0.0038314 k( 62) = ( 0.5000000 0.2024325 -0.2024325), wk = 0.0038314 k( 63) = ( 0.5000000 0.2108672 -0.2108672), wk = 0.0038314 k( 64) = ( 0.5000000 0.2193019 -0.2193019), wk = 0.0038314 k( 65) = ( 0.5000000 0.2277366 -0.2277366), wk = 0.0038314 k( 66) = ( 0.5000000 0.2361713 -0.2361712), wk = 0.0038314 k( 67) = ( 0.5000000 0.2446059 -0.2446059), wk = 0.0038314 k( 68) = ( 0.7553941 0.5000000 0.2446059), wk = 0.0038314 k( 69) = ( 0.7468809 0.5000000 0.2531191), wk = 0.0038314 k( 70) = ( 0.7383678 0.5000000 0.2616322), wk = 0.0038314 k( 71) = ( 0.7298547 0.5000000 0.2701453), wk = 0.0038314 k( 72) = ( 0.7213415 0.5000000 0.2786585), wk = 0.0038314 k( 73) = ( 0.7128284 0.5000000 0.2871716), wk = 0.0038314 k( 74) = ( 0.7043152 0.5000000 0.2956848), wk = 0.0038314 k( 75) = ( 0.6958021 0.5000000 0.3041979), wk = 0.0038314 k( 76) = ( 0.6872890 0.5000000 0.3127110), wk = 0.0038314 k( 77) = ( 0.6787758 0.5000000 0.3212242), wk = 0.0038314 k( 78) = ( 0.6702627 0.5000000 0.3297373), wk = 0.0038314 k( 79) = ( 0.6617496 0.5000000 0.3382504), wk = 0.0038314 k( 80) = ( 0.6532364 0.5000000 0.3467636), wk = 0.0038314 k( 81) = ( 0.6447233 0.5000000 0.3552767), wk = 0.0038314 k( 82) = ( 0.6362102 0.5000000 0.3637898), wk = 0.0038314 k( 83) = ( 0.6276970 0.5000000 0.3723030), wk = 0.0038314 k( 84) = ( 0.6191839 0.5000000 0.3808161), wk = 0.0038314 k( 85) = ( 0.6106708 0.5000000 0.3893292), wk = 0.0038314 k( 86) = ( 0.6021576 0.5000000 0.3978424), wk = 0.0038314 k( 87) = ( 0.5936445 0.5000000 0.4063555), wk = 0.0038314 k( 88) = ( 0.5851314 0.5000000 0.4148687), wk = 0.0038314 k( 89) = ( 0.5766182 0.5000000 0.4233818), wk = 0.0038314 k( 90) = ( 0.5681051 0.5000000 0.4318949), wk = 0.0038314 k( 91) = ( 0.5595919 0.5000000 0.4404081), wk = 0.0038314 k( 92) = ( 0.5510788 0.5000000 0.4489212), wk = 0.0038314 k( 93) = ( 0.5425657 0.5000000 0.4574343), wk = 0.0038314 k( 94) = ( 0.5340525 0.5000000 0.4659475), wk = 0.0038314 k( 95) = ( 0.5255394 0.5000000 0.4744606), wk = 0.0038314 k( 96) = ( 0.5170263 0.5000000 0.4829737), wk = 0.0038314 k( 97) = ( 0.5085131 0.5000000 0.4914869), wk = 0.0038314 k( 98) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038314 k( 99) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038314 k( 100) = ( 0.4857143 0.4857143 0.4857143), wk = 0.0038314 k( 101) = ( 0.4714286 0.4714286 0.4714286), wk = 0.0038314 k( 102) = ( 0.4571429 0.4571429 0.4571429), wk = 0.0038314 k( 103) = ( 0.4428571 0.4428571 0.4428571), wk = 0.0038314 k( 104) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0038314 k( 105) = ( 0.4142857 0.4142857 0.4142857), wk = 0.0038314 k( 106) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0038314 k( 107) = ( 0.3857143 0.3857143 0.3857143), wk = 0.0038314 k( 108) = ( 0.3714286 0.3714286 0.3714286), wk = 0.0038314 k( 109) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0038314 k( 110) = ( 0.3428571 0.3428571 0.3428571), wk = 0.0038314 k( 111) = ( 0.3285714 0.3285714 0.3285714), wk = 0.0038314 k( 112) = ( 0.3142857 0.3142857 0.3142857), wk = 0.0038314 k( 113) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0038314 k( 114) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0038314 k( 115) = ( 0.2714286 0.2714286 0.2714286), wk = 0.0038314 k( 116) = ( 0.2571429 0.2571429 0.2571429), wk = 0.0038314 k( 117) = ( 0.2428571 0.2428571 0.2428571), wk = 0.0038314 k( 118) = ( 0.2285714 0.2285714 0.2285714), wk = 0.0038314 k( 119) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0038314 k( 120) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0038314 k( 121) = ( 0.1857143 0.1857143 0.1857143), wk = 0.0038314 k( 122) = ( 0.1714286 0.1714286 0.1714286), wk = 0.0038314 k( 123) = ( 0.1571429 0.1571429 0.1571429), wk = 0.0038314 k( 124) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0038314 k( 125) = ( 0.1285714 0.1285714 0.1285714), wk = 0.0038314 k( 126) = ( 0.1142857 0.1142857 0.1142857), wk = 0.0038314 k( 127) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0038314 k( 128) = ( 0.0857143 0.0857143 0.0857143), wk = 0.0038314 k( 129) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0038314 k( 130) = ( 0.0571429 0.0571429 0.0571429), wk = 0.0038314 k( 131) = ( 0.0428571 0.0428571 0.0428571), wk = 0.0038314 k( 132) = ( 0.0285714 0.0285714 0.0285714), wk = 0.0038314 k( 133) = ( 0.0142857 0.0142857 0.0142857), wk = 0.0038314 k( 134) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 135) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 136) = ( 0.0086582 0.0000000 -0.0086582), wk = 0.0038314 k( 137) = ( 0.0173164 0.0000000 -0.0173164), wk = 0.0038314 k( 138) = ( 0.0259746 0.0000000 -0.0259746), wk = 0.0038314 k( 139) = ( 0.0346328 0.0000000 -0.0346328), wk = 0.0038314 k( 140) = ( 0.0432910 0.0000000 -0.0432910), wk = 0.0038314 k( 141) = ( 0.0519493 0.0000000 -0.0519493), wk = 0.0038314 k( 142) = ( 0.0606075 0.0000000 -0.0606075), wk = 0.0038314 k( 143) = ( 0.0692657 0.0000000 -0.0692657), wk = 0.0038314 k( 144) = ( 0.0779239 0.0000000 -0.0779239), wk = 0.0038314 k( 145) = ( 0.0865821 0.0000000 -0.0865821), wk = 0.0038314 k( 146) = ( 0.0952403 0.0000000 -0.0952403), wk = 0.0038314 k( 147) = ( 0.1038985 0.0000000 -0.1038985), wk = 0.0038314 k( 148) = ( 0.1125567 0.0000000 -0.1125567), wk = 0.0038314 k( 149) = ( 0.1212149 0.0000000 -0.1212149), wk = 0.0038314 k( 150) = ( 0.1298731 0.0000000 -0.1298731), wk = 0.0038314 k( 151) = ( 0.1385313 0.0000000 -0.1385313), wk = 0.0038314 k( 152) = ( 0.1471896 0.0000000 -0.1471896), wk = 0.0038314 k( 153) = ( 0.1558478 0.0000000 -0.1558477), wk = 0.0038314 k( 154) = ( 0.1645060 0.0000000 -0.1645060), wk = 0.0038314 k( 155) = ( 0.1731642 0.0000000 -0.1731642), wk = 0.0038314 k( 156) = ( 0.1818224 0.0000000 -0.1818224), wk = 0.0038314 k( 157) = ( 0.1904806 0.0000000 -0.1904806), wk = 0.0038314 k( 158) = ( 0.1991388 0.0000000 -0.1991388), wk = 0.0038314 k( 159) = ( 0.2077970 0.0000000 -0.2077970), wk = 0.0038314 k( 160) = ( 0.2164552 0.0000000 -0.2164552), wk = 0.0038314 k( 161) = ( 0.2251134 0.0000000 -0.2251134), wk = 0.0038314 k( 162) = ( 0.2337716 0.0000000 -0.2337716), wk = 0.0038314 k( 163) = ( 0.2424298 0.0000000 -0.2424298), wk = 0.0038314 k( 164) = ( 0.2510881 0.0000000 -0.2510881), wk = 0.0038314 k( 165) = ( 0.2597463 0.0000000 -0.2597463), wk = 0.0038314 k( 166) = ( 0.2684045 0.0000000 -0.2684045), wk = 0.0038314 k( 167) = ( 0.2770627 0.0000000 -0.2770627), wk = 0.0038314 k( 168) = ( 0.2857209 0.0000000 -0.2857209), wk = 0.0038314 k( 169) = ( 0.2943791 0.0000000 -0.2943791), wk = 0.0038314 k( 170) = ( 0.3030373 0.0000000 -0.3030373), wk = 0.0038314 k( 171) = ( 0.3116955 0.0000000 -0.3116955), wk = 0.0038314 k( 172) = ( 0.3203537 0.0000000 -0.3203537), wk = 0.0038314 k( 173) = ( 0.3290119 0.0000000 -0.3290119), wk = 0.0038314 k( 174) = ( 0.3376701 0.0000000 -0.3376701), wk = 0.0038314 k( 175) = ( 0.3463283 0.0000000 -0.3463283), wk = 0.0038314 k( 176) = ( 0.3549866 0.0000000 -0.3549865), wk = 0.0038314 k( 177) = ( 0.3636448 0.0000000 -0.3636448), wk = 0.0038314 k( 178) = ( 0.3723030 0.0000000 -0.3723030), wk = 0.0038314 k( 179) = ( 0.6276970 0.3723030 0.0000000), wk = 0.0038314 k( 180) = ( 0.6191839 0.3808161 0.0000000), wk = 0.0038314 k( 181) = ( 0.6106708 0.3893292 0.0000000), wk = 0.0038314 k( 182) = ( 0.6021576 0.3978424 0.0000000), wk = 0.0038314 k( 183) = ( 0.5936445 0.4063555 0.0000000), wk = 0.0038314 k( 184) = ( 0.5851314 0.4148687 0.0000000), wk = 0.0038314 k( 185) = ( 0.5766182 0.4233818 0.0000000), wk = 0.0038314 k( 186) = ( 0.5681051 0.4318949 0.0000000), wk = 0.0038314 k( 187) = ( 0.5595919 0.4404080 0.0000000), wk = 0.0038314 k( 188) = ( 0.5510788 0.4489212 0.0000000), wk = 0.0038314 k( 189) = ( 0.5425657 0.4574343 0.0000000), wk = 0.0038314 k( 190) = ( 0.5340525 0.4659475 0.0000000), wk = 0.0038314 k( 191) = ( 0.5255394 0.4744606 0.0000000), wk = 0.0038314 k( 192) = ( 0.5170263 0.4829737 0.0000000), wk = 0.0038314 k( 193) = ( 0.5085131 0.4914869 0.0000000), wk = 0.0038314 k( 194) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0038314 k( 195) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0038314 k( 196) = ( 0.5091212 0.5091212 0.0174719), wk = 0.0038314 k( 197) = ( 0.5182424 0.5182424 0.0349437), wk = 0.0038314 k( 198) = ( 0.5273636 0.5273636 0.0524156), wk = 0.0038314 k( 199) = ( 0.5364849 0.5364849 0.0698874), wk = 0.0038314 k( 200) = ( 0.5456061 0.5456061 0.0873593), wk = 0.0038314 k( 201) = ( 0.5547273 0.5547273 0.1048311), wk = 0.0038314 k( 202) = ( 0.5638485 0.5638485 0.1223030), wk = 0.0038314 k( 203) = ( 0.5729697 0.5729697 0.1397748), wk = 0.0038314 k( 204) = ( 0.5820909 0.5820910 0.1572467), wk = 0.0038314 k( 205) = ( 0.5912122 0.5912122 0.1747185), wk = 0.0038314 k( 206) = ( 0.6003334 0.6003334 0.1921904), wk = 0.0038314 k( 207) = ( 0.6094546 0.6094546 0.2096622), wk = 0.0038314 k( 208) = ( 0.6185758 0.6185758 0.2271341), wk = 0.0038314 k( 209) = ( 0.6276970 0.6276970 0.2446059), wk = 0.0038314 k( 210) = ( 0.6276970 0.6276970 0.2446059), wk = 0.0038314 k( 211) = ( 0.6227856 0.6227856 0.2544288), wk = 0.0038314 k( 212) = ( 0.6178742 0.6178742 0.2642516), wk = 0.0038314 k( 213) = ( 0.6129628 0.6129628 0.2740745), wk = 0.0038314 k( 214) = ( 0.6080513 0.6080513 0.2838973), wk = 0.0038314 k( 215) = ( 0.6031399 0.6031399 0.2937202), wk = 0.0038314 k( 216) = ( 0.5982285 0.5982285 0.3035430), wk = 0.0038314 k( 217) = ( 0.5933171 0.5933171 0.3133659), wk = 0.0038314 k( 218) = ( 0.5884056 0.5884056 0.3231887), wk = 0.0038314 k( 219) = ( 0.5834942 0.5834942 0.3330116), wk = 0.0038314 k( 220) = ( 0.5785828 0.5785828 0.3428344), wk = 0.0038314 k( 221) = ( 0.5736714 0.5736714 0.3526573), wk = 0.0038314 k( 222) = ( 0.5687599 0.5687599 0.3624801), wk = 0.0038314 k( 223) = ( 0.5638485 0.5638485 0.3723030), wk = 0.0038314 k( 224) = ( 0.5589371 0.5589371 0.3821258), wk = 0.0038314 k( 225) = ( 0.5540257 0.5540257 0.3919487), wk = 0.0038314 k( 226) = ( 0.5491142 0.5491142 0.4017715), wk = 0.0038314 k( 227) = ( 0.5442028 0.5442028 0.4115944), wk = 0.0038314 k( 228) = ( 0.5392914 0.5392914 0.4214172), wk = 0.0038314 k( 229) = ( 0.5343800 0.5343800 0.4312401), wk = 0.0038314 k( 230) = ( 0.5294686 0.5294686 0.4410629), wk = 0.0038314 k( 231) = ( 0.5245571 0.5245571 0.4508858), wk = 0.0038314 k( 232) = ( 0.5196457 0.5196457 0.4607086), wk = 0.0038314 k( 233) = ( 0.5147343 0.5147343 0.4705315), wk = 0.0038314 k( 234) = ( 0.5098229 0.5098229 0.4803543), wk = 0.0038314 k( 235) = ( 0.5049114 0.5049114 0.4901772), wk = 0.0038314 k( 236) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038314 k( 237) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0038314 k( 238) = ( 0.5106414 0.0155126 0.0155126), wk = 0.0038314 k( 239) = ( 0.5212828 0.0310253 0.0310253), wk = 0.0038314 k( 240) = ( 0.5319243 0.0465379 0.0465379), wk = 0.0038314 k( 241) = ( 0.5425657 0.0620505 0.0620505), wk = 0.0038314 k( 242) = ( 0.5532071 0.0775631 0.0775631), wk = 0.0038314 k( 243) = ( 0.5638485 0.0930757 0.0930757), wk = 0.0038314 k( 244) = ( 0.5744899 0.1085884 0.1085884), wk = 0.0038314 k( 245) = ( 0.5851314 0.1241010 0.1241010), wk = 0.0038314 k( 246) = ( 0.5957728 0.1396136 0.1396136), wk = 0.0038314 k( 247) = ( 0.6064142 0.1551262 0.1551262), wk = 0.0038314 k( 248) = ( 0.6170556 0.1706389 0.1706389), wk = 0.0038314 k( 249) = ( 0.6276970 0.1861515 0.1861515), wk = 0.0038314 k( 250) = ( 0.6383385 0.2016641 0.2016641), wk = 0.0038314 k( 251) = ( 0.6489799 0.2171767 0.2171767), wk = 0.0038314 k( 252) = ( 0.6596213 0.2326894 0.2326894), wk = 0.0038314 k( 253) = ( 0.6702627 0.2482020 0.2482020), wk = 0.0038314 k( 254) = ( 0.6809041 0.2637146 0.2637146), wk = 0.0038314 k( 255) = ( 0.6915455 0.2792272 0.2792272), wk = 0.0038314 k( 256) = ( 0.7021870 0.2947399 0.2947399), wk = 0.0038314 k( 257) = ( 0.7128284 0.3102525 0.3102525), wk = 0.0038314 k( 258) = ( 0.7234698 0.3257651 0.3257651), wk = 0.0038314 k( 259) = ( 0.7341112 0.3412777 0.3412777), wk = 0.0038314 k( 260) = ( 0.7447526 0.3567903 0.3567903), wk = 0.0038314 k( 261) = ( 0.7553941 0.3723030 0.3723030), wk = 0.0038314 Dense grid: 49393 G-vectors FFT dimensions: ( 54, 54, 54) Smooth grid: 32941 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.32 Mb ( 258, 82) NL pseudopotentials 0.47 Mb ( 129, 238) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.01 Mb ( 1371) G-vector shells 0.01 Mb ( 1155) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.29 Mb ( 258, 328) Each subspace H/S matrix 0.10 Mb ( 82, 82) Each matrix 0.60 Mb ( 238, 2, 82) The potential is recalculated from file : ./Tl2Ni3S2.save/charge-density.dat Starting wfc are 106 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.8 secs Computing kpt #: 2 total cpu time spent up to now is 4.8 secs Computing kpt #: 3 total cpu time spent up to now is 5.7 secs Computing kpt #: 4 total cpu time spent up to now is 6.7 secs Computing kpt #: 5 total cpu time spent up to now is 7.6 secs Computing kpt #: 6 total cpu time spent up to now is 8.5 secs Computing kpt #: 7 total cpu time spent up to now is 9.5 secs Computing kpt #: 8 total cpu time spent up to now is 10.4 secs Computing kpt #: 9 total cpu time spent up to now is 11.4 secs Computing kpt #: 10 total cpu time spent up to now is 12.3 secs Computing kpt #: 11 total cpu time spent up to now is 13.3 secs Computing kpt #: 12 total cpu time spent up to now is 14.3 secs Computing kpt #: 13 total cpu time spent up to now is 15.2 secs Computing kpt #: 14 total cpu time spent up to now is 16.2 secs Computing kpt #: 15 total cpu time spent up to now is 17.1 secs Computing kpt #: 16 total cpu time spent up to now is 18.0 secs Computing kpt #: 17 total cpu time spent up to now is 19.0 secs Computing kpt #: 18 total cpu time spent up to now is 19.9 secs Computing kpt #: 19 total cpu time spent up to now is 20.8 secs Computing kpt #: 20 total cpu time spent up to now is 21.7 secs Computing kpt #: 21 total cpu time spent up to now is 22.6 secs Computing kpt #: 22 total cpu time spent up to now is 23.5 secs Computing kpt #: 23 total cpu time spent up to now is 24.4 secs Computing kpt #: 24 total cpu time spent up to now is 25.3 secs Computing kpt #: 25 total cpu time spent up to now is 26.2 secs Computing kpt #: 26 total cpu time spent up to now is 27.0 secs Computing kpt #: 27 total cpu time spent up to now is 27.9 secs Computing kpt #: 28 total cpu time spent up to now is 28.8 secs Computing kpt #: 29 total cpu time spent up to now is 29.7 secs Computing kpt #: 30 total cpu time spent up to now is 30.5 secs Computing kpt #: 31 total cpu time spent up to now is 31.4 secs Computing kpt #: 32 total cpu time spent up to now is 32.3 secs Computing kpt #: 33 total cpu time spent up to now is 33.1 secs Computing kpt #: 34 total cpu time spent up to now is 34.0 secs Computing kpt #: 35 total cpu time spent up to now is 34.9 secs Computing kpt #: 36 total cpu time spent up to now is 35.7 secs Computing kpt #: 37 total cpu time spent up to now is 36.6 secs Computing kpt #: 38 total cpu time spent up to now is 37.4 secs Computing kpt #: 39 total cpu time spent up to now is 38.3 secs Computing kpt #: 40 total cpu time spent up to now is 39.1 secs Computing kpt #: 41 total cpu time spent up to now is 40.0 secs Computing kpt #: 42 total cpu time spent up to now is 40.9 secs Computing kpt #: 43 total cpu time spent up to now is 41.7 secs Computing kpt #: 44 total cpu time spent up to now is 42.6 secs Computing kpt #: 45 total cpu time spent up to now is 43.5 secs Computing kpt #: 46 total cpu time spent up to now is 44.3 secs Computing kpt #: 47 total cpu time spent up to now is 45.2 secs Computing kpt #: 48 total cpu time spent up to now is 46.1 secs Computing kpt #: 49 total cpu time spent up to now is 47.0 secs Computing kpt #: 50 total cpu time spent up to now is 47.9 secs Computing kpt #: 51 total cpu time spent up to now is 48.8 secs Computing kpt #: 52 total cpu time spent up to now is 49.7 secs Computing kpt #: 53 total cpu time spent up to now is 50.7 secs Computing kpt #: 54 total cpu time spent up to now is 51.6 secs Computing kpt #: 55 total cpu time spent up to now is 52.6 secs Computing kpt #: 56 total cpu time spent up to now is 53.6 secs Computing kpt #: 57 total cpu time spent up to now is 54.6 secs Computing kpt #: 58 total cpu time spent up to now is 55.6 secs Computing kpt #: 59 total cpu time spent up to now is 56.6 secs Computing kpt #: 60 total cpu time spent up to now is 57.6 secs Computing kpt #: 61 total cpu time spent up to now is 58.6 secs Computing kpt #: 62 total cpu time spent up to now is 59.6 secs Computing kpt #: 63 total cpu time spent up to now is 60.6 secs Computing kpt #: 64 total cpu time spent up to now is 61.7 secs Computing kpt #: 65 total cpu time spent up to now is 62.7 secs Computing kpt #: 66 total cpu time spent up to now is 63.7 secs Computing kpt #: 67 total cpu time spent up to now is 64.9 secs Computing kpt #: 68 total cpu time spent up to now is 66.0 secs Computing kpt #: 69 total cpu time spent up to now is 67.1 secs Computing kpt #: 70 total cpu time spent up to now is 68.1 secs Computing kpt #: 71 total cpu time spent up to now is 69.1 secs Computing kpt #: 72 total cpu time spent up to now is 70.1 secs Computing kpt #: 73 total cpu time spent up to now is 71.1 secs Computing kpt #: 74 total cpu time spent up to now is 72.1 secs Computing kpt #: 75 total cpu time spent up to now is 73.0 secs Computing kpt #: 76 total cpu time spent up to now is 74.0 secs Computing kpt #: 77 total cpu time spent up to now is 75.0 secs Computing kpt #: 78 total cpu time spent up to now is 76.0 secs Computing kpt #: 79 total cpu time spent up to now is 76.9 secs Computing kpt #: 80 total cpu time spent up to now is 77.9 secs Computing kpt #: 81 total cpu time spent up to now is 78.9 secs Computing kpt #: 82 total cpu time spent up to now is 79.8 secs Computing kpt #: 83 total cpu time spent up to now is 80.8 secs Computing kpt #: 84 total cpu time spent up to now is 81.7 secs Computing kpt #: 85 total cpu time spent up to now is 82.7 secs Computing kpt #: 86 total cpu time spent up to now is 83.6 secs Computing kpt #: 87 total cpu time spent up to now is 84.5 secs Computing kpt #: 88 total cpu time spent up to now is 85.5 secs Computing kpt #: 89 total cpu time spent up to now is 86.4 secs Computing kpt #: 90 total cpu time spent up to now is 87.3 secs Computing kpt #: 91 total cpu time spent up to now is 88.3 secs Computing kpt #: 92 total cpu time spent up to now is 89.2 secs Computing kpt #: 93 total cpu time spent up to now is 90.1 secs Computing kpt #: 94 total cpu time spent up to now is 91.0 secs Computing kpt #: 95 total cpu time spent up to now is 91.9 secs Computing kpt #: 96 total cpu time spent up to now is 92.8 secs Computing kpt #: 97 total cpu time spent up to now is 93.7 secs Computing kpt #: 98 total cpu time spent up to now is 94.6 secs Computing kpt #: 99 total cpu time spent up to now is 95.5 secs Computing kpt #: 100 total cpu time spent up to now is 96.4 secs Computing kpt #: 101 total cpu time spent up to now is 97.3 secs Computing kpt #: 102 total cpu time spent up to now is 98.2 secs Computing kpt #: 103 total cpu time spent up to now is 99.1 secs Computing kpt #: 104 total cpu time spent up to now is 99.9 secs Computing kpt #: 105 total cpu time spent up to now is 100.8 secs Computing kpt #: 106 total cpu time spent up to now is 101.7 secs Computing kpt #: 107 total cpu time spent up to now is 102.6 secs Computing kpt #: 108 total cpu time spent up to now is 103.6 secs Computing kpt #: 109 total cpu time spent up to now is 104.4 secs Computing kpt #: 110 total cpu time spent up to now is 105.4 secs Computing kpt #: 111 total cpu time spent up to now is 106.2 secs Computing kpt #: 112 total cpu time spent up to now is 107.1 secs Computing kpt #: 113 total cpu time spent up to now is 108.0 secs Computing kpt #: 114 total cpu time spent up to now is 108.9 secs Computing kpt #: 115 total cpu time spent up to now is 109.8 secs Computing kpt #: 116 total cpu time spent up to now is 110.7 secs Computing kpt #: 117 total cpu time spent up to now is 111.6 secs Computing kpt #: 118 total cpu time spent up to now is 112.5 secs Computing kpt #: 119 total cpu time spent up to now is 113.4 secs Computing kpt #: 120 total cpu time spent up to now is 114.3 secs Computing kpt #: 121 total cpu time spent up to now is 115.3 secs Computing kpt #: 122 total cpu time spent up to now is 116.2 secs Computing kpt #: 123 total cpu time spent up to now is 117.1 secs Computing kpt #: 124 total cpu time spent up to now is 118.0 secs Computing kpt #: 125 total cpu time spent up to now is 119.0 secs Computing kpt #: 126 total cpu time spent up to now is 119.9 secs Computing kpt #: 127 total cpu time spent up to now is 120.8 secs Computing kpt #: 128 total cpu time spent up to now is 121.8 secs Computing kpt #: 129 total cpu time spent up to now is 122.7 secs Computing kpt #: 130 total cpu time spent up to now is 123.6 secs Computing kpt #: 131 total cpu time spent up to now is 124.5 secs Computing kpt #: 132 total cpu time spent up to now is 125.4 secs Computing kpt #: 133 total cpu time spent up to now is 126.3 secs Computing kpt #: 134 total cpu time spent up to now is 127.2 secs Computing kpt #: 135 total cpu time spent up to now is 128.1 secs Computing kpt #: 136 total cpu time spent up to now is 129.0 secs Computing kpt #: 137 total cpu time spent up to now is 130.0 secs Computing kpt #: 138 total cpu time spent up to now is 130.9 secs Computing kpt #: 139 total cpu time spent up to now is 131.9 secs Computing kpt #: 140 total cpu time spent up to now is 132.8 secs Computing kpt #: 141 total cpu time spent up to now is 133.8 secs Computing kpt #: 142 total cpu time spent up to now is 134.7 secs Computing kpt #: 143 total cpu time spent up to now is 135.7 secs Computing kpt #: 144 total cpu time spent up to now is 136.7 secs Computing kpt #: 145 total cpu time spent up to now is 137.6 secs Computing kpt #: 146 total cpu time spent up to now is 138.6 secs Computing kpt #: 147 total cpu time spent up to now is 139.6 secs Computing kpt #: 148 total cpu time spent up to now is 140.6 secs Computing kpt #: 149 total cpu time spent up to now is 141.5 secs Computing kpt #: 150 total cpu time spent up to now is 142.5 secs Computing kpt #: 151 total cpu time spent up to now is 143.9 secs Computing kpt #: 152 total cpu time spent up to now is 144.9 secs Computing kpt #: 153 total cpu time spent up to now is 145.9 secs Computing kpt #: 154 total cpu time spent up to now is 146.9 secs Computing kpt #: 155 total cpu time spent up to now is 147.9 secs Computing kpt #: 156 total cpu time spent up to now is 148.9 secs Computing kpt #: 157 total cpu time spent up to now is 149.9 secs Computing kpt #: 158 total cpu time spent up to now is 150.9 secs Computing kpt #: 159 total cpu time spent up to now is 151.8 secs Computing kpt #: 160 total cpu time spent up to now is 152.7 secs Computing kpt #: 161 total cpu time spent up to now is 153.7 secs Computing kpt #: 162 total cpu time spent up to now is 154.6 secs Computing kpt #: 163 total cpu time spent up to now is 155.6 secs Computing kpt #: 164 total cpu time spent up to now is 156.9 secs Computing kpt #: 165 total cpu time spent up to now is 158.0 secs Computing kpt #: 166 total cpu time spent up to now is 158.9 secs Computing kpt #: 167 total cpu time spent up to now is 159.9 secs Computing kpt #: 168 total cpu time spent up to now is 160.9 secs Computing kpt #: 169 total cpu time spent up to now is 161.8 secs Computing kpt #: 170 total cpu time spent up to now is 162.8 secs Computing kpt #: 171 total cpu time spent up to now is 163.9 secs Computing kpt #: 172 total cpu time spent up to now is 165.0 secs Computing kpt #: 173 total cpu time spent up to now is 166.2 secs Computing kpt #: 174 total cpu time spent up to now is 167.3 secs Computing kpt #: 175 total cpu time spent up to now is 168.5 secs Computing kpt #: 176 total cpu time spent up to now is 169.7 secs Computing kpt #: 177 total cpu time spent up to now is 170.7 secs Computing kpt #: 178 total cpu time spent up to now is 171.7 secs Computing kpt #: 179 total cpu time spent up to now is 172.8 secs Computing kpt #: 180 total cpu time spent up to now is 173.8 secs Computing kpt #: 181 total cpu time spent up to now is 174.8 secs Computing kpt #: 182 total cpu time spent up to now is 175.8 secs Computing kpt #: 183 total cpu time spent up to now is 176.8 secs Computing kpt #: 184 total cpu time spent up to now is 177.8 secs Computing kpt #: 185 total cpu time spent up to now is 178.7 secs Computing kpt #: 186 total cpu time spent up to now is 179.7 secs Computing kpt #: 187 total cpu time spent up to now is 180.6 secs Computing kpt #: 188 total cpu time spent up to now is 181.6 secs Computing kpt #: 189 total cpu time spent up to now is 182.5 secs Computing kpt #: 190 total cpu time spent up to now is 183.4 secs Computing kpt #: 191 total cpu time spent up to now is 184.4 secs Computing kpt #: 192 total cpu time spent up to now is 185.3 secs Computing kpt #: 193 total cpu time spent up to now is 186.2 secs Computing kpt #: 194 total cpu time spent up to now is 187.2 secs Computing kpt #: 195 total cpu time spent up to now is 188.1 secs Computing kpt #: 196 total cpu time spent up to now is 189.1 secs Computing kpt #: 197 total cpu time spent up to now is 190.0 secs Computing kpt #: 198 total cpu time spent up to now is 190.9 secs Computing kpt #: 199 total cpu time spent up to now is 191.9 secs Computing kpt #: 200 total cpu time spent up to now is 192.8 secs Computing kpt #: 201 total cpu time spent up to now is 193.8 secs Computing kpt #: 202 total cpu time spent up to now is 194.7 secs Computing kpt #: 203 total cpu time spent up to now is 195.6 secs Computing kpt #: 204 total cpu time spent up to now is 196.6 secs Computing kpt #: 205 total cpu time spent up to now is 197.6 secs Computing kpt #: 206 total cpu time spent up to now is 198.5 secs Computing kpt #: 207 total cpu time spent up to now is 199.5 secs Computing kpt #: 208 total cpu time spent up to now is 200.5 secs Computing kpt #: 209 total cpu time spent up to now is 201.4 secs Computing kpt #: 210 total cpu time spent up to now is 202.4 secs Computing kpt #: 211 total cpu time spent up to now is 203.4 secs Computing kpt #: 212 total cpu time spent up to now is 204.3 secs Computing kpt #: 213 total cpu time spent up to now is 205.3 secs Computing kpt #: 214 total cpu time spent up to now is 206.2 secs Computing kpt #: 215 total cpu time spent up to now is 207.1 secs Computing kpt #: 216 total cpu time spent up to now is 208.1 secs Computing kpt #: 217 total cpu time spent up to now is 209.0 secs Computing kpt #: 218 total cpu time spent up to now is 209.9 secs Computing kpt #: 219 total cpu time spent up to now is 210.9 secs Computing kpt #: 220 total cpu time spent up to now is 211.9 secs Computing kpt #: 221 total cpu time spent up to now is 212.8 secs Computing kpt #: 222 total cpu time spent up to now is 213.8 secs Computing kpt #: 223 total cpu time spent up to now is 214.7 secs Computing kpt #: 224 total cpu time spent up to now is 215.7 secs Computing kpt #: 225 total cpu time spent up to now is 216.6 secs Computing kpt #: 226 total cpu time spent up to now is 217.6 secs Computing kpt #: 227 total cpu time spent up to now is 218.5 secs Computing kpt #: 228 total cpu time spent up to now is 219.5 secs Computing kpt #: 229 total cpu time spent up to now is 220.4 secs Computing kpt #: 230 total cpu time spent up to now is 221.3 secs Computing kpt #: 231 total cpu time spent up to now is 222.2 secs Computing kpt #: 232 total cpu time spent up to now is 223.2 secs Computing kpt #: 233 total cpu time spent up to now is 224.1 secs Computing kpt #: 234 total cpu time spent up to now is 225.0 secs Computing kpt #: 235 total cpu time spent up to now is 225.9 secs Computing kpt #: 236 total cpu time spent up to now is 226.8 secs Computing kpt #: 237 total cpu time spent up to now is 227.6 secs Computing kpt #: 238 total cpu time spent up to now is 228.5 secs Computing kpt #: 239 total cpu time spent up to now is 229.3 secs Computing kpt #: 240 total cpu time spent up to now is 230.2 secs Computing kpt #: 241 total cpu time spent up to now is 231.0 secs Computing kpt #: 242 total cpu time spent up to now is 231.9 secs Computing kpt #: 243 total cpu time spent up to now is 232.8 secs Computing kpt #: 244 total cpu time spent up to now is 233.7 secs Computing kpt #: 245 total cpu time spent up to now is 234.6 secs Computing kpt #: 246 total cpu time spent up to now is 235.5 secs Computing kpt #: 247 total cpu time spent up to now is 236.4 secs Computing kpt #: 248 total cpu time spent up to now is 237.3 secs Computing kpt #: 249 total cpu time spent up to now is 238.3 secs Computing kpt #: 250 total cpu time spent up to now is 239.2 secs Computing kpt #: 251 total cpu time spent up to now is 240.1 secs Computing kpt #: 252 total cpu time spent up to now is 241.0 secs Computing kpt #: 253 total cpu time spent up to now is 242.0 secs Computing kpt #: 254 total cpu time spent up to now is 242.9 secs Computing kpt #: 255 total cpu time spent up to now is 243.9 secs Computing kpt #: 256 total cpu time spent up to now is 244.9 secs Computing kpt #: 257 total cpu time spent up to now is 245.9 secs Computing kpt #: 258 total cpu time spent up to now is 246.8 secs Computing kpt #: 259 total cpu time spent up to now is 247.8 secs Computing kpt #: 260 total cpu time spent up to now is 248.7 secs Computing kpt #: 261 total cpu time spent up to now is 249.7 secs ethr = 1.47E-08, avg # of iterations = 17.3 total cpu time spent up to now is 249.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4111 PWs) bands (ev): -3.0274 -3.0274 -1.5427 -1.5427 -1.4244 -1.4244 -1.4042 -1.4042 -1.3690 -1.3690 -1.3490 -1.3490 0.5298 0.5298 0.6815 0.6815 0.6919 0.6919 0.7918 0.7918 0.8735 0.8735 0.8755 0.8755 3.9520 3.9520 5.7705 5.7705 5.9218 5.9218 6.3233 6.3233 6.3614 6.3614 7.1190 7.1190 7.9128 7.9128 8.0784 8.0784 8.8858 8.8858 8.9262 8.9262 9.0500 9.0500 9.3544 9.3544 9.5491 9.5491 9.5631 9.5631 9.8652 9.8652 9.8847 9.8847 9.9759 9.9759 10.0114 10.0114 10.2078 10.2078 10.2414 10.2414 10.3175 10.3175 10.6990 10.6990 10.9666 10.9666 10.9751 10.9751 11.2311 11.2311 11.5388 11.5388 15.2411 15.2411 15.3530 15.3530 15.3594 15.3594 k = 0.0139-0.0085-0.0059 ( 4106 PWs) bands (ev): -3.0266 -3.0266 -1.5454 -1.5454 -1.4241 -1.4241 -1.4039 -1.4039 -1.3679 -1.3679 -1.3485 -1.3485 0.5302 0.5302 0.6816 0.6816 0.6919 0.6919 0.7918 0.7918 0.8735 0.8735 0.8755 0.8755 3.9514 3.9514 5.7687 5.7687 5.9213 5.9213 6.3225 6.3225 6.3607 6.3607 7.1192 7.1192 7.9129 7.9129 8.0780 8.0780 8.8857 8.8857 8.9261 8.9261 9.0511 9.0511 9.3514 9.3514 9.5493 9.5493 9.5632 9.5632 9.8634 9.8634 9.8806 9.8806 9.9758 9.9758 10.0100 10.0100 10.2115 10.2115 10.2339 10.2339 10.3197 10.3197 10.7035 10.7035 10.9704 10.9704 10.9780 10.9780 11.2377 11.2377 11.5423 11.5423 15.2288 15.2288 15.3595 15.3595 15.3669 15.3669 k = 0.0278-0.0170-0.0119 ( 4102 PWs) bands (ev): -3.0244 -3.0244 -1.5531 -1.5531 -1.4233 -1.4233 -1.4031 -1.4031 -1.3648 -1.3648 -1.3470 -1.3470 0.5314 0.5314 0.6820 0.6820 0.6922 0.6922 0.7919 0.7919 0.8735 0.8735 0.8757 0.8757 3.9495 3.9495 5.7630 5.7630 5.9198 5.9198 6.3201 6.3201 6.3591 6.3591 7.1198 7.1198 7.9130 7.9130 8.0770 8.0770 8.8855 8.8855 8.9260 8.9260 9.0541 9.0541 9.3427 9.3427 9.5495 9.5495 9.5638 9.5638 9.8538 9.8538 9.8726 9.8726 9.9752 9.9752 10.0070 10.0070 10.2103 10.2103 10.2248 10.2248 10.3259 10.3259 10.7157 10.7157 10.9780 10.9780 10.9889 10.9889 11.2580 11.2580 11.5532 11.5532 15.2007 15.2007 15.3664 15.3664 15.3932 15.3932 k = 0.0417-0.0255-0.0178 ( 4102 PWs) bands (ev): -3.0208 -3.0208 -1.5649 -1.5649 -1.4223 -1.4223 -1.4021 -1.4021 -1.3610 -1.3610 -1.3436 -1.3436 0.5335 0.5335 0.6828 0.6828 0.6926 0.6926 0.7919 0.7919 0.8735 0.8735 0.8759 0.8759 3.9464 3.9464 5.7529 5.7529 5.9177 5.9177 6.3161 6.3161 6.3570 6.3570 7.1207 7.1207 7.9123 7.9123 8.0760 8.0760 8.8850 8.8850 8.9257 8.9257 9.0591 9.0591 9.3290 9.3290 9.5489 9.5489 9.5653 9.5653 9.8311 9.8311 9.8673 9.8673 9.9741 9.9741 10.0042 10.0042 10.1825 10.1825 10.2378 10.2378 10.3354 10.3354 10.7330 10.7330 10.9871 10.9871 11.0057 11.0057 11.2927 11.2927 11.5727 11.5727 15.1661 15.1661 15.3767 15.3767 15.4253 15.4253 k = 0.0556-0.0340-0.0238 ( 4098 PWs) bands (ev): -3.0157 -3.0157 -1.5798 -1.5798 -1.4215 -1.4215 -1.4010 -1.4010 -1.3578 -1.3578 -1.3375 -1.3375 0.5363 0.5363 0.6838 0.6838 0.6932 0.6932 0.7918 0.7918 0.8734 0.8734 0.8763 0.8763 3.9421 3.9421 5.7376 5.7376 5.9152 5.9152 6.3111 6.3111 6.3554 6.3554 7.1218 7.1218 7.9094 7.9094 8.0759 8.0759 8.8842 8.8842 8.9253 8.9253 9.0657 9.0657 9.3112 9.3112 9.5467 9.5467 9.5680 9.5680 9.8000 9.8000 9.8621 9.8621 9.9722 9.9722 10.0023 10.0023 10.1512 10.1512 10.2526 10.2526 10.3476 10.3476 10.7535 10.7535 10.9991 10.9991 11.0233 11.0233 11.3406 11.3406 11.6030 11.6030 15.1285 15.1285 15.3904 15.3904 15.4589 15.4589 k = 0.0694-0.0425-0.0297 ( 4094 PWs) bands (ev): -3.0091 -3.0091 -1.5970 -1.5970 -1.4206 -1.4206 -1.3999 -1.3999 -1.3557 -1.3557 -1.3290 -1.3290 0.5399 0.5399 0.6851 0.6851 0.6939 0.6939 0.7918 0.7918 0.8731 0.8731 0.8769 0.8769 3.9368 3.9368 5.7163 5.7163 5.9126 5.9126 6.3059 6.3059 6.3543 6.3543 7.1229 7.1229 7.9030 7.9030 8.0779 8.0779 8.8829 8.8829 8.9250 8.9250 9.0734 9.0734 9.2906 9.2906 9.5421 9.5421 9.5719 9.5719 9.7650 9.7650 9.8549 9.8549 9.9694 9.9694 10.0012 10.0012 10.1220 10.1220 10.2664 10.2664 10.3618 10.3618 10.7758 10.7758 11.0135 11.0135 11.0403 11.0403 11.3962 11.3962 11.6481 11.6481 15.0889 15.0889 15.4067 15.4067 15.4925 15.4925 k = 0.0833-0.0510-0.0357 ( 4092 PWs) bands (ev): -3.0012 -3.0012 -1.6159 -1.6159 -1.4199 -1.4199 -1.3989 -1.3989 -1.3543 -1.3543 -1.3190 -1.3190 0.5441 0.5441 0.6867 0.6867 0.6948 0.6948 0.7918 0.7918 0.8728 0.8728 0.8777 0.8777 3.9304 3.9304 5.6881 5.6881 5.9103 5.9103 6.3019 6.3019 6.3541 6.3541 7.1237 7.1237 7.8921 7.8921 8.0824 8.0824 8.8808 8.8808 8.9247 8.9247 9.0813 9.0813 9.2688 9.2688 9.5347 9.5347 9.5767 9.5767 9.7290 9.7290 9.8445 9.8445 9.9655 9.9655 10.0005 10.0005 10.0982 10.0982 10.2783 10.2783 10.3774 10.3774 10.7989 10.7989 11.0279 11.0279 11.0596 11.0596 11.4524 11.4524 11.7124 11.7124 15.0473 15.0473 15.4247 15.4247 15.5253 15.5253 k = 0.0972-0.0595-0.0416 ( 4092 PWs) bands (ev): -2.9918 -2.9918 -1.6360 -1.6360 -1.4192 -1.4192 -1.3979 -1.3979 -1.3532 -1.3532 -1.3084 -1.3084 0.5489 0.5489 0.6885 0.6885 0.6960 0.6960 0.7918 0.7918 0.8724 0.8724 0.8787 0.8787 3.9231 3.9231 5.6529 5.6529 5.9082 5.9082 6.3002 6.3002 6.3547 6.3547 7.1240 7.1240 7.8763 7.8763 8.0894 8.0894 8.8777 8.8777 8.9244 8.9244 9.0877 9.0877 9.2482 9.2482 9.5240 9.5240 9.5820 9.5820 9.6945 9.6945 9.8304 9.8304 9.9608 9.9608 9.9994 9.9994 10.0817 10.0817 10.2879 10.2879 10.3940 10.3940 10.8220 10.8220 11.0390 11.0390 11.0854 11.0854 11.5041 11.5041 11.7975 11.7975 15.0039 15.0039 15.4425 15.4425 15.5571 15.5571 k = 0.1111-0.0680-0.0476 ( 4092 PWs) bands (ev): -2.9811 -2.9811 -1.6570 -1.6570 -1.4186 -1.4186 -1.3969 -1.3969 -1.3521 -1.3521 -1.2978 -1.2978 0.5542 0.5542 0.6905 0.6905 0.6973 0.6973 0.7918 0.7918 0.8720 0.8720 0.8798 0.8798 3.9149 3.9149 5.6106 5.6106 5.9065 5.9065 6.3017 6.3017 6.3561 6.3561 7.1236 7.1236 7.8558 7.8558 8.0984 8.0984 8.8734 8.8734 8.9242 8.9242 9.0900 9.0900 9.2317 9.2317 9.5101 9.5101 9.5873 9.5873 9.6632 9.6632 9.8127 9.8127 9.9561 9.9561 9.9980 9.9980 10.0725 10.0725 10.2950 10.2950 10.4113 10.4113 10.8445 10.8445 11.0467 11.0467 11.1191 11.1191 11.5509 11.5509 11.9010 11.9010 14.9582 14.9582 15.4580 15.4580 15.5881 15.5881 k = 0.1250-0.0765-0.0535 ( 4096 PWs) bands (ev): -2.9691 -2.9691 -1.6788 -1.6788 -1.4179 -1.4179 -1.3958 -1.3958 -1.3511 -1.3511 -1.2873 -1.2873 0.5600 0.5600 0.6927 0.6927 0.6989 0.6989 0.7917 0.7917 0.8714 0.8714 0.8812 0.8812 3.9061 3.9061 5.5618 5.5618 5.9051 5.9051 6.3069 6.3069 6.3584 6.3584 7.1223 7.1223 7.8312 7.8312 8.1087 8.1087 8.8676 8.8676 8.9241 8.9241 9.0854 9.0854 9.2220 9.2220 9.4935 9.4935 9.5913 9.5913 9.6371 9.6371 9.7928 9.7928 9.9521 9.9521 9.9962 9.9962 10.0688 10.0688 10.2996 10.2996 10.4293 10.4293 10.8661 10.8661 11.0523 11.0523 11.1599 11.1599 11.5949 11.5949 12.0184 12.0184 14.9101 14.9101 15.4686 15.4686 15.6191 15.6191 k = 0.1389-0.0850-0.0595 ( 4100 PWs) bands (ev): -2.9558 -2.9558 -1.7012 -1.7012 -1.4173 -1.4173 -1.3946 -1.3946 -1.3500 -1.3500 -1.2774 -1.2774 0.5661 0.5661 0.6950 0.6950 0.7008 0.7008 0.7916 0.7916 0.8709 0.8709 0.8827 0.8827 3.8967 3.8967 5.5072 5.5072 5.9038 5.9038 6.3157 6.3157 6.3623 6.3623 7.1198 7.1198 7.8029 7.8029 8.1193 8.1193 8.8601 8.8601 8.9239 8.9239 9.0731 9.0731 9.2194 9.2194 9.4761 9.4761 9.5892 9.5892 9.6205 9.6205 9.7722 9.7722 9.9492 9.9492 9.9943 9.9943 10.0690 10.0690 10.3018 10.3018 10.4479 10.4479 10.8865 10.8865 11.0567 11.0567 11.2071 11.2071 11.6379 11.6379 12.1458 12.1458 14.8596 14.8596 15.4718 15.4718 15.6507 15.6507 k = 0.1528-0.0935-0.0654 ( 4104 PWs) bands (ev): -2.9412 -2.9412 -1.7240 -1.7240 -1.4166 -1.4166 -1.3934 -1.3934 -1.3488 -1.3488 -1.2679 -1.2679 0.5724 0.5724 0.6974 0.6974 0.7031 0.7031 0.7915 0.7915 0.8702 0.8702 0.8844 0.8844 3.8869 3.8869 5.4475 5.4475 5.9026 5.9026 6.3270 6.3270 6.3686 6.3686 7.1160 7.1160 7.7717 7.7717 8.1297 8.1297 8.8508 8.8508 8.9234 8.9234 9.0554 9.0554 9.2203 9.2203 9.4606 9.4606 9.5754 9.5754 9.6183 9.6183 9.7526 9.7526 9.9473 9.9473 9.9923 9.9923 10.0716 10.0716 10.3017 10.3017 10.4671 10.4671 10.9057 10.9057 11.0604 11.0604 11.2597 11.2597 11.6809 11.6809 12.2803 12.2803 14.8066 14.8066 15.4667 15.4667 15.6829 15.6829 k = 0.1667-0.1020-0.0714 ( 4116 PWs) bands (ev): -2.9254 -2.9254 -1.7472 -1.7472 -1.4160 -1.4160 -1.3921 -1.3921 -1.3476 -1.3476 -1.2592 -1.2592 0.5788 0.5788 0.6997 0.6997 0.7057 0.7057 0.7913 0.7913 0.8695 0.8695 0.8862 0.8862 3.8767 3.8767 5.3839 5.3839 5.9015 5.9015 6.3388 6.3388 6.3794 6.3794 7.1107 7.1107 7.7379 7.7379 8.1392 8.1392 8.8394 8.8394 8.9225 8.9225 9.0357 9.0357 9.2198 9.2198 9.4498 9.4498 9.5573 9.5573 9.6224 9.6224 9.7350 9.7350 9.9462 9.9462 9.9902 9.9902 10.0756 10.0756 10.2996 10.2996 10.4868 10.4868 10.9239 10.9239 11.0640 11.0640 11.3172 11.3172 11.7245 11.7245 12.4200 12.4200 14.7515 14.7515 15.4532 15.4532 15.7149 15.7149 k = 0.1806-0.1105-0.0773 ( 4114 PWs) bands (ev): -2.9085 -2.9085 -1.7707 -1.7707 -1.4153 -1.4153 -1.3907 -1.3907 -1.3462 -1.3462 -1.2512 -1.2512 0.5854 0.5854 0.7020 0.7020 0.7088 0.7088 0.7912 0.7912 0.8689 0.8689 0.8882 0.8882 3.8664 3.8664 5.3171 5.3171 5.9005 5.9005 6.3487 6.3487 6.3971 6.3971 7.1038 7.1038 7.7019 7.7019 8.1475 8.1475 8.8257 8.8257 8.9209 8.9209 9.0164 9.0164 9.2144 9.2144 9.4450 9.4450 9.5401 9.5401 9.6280 9.6280 9.7204 9.7204 9.9456 9.9456 9.9881 9.9881 10.0807 10.0807 10.2960 10.2960 10.5072 10.5072 10.9413 10.9413 11.0677 11.0677 11.3789 11.3789 11.7686 11.7686 12.5629 12.5629 14.6950 14.6950 15.4327 15.4327 15.7451 15.7451 k = 0.1944-0.1190-0.0832 ( 4118 PWs) bands (ev): -2.8905 -2.8905 -1.7944 -1.7944 -1.4146 -1.4146 -1.3892 -1.3892 -1.3447 -1.3447 -1.2439 -1.2439 0.5919 0.5919 0.7043 0.7043 0.7122 0.7122 0.7910 0.7910 0.8681 0.8681 0.8902 0.8902 3.8561 3.8561 5.2481 5.2481 5.8997 5.8997 6.3563 6.3563 6.4215 6.4215 7.0954 7.0954 7.6642 7.6642 8.1544 8.1544 8.8098 8.8098 8.9182 8.9182 8.9988 8.9988 9.2029 9.2029 9.4441 9.4441 9.5264 9.5264 9.6337 9.6337 9.7096 9.7096 9.9453 9.9453 9.9857 9.9857 10.0863 10.0863 10.2910 10.2910 10.5282 10.5282 10.9579 10.9579 11.0718 11.0718 11.4440 11.4440 11.8130 11.8130 12.7077 12.7077 14.6378 14.6378 15.4067 15.4067 15.7718 15.7718 k = 0.2083-0.1275-0.0892 ( 4118 PWs) bands (ev): -2.8714 -2.8714 -1.8183 -1.8183 -1.4139 -1.4139 -1.3877 -1.3877 -1.3431 -1.3431 -1.2375 -1.2375 0.5984 0.5984 0.7066 0.7066 0.7158 0.7158 0.7908 0.7908 0.8674 0.8674 0.8924 0.8924 3.8459 3.8459 5.1775 5.1775 5.8991 5.8991 6.3630 6.3630 6.4515 6.4515 7.0854 7.0854 7.6250 7.6250 8.1595 8.1595 8.7919 8.7919 8.9142 8.9142 8.9839 8.9839 9.1863 9.1863 9.4422 9.4422 9.5192 9.5192 9.6393 9.6393 9.7034 9.7034 9.9451 9.9451 9.9833 9.9833 10.0921 10.0921 10.2849 10.2849 10.5499 10.5499 10.9740 10.9740 11.0766 11.0766 11.5122 11.5122 11.8571 11.8571 12.8531 12.8531 14.5812 14.5812 15.3766 15.3766 15.7929 15.7929 k = 0.2222-0.1360-0.0951 ( 4120 PWs) bands (ev): -2.8513 -2.8513 -1.8423 -1.8423 -1.4133 -1.4133 -1.3861 -1.3861 -1.3414 -1.3414 -1.2319 -1.2319 0.6048 0.6048 0.7089 0.7089 0.7197 0.7197 0.7907 0.7907 0.8666 0.8666 0.8947 0.8947 3.8360 3.8360 5.1061 5.1061 5.8988 5.8988 6.3695 6.3695 6.4857 6.4857 7.0739 7.0739 7.5847 7.5847 8.1629 8.1629 8.7723 8.7723 8.9088 8.9088 8.9716 8.9716 9.1662 9.1662 9.4352 9.4352 9.5186 9.5186 9.6454 9.6454 9.7026 9.7026 9.9450 9.9450 9.9806 9.9806 10.0980 10.0980 10.2778 10.2778 10.5723 10.5723 10.9895 10.9895 11.0822 11.0822 11.5829 11.5829 11.9006 11.9006 12.9975 12.9975 14.5266 14.5266 15.3437 15.3437 15.8069 15.8069 k = 0.2361-0.1445-0.1011 ( 4117 PWs) bands (ev): -2.8303 -2.8303 -1.8663 -1.8663 -1.4126 -1.4126 -1.3844 -1.3844 -1.3395 -1.3395 -1.2271 -1.2271 0.6111 0.6111 0.7112 0.7112 0.7236 0.7236 0.7905 0.7905 0.8659 0.8659 0.8970 0.8970 3.8264 3.8264 5.0345 5.0345 5.8989 5.8989 6.3763 6.3763 6.5236 6.5236 7.0612 7.0612 7.5434 7.5434 8.1645 8.1645 8.7515 8.7515 8.9022 8.9022 8.9616 8.9616 9.1441 9.1441 9.4242 9.4242 9.5202 9.5202 9.6528 9.6528 9.7079 9.7079 9.9448 9.9448 9.9779 9.9779 10.1037 10.1037 10.2703 10.2703 10.5955 10.5955 11.0044 11.0044 11.0891 11.0891 11.6554 11.6554 11.9429 11.9429 13.1395 13.1395 14.4756 14.4756 15.3089 15.3089 15.8128 15.8128 k = 0.2500-0.1530-0.1070 ( 4118 PWs) bands (ev): -2.8085 -2.8085 -1.8904 -1.8904 -1.4119 -1.4119 -1.3828 -1.3828 -1.3374 -1.3374 -1.2231 -1.2231 0.6171 0.6171 0.7135 0.7135 0.7276 0.7276 0.7905 0.7905 0.8652 0.8652 0.8992 0.8992 3.8173 3.8173 4.9633 4.9633 5.8992 5.8992 6.3837 6.3837 6.5646 6.5646 7.0475 7.0475 7.5015 7.5015 8.1642 8.1642 8.7300 8.7300 8.8946 8.8946 8.9532 8.9532 9.1211 9.1211 9.4118 9.4118 9.5194 9.5194 9.6615 9.6615 9.7196 9.7196 9.9444 9.9444 9.9749 9.9749 10.1091 10.1091 10.2623 10.2623 10.6194 10.6194 11.0189 11.0189 11.0974 11.0974 11.7290 11.7290 11.9837 11.9837 13.2774 13.2774 14.4299 14.4299 15.2728 15.2728 15.8102 15.8102 k = 0.2639-0.1615-0.1130 ( 4118 PWs) bands (ev): -2.7859 -2.7859 -1.9146 -1.9146 -1.4113 -1.4113 -1.3811 -1.3811 -1.3351 -1.3351 -1.2200 -1.2200 0.6230 0.6230 0.7158 0.7158 0.7316 0.7316 0.7906 0.7906 0.8645 0.8645 0.9013 0.9013 3.8089 3.8089 4.8930 4.8930 5.9000 5.9000 6.3917 6.3917 6.6081 6.6081 7.0332 7.0332 7.4591 7.4591 8.1621 8.1621 8.7079 8.7079 8.8865 8.8865 8.9455 8.9455 9.0979 9.0979 9.4000 9.4000 9.5144 9.5144 9.6705 9.6705 9.7374 9.7374 9.9439 9.9439 9.9717 9.9717 10.1140 10.1140 10.2543 10.2543 10.6439 10.6439 11.0330 11.0330 11.1074 11.1074 11.8026 11.8026 12.0230 12.0230 13.4089 13.4089 14.3913 14.3913 15.2359 15.2359 15.7997 15.7997 k = 0.2778-0.1700-0.1189 ( 4126 PWs) bands (ev): -2.7626 -2.7626 -1.9388 -1.9388 -1.4107 -1.4107 -1.3794 -1.3794 -1.3326 -1.3326 -1.2177 -1.2177 0.6286 0.6286 0.7180 0.7180 0.7355 0.7355 0.7908 0.7908 0.8638 0.8638 0.9033 0.9033 3.8011 3.8011 4.8239 4.8239 5.9012 5.9012 6.4004 6.4004 6.6534 6.6534 7.0190 7.0190 7.4165 7.4165 8.1582 8.1582 8.6857 8.6857 8.8782 8.8782 8.9381 8.9381 9.0746 9.0746 9.3894 9.3894 9.5059 9.5059 9.6788 9.6788 9.7598 9.7598 9.9432 9.9432 9.9684 9.9684 10.1182 10.1182 10.2463 10.2463 10.6686 10.6686 11.0469 11.0469 11.1196 11.1196 11.8744 11.8744 12.0616 12.0616 13.5315 13.5315 14.3618 14.3618 15.1987 15.1987 15.7825 15.7825 k = 0.2917-0.1785-0.1249 ( 4123 PWs) bands (ev): -2.7386 -2.7386 -1.9630 -1.9630 -1.4100 -1.4100 -1.3777 -1.3777 -1.3300 -1.3300 -1.2161 -1.2161 0.6341 0.6341 0.7201 0.7201 0.7393 0.7393 0.7912 0.7912 0.8632 0.8632 0.9051 0.9051 3.7942 3.7942 4.7566 4.7566 5.9028 5.9028 6.4101 6.4101 6.6994 6.6994 7.0060 7.0060 7.3739 7.3739 8.1524 8.1524 8.6634 8.6634 8.8698 8.8698 8.9306 8.9306 9.0519 9.0519 9.3807 9.3807 9.4950 9.4950 9.6861 9.6861 9.7848 9.7848 9.9422 9.9422 9.9650 9.9650 10.1217 10.1217 10.2387 10.2387 10.6934 10.6934 11.0606 11.0606 11.1344 11.1344 11.9411 11.9411 12.1021 12.1021 13.6420 13.6420 14.3435 14.3435 15.1618 15.1618 15.7607 15.7607 k = 0.3056-0.1870-0.1308 ( 4125 PWs) bands (ev): -2.7141 -2.7141 -1.9872 -1.9872 -1.4095 -1.4095 -1.3761 -1.3761 -1.3270 -1.3270 -1.2154 -1.2154 0.6393 0.6393 0.7220 0.7220 0.7429 0.7429 0.7919 0.7919 0.8627 0.8627 0.9067 0.9067 3.7881 3.7881 4.6914 4.6914 5.9049 5.9049 6.4206 6.4206 6.7443 6.7443 6.9960 6.9960 7.3315 7.3315 8.1449 8.1449 8.6411 8.6411 8.8614 8.8614 8.9226 8.9226 9.0299 9.0299 9.3737 9.3737 9.4826 9.4826 9.6928 9.6928 9.8103 9.8103 9.9411 9.9411 9.9615 9.9615 10.1242 10.1242 10.2316 10.2316 10.7174 10.7174 11.0740 11.0740 11.1524 11.1524 11.9971 11.9971 12.1492 12.1492 13.7366 13.7366 14.3380 14.3380 15.1260 15.1260 15.7366 15.7366 k = 0.3194-0.1955-0.1368 ( 4123 PWs) bands (ev): -2.6890 -2.6890 -2.0114 -2.0114 -1.4089 -1.4089 -1.3745 -1.3745 -1.3239 -1.3239 -1.2153 -1.2153 0.6443 0.6443 0.7237 0.7237 0.7463 0.7463 0.7928 0.7928 0.8624 0.8624 0.9079 0.9079 3.7831 3.7831 4.6286 4.6286 5.9073 5.9073 6.4320 6.4320 6.7845 6.7845 6.9927 6.9927 7.2894 7.2894 8.1354 8.1354 8.6188 8.6188 8.8531 8.8531 8.9139 8.9139 9.0090 9.0090 9.3685 9.3685 9.4697 9.4697 9.6989 9.6989 9.8350 9.8350 9.9400 9.9400 9.9582 9.9582 10.1256 10.1256 10.2254 10.2254 10.7403 10.7403 11.0868 11.0868 11.1741 11.1741 12.0376 12.0376 12.2071 12.2071 13.8120 13.8120 14.3462 14.3462 15.0922 15.0922 15.7130 15.7130 k = 0.3333-0.2040-0.1427 ( 4118 PWs) bands (ev): -2.6636 -2.6636 -2.0356 -2.0356 -1.4084 -1.4084 -1.3729 -1.3729 -1.3205 -1.3205 -1.2160 -1.2160 0.6492 0.6492 0.7252 0.7252 0.7494 0.7494 0.7941 0.7941 0.8622 0.8622 0.9087 0.9087 3.7790 3.7790 4.5685 4.5685 5.9101 5.9101 6.4443 6.4443 6.8142 6.8142 7.0020 7.0020 7.2480 7.2480 8.1240 8.1240 8.5964 8.5964 8.8449 8.8449 8.9043 8.9043 8.9898 8.9898 9.3648 9.3648 9.4569 9.4569 9.7045 9.7045 9.8577 9.8577 9.9392 9.9392 9.9549 9.9549 10.1259 10.1259 10.2202 10.2202 10.7615 10.7615 11.0988 11.0988 11.2000 11.2000 12.0634 12.0634 12.2747 12.2747 13.8670 13.8670 14.3661 14.3661 15.0619 15.0619 15.6925 15.6925 k = 0.3472-0.2125-0.1486 ( 4112 PWs) bands (ev): -2.6379 -2.6379 -2.0599 -2.0599 -1.4079 -1.4079 -1.3715 -1.3715 -1.3168 -1.3168 -1.2173 -1.2173 0.6538 0.6538 0.7262 0.7262 0.7524 0.7524 0.7956 0.7956 0.8622 0.8622 0.9092 0.9092 3.7761 3.7761 4.5114 4.5114 5.9133 5.9133 6.4575 6.4575 6.8285 6.8285 7.0285 7.0285 7.2074 7.2074 8.1105 8.1105 8.5739 8.5739 8.8368 8.8368 8.8937 8.8937 8.9726 8.9726 9.3624 9.3624 9.4448 9.4448 9.7094 9.7094 9.8773 9.8773 9.9391 9.9391 9.9519 9.9519 10.1251 10.1251 10.2161 10.2161 10.7804 10.7804 11.1099 11.1099 11.2302 11.2302 12.0785 12.0785 12.3478 12.3478 13.9033 13.9033 14.3920 14.3920 15.0367 15.0367 15.6779 15.6779 k = 0.3611-0.2210-0.1546 ( 4117 PWs) bands (ev): -2.6119 -2.6119 -2.0841 -2.0841 -1.4074 -1.4074 -1.3702 -1.3702 -1.3129 -1.3129 -1.2192 -1.2192 0.6583 0.6583 0.7269 0.7269 0.7551 0.7551 0.7973 0.7973 0.8625 0.8625 0.9092 0.9092 3.7741 3.7741 4.4576 4.4576 5.9166 5.9166 6.4715 6.4715 6.8292 6.8292 7.0702 7.0702 7.1683 7.1683 8.0945 8.0945 8.5513 8.5513 8.8287 8.8287 8.8820 8.8820 8.9579 8.9579 9.3606 9.3606 9.4337 9.4337 9.7139 9.7139 9.8926 9.8926 9.9400 9.9400 9.9499 9.9499 10.1232 10.1232 10.2130 10.2130 10.7968 10.7968 11.1199 11.1199 11.2643 11.2643 12.0863 12.0863 12.4230 12.4230 13.9250 13.9250 14.4161 14.4161 15.0187 15.0187 15.6712 15.6712 k = 0.3750-0.2295-0.1605 ( 4123 PWs) bands (ev): -2.5857 -2.5857 -2.1084 -2.1084 -1.4070 -1.4070 -1.3690 -1.3690 -1.3087 -1.3087 -1.2218 -1.2218 0.6625 0.6625 0.7272 0.7272 0.7576 0.7576 0.7992 0.7992 0.8631 0.8631 0.9087 0.9087 3.7733 3.7733 4.4073 4.4073 5.9201 5.9201 6.4863 6.4863 6.8222 6.8222 7.1134 7.1134 7.1388 7.1388 8.0758 8.0758 8.5289 8.5289 8.8205 8.8205 8.8698 8.8698 8.9458 8.9458 9.3591 9.3591 9.4242 9.4242 9.7178 9.7178 9.9023 9.9023 9.9405 9.9405 9.9516 9.9516 10.1205 10.1205 10.2109 10.2109 10.8108 10.8108 11.1289 11.1289 11.3014 11.3014 12.0889 12.0889 12.4980 12.4980 13.9362 13.9362 14.4313 14.4313 15.0093 15.0093 15.6738 15.6738 k = 0.3889-0.2380-0.1665 ( 4125 PWs) bands (ev): -2.5595 -2.5595 -2.1327 -2.1327 -1.4066 -1.4066 -1.3678 -1.3678 -1.3043 -1.3043 -1.2248 -1.2248 0.6665 0.6665 0.7271 0.7271 0.7599 0.7599 0.8010 0.8010 0.8641 0.8641 0.9078 0.9078 3.7735 3.7735 4.3608 4.3608 5.9236 5.9236 6.5017 6.5017 6.8116 6.8116 7.0890 7.0890 7.1838 7.1838 8.0541 8.0541 8.5070 8.5070 8.8123 8.8123 8.8577 8.8577 8.9362 8.9362 9.3574 9.3574 9.4169 9.4169 9.7211 9.7211 9.9071 9.9071 9.9386 9.9386 9.9585 9.9585 10.1173 10.1173 10.2096 10.2096 10.8225 10.8225 11.1369 11.1369 11.3404 11.3404 12.0880 12.0880 12.5710 12.5710 13.9404 13.9404 14.4336 14.4336 15.0090 15.0090 15.6855 15.6855 k = 0.4028-0.2465-0.1724 ( 4123 PWs) bands (ev): -2.5333 -2.5333 -2.1570 -2.1570 -1.4062 -1.4062 -1.3668 -1.3668 -1.2996 -1.2996 -1.2284 -1.2284 0.6703 0.6703 0.7266 0.7266 0.7621 0.7621 0.8028 0.8028 0.8655 0.8655 0.9064 0.9064 3.7746 3.7746 4.3184 4.3184 5.9272 5.9272 6.5176 6.5176 6.7998 6.7998 7.0543 7.0543 7.2439 7.2439 8.0289 8.0289 8.4859 8.4859 8.8039 8.8039 8.8465 8.8465 8.9287 8.9287 9.3550 9.3550 9.4120 9.4120 9.7238 9.7238 9.9089 9.9089 9.9358 9.9358 9.9676 9.9676 10.1138 10.1138 10.2090 10.2090 10.8320 10.8320 11.1439 11.1439 11.3800 11.3800 12.0846 12.0846 12.6407 12.6407 13.9401 13.9401 14.4224 14.4224 15.0168 15.0168 15.7052 15.7052 k = 0.4167-0.2550-0.1784 ( 4127 PWs) bands (ev): -2.5073 -2.5073 -2.1812 -2.1812 -1.4059 -1.4059 -1.3660 -1.3660 -1.2947 -1.2947 -1.2323 -1.2323 0.6738 0.6738 0.7259 0.7259 0.7642 0.7642 0.8044 0.8044 0.8673 0.8673 0.9045 0.9045 3.7765 3.7765 4.2805 4.2805 5.9305 5.9305 6.5335 6.5335 6.7883 6.7883 7.0212 7.0212 7.3061 7.3061 7.9999 7.9999 8.4662 8.4662 8.7957 8.7957 8.8368 8.8368 8.9227 8.9227 9.3520 9.3520 9.4092 9.4092 9.7260 9.7260 9.9093 9.9093 9.9327 9.9327 9.9765 9.9765 10.1102 10.1102 10.2088 10.2088 10.8396 10.8396 11.1499 11.1499 11.4186 11.4186 12.0799 12.0799 12.7055 12.7055 13.9375 13.9375 14.4000 14.4000 15.0304 15.0304 15.7305 15.7305 k = 0.4306-0.2635-0.1843 ( 4127 PWs) bands (ev): -2.4815 -2.4815 -2.2052 -2.2052 -1.4057 -1.4057 -1.3652 -1.3652 -1.2897 -1.2897 -1.2367 -1.2367 0.6771 0.6771 0.7249 0.7249 0.7660 0.7660 0.8057 0.8057 0.8696 0.8696 0.9022 0.9022 3.7789 3.7789 4.2473 4.2473 5.9336 5.9336 6.5492 6.5492 6.7778 6.7778 6.9905 6.9905 7.3687 7.3687 7.9671 7.9671 8.4485 8.4485 8.7878 8.7878 8.8288 8.8288 8.9181 8.9181 9.3485 9.3485 9.4082 9.4082 9.7277 9.7277 9.9094 9.9094 9.9296 9.9296 9.9845 9.9845 10.1069 10.1069 10.2089 10.2089 10.8457 10.8457 11.1550 11.1550 11.4547 11.4547 12.0747 12.0747 12.7639 12.7639 13.9344 13.9344 14.3700 14.3700 15.0473 15.0473 15.7585 15.7585 k = 0.4444-0.2720-0.1903 ( 4128 PWs) bands (ev): -2.4564 -2.4564 -2.2289 -2.2289 -1.4055 -1.4055 -1.3646 -1.3646 -1.2845 -1.2845 -1.2413 -1.2413 0.6799 0.6799 0.7239 0.7239 0.7676 0.7676 0.8067 0.8067 0.8724 0.8724 0.8995 0.8995 3.7817 3.7817 4.2192 4.2192 5.9363 5.9363 6.5640 6.5640 6.7688 6.7688 6.9631 6.9631 7.4303 7.4303 7.9307 7.9307 8.4333 8.4333 8.7807 8.7807 8.8225 8.8225 8.9146 8.9146 9.3450 9.3450 9.4083 9.4083 9.7289 9.7289 9.9097 9.9097 9.9264 9.9264 9.9911 9.9911 10.1039 10.1039 10.2092 10.2092 10.8503 10.8503 11.1591 11.1591 11.4867 11.4867 12.0695 12.0695 12.8145 12.8145 13.9322 13.9322 14.3364 14.3364 15.0650 15.0650 15.7860 15.7860 k = 0.4583-0.2805-0.1962 ( 4131 PWs) bands (ev): -2.4322 -2.4322 -2.2519 -2.2519 -1.4053 -1.4053 -1.3642 -1.3642 -1.2793 -1.2793 -1.2462 -1.2462 0.6823 0.6823 0.7229 0.7229 0.7689 0.7689 0.8075 0.8075 0.8754 0.8754 0.8964 0.8964 3.7844 3.7844 4.1967 4.1967 5.9386 5.9386 6.5771 6.5771 6.7618 6.7618 6.9398 6.9398 7.4894 7.4894 7.8918 7.8918 8.4211 8.4211 8.7748 8.7748 8.8178 8.8178 8.9121 8.9121 9.3420 9.3420 9.4090 9.4090 9.7297 9.7297 9.9103 9.9103 9.9233 9.9233 9.9962 9.9962 10.1014 10.1014 10.2094 10.2094 10.8538 10.8538 11.1622 11.1622 11.5133 11.5133 12.0650 12.0650 12.8556 12.8556 13.9317 13.9317 14.3032 14.3032 15.0813 15.0813 15.8103 15.8103 k = 0.4722-0.2890-0.2022 ( 4129 PWs) bands (ev): -2.4102 -2.4102 -2.2730 -2.2730 -1.4052 -1.4052 -1.3638 -1.3638 -1.2740 -1.2740 -1.2512 -1.2512 0.6841 0.6841 0.7220 0.7220 0.7698 0.7698 0.8080 0.8080 0.8788 0.8788 0.8932 0.8932 3.7867 3.7867 4.1802 4.1802 5.9402 5.9402 6.5876 6.5876 6.7568 6.7568 6.9217 6.9217 7.5429 7.5429 7.8529 7.8529 8.4122 8.4122 8.7704 8.7704 8.8146 8.8146 8.9103 8.9103 9.3396 9.3396 9.4097 9.4097 9.7302 9.7302 9.9114 9.9114 9.9205 9.9205 9.9999 9.9999 10.0996 10.0996 10.2097 10.2097 10.8561 10.8561 11.1645 11.1645 11.5333 11.5333 12.0616 12.0616 12.8859 12.8859 13.9330 13.9330 14.2749 14.2749 15.0944 15.0944 15.8293 15.8293 k = 0.4861-0.2975-0.2081 ( 4131 PWs) bands (ev): -2.3927 -2.3927 -2.2900 -2.2900 -1.4051 -1.4051 -1.3636 -1.3636 -1.2690 -1.2690 -1.2560 -1.2560 0.6853 0.6853 0.7214 0.7214 0.7704 0.7704 0.8083 0.8083 0.8823 0.8823 0.8897 0.8897 3.7882 3.7882 4.1702 4.1702 5.9413 5.9413 6.5944 6.5944 6.7540 6.7540 6.9102 6.9102 7.5846 7.5846 7.8200 7.8200 8.4068 8.4068 8.7677 8.7677 8.8127 8.8127 8.9093 8.9093 9.3381 9.3381 9.4103 9.4103 9.7305 9.7305 9.9130 9.9130 9.9178 9.9178 10.0022 10.0022 10.0984 10.0984 10.2099 10.2099 10.8575 10.8575 11.1659 11.1659 11.5457 11.5457 12.0594 12.0594 12.9046 12.9046 13.9348 13.9348 14.2555 14.2555 15.1029 15.1029 15.8413 15.8413 k = 0.5000-0.3060-0.2141 ( 4126 PWs) bands (ev): -2.3854 -2.3854 -2.2971 -2.2971 -1.4051 -1.4051 -1.3636 -1.3636 -1.2660 -1.2660 -1.2589 -1.2589 0.6857 0.6857 0.7212 0.7212 0.7706 0.7706 0.8084 0.8084 0.8853 0.8853 0.8867 0.8867 3.7888 3.7888 4.1668 4.1668 5.9416 5.9416 6.5968 6.5968 6.7530 6.7530 6.9062 6.9062 7.6017 7.6017 7.8059 7.8059 8.4050 8.4050 8.7668 8.7668 8.8120 8.8120 8.9090 8.9090 9.3377 9.3377 9.4105 9.4105 9.7306 9.7306 9.9142 9.9142 9.9162 9.9162 10.0029 10.0029 10.0980 10.0980 10.2099 10.2099 10.8580 10.8580 11.1664 11.1664 11.5499 11.5499 12.0586 12.0586 12.9109 12.9109 13.9357 13.9357 14.2486 14.2486 15.1058 15.1058 15.8454 15.8454 k = 0.5000-0.3060-0.2141 ( 4126 PWs) bands (ev): -2.3854 -2.3854 -2.2971 -2.2971 -1.4051 -1.4051 -1.3636 -1.3636 -1.2660 -1.2660 -1.2589 -1.2589 0.6857 0.6857 0.7212 0.7212 0.7706 0.7706 0.8084 0.8084 0.8853 0.8853 0.8867 0.8867 3.7888 3.7888 4.1668 4.1668 5.9416 5.9416 6.5968 6.5968 6.7530 6.7530 6.9062 6.9062 7.6017 7.6017 7.8059 7.8059 8.4050 8.4050 8.7668 8.7668 8.8120 8.8120 8.9090 8.9090 9.3377 9.3377 9.4105 9.4105 9.7306 9.7306 9.9142 9.9142 9.9162 9.9162 10.0029 10.0029 10.0980 10.0980 10.2099 10.2099 10.8580 10.8580 11.1664 11.1664 11.5499 11.5499 12.0586 12.0586 12.9109 12.9109 13.9357 13.9357 14.2486 14.2486 15.1058 15.1058 15.8454 15.8454 k = 0.5000-0.2962-0.2282 ( 4128 PWs) bands (ev): -2.3853 -2.3853 -2.2970 -2.2970 -1.4051 -1.4051 -1.3635 -1.3635 -1.2668 -1.2668 -1.2581 -1.2581 0.6857 0.6857 0.7212 0.7212 0.7707 0.7707 0.8085 0.8085 0.8832 0.8832 0.8888 0.8888 3.7878 3.7878 4.1658 4.1658 5.9385 5.9385 6.6028 6.6028 6.7415 6.7415 6.9183 6.9183 7.6018 7.6018 7.8050 7.8050 8.4053 8.4053 8.7540 8.7540 8.8226 8.8226 8.9102 8.9102 9.3309 9.3309 9.4174 9.4174 9.7301 9.7301 9.9098 9.9098 9.9190 9.9190 10.0027 10.0027 10.0988 10.0988 10.2101 10.2101 10.8533 10.8533 11.1689 11.1689 11.5475 11.5475 12.0613 12.0613 12.9138 12.9138 13.9323 13.9323 14.2541 14.2541 15.1104 15.1104 15.8458 15.8458 k = 0.5000-0.2863-0.2423 ( 4130 PWs) bands (ev): -2.3850 -2.3850 -2.2967 -2.2967 -1.4050 -1.4050 -1.3633 -1.3633 -1.2684 -1.2684 -1.2562 -1.2562 0.6860 0.6860 0.7212 0.7212 0.7708 0.7708 0.8087 0.8087 0.8806 0.8806 0.8916 0.8916 3.7848 3.7848 4.1628 4.1628 5.9297 5.9297 6.6198 6.6198 6.7148 6.7148 6.9474 6.9474 7.6021 7.6021 7.8024 7.8024 8.4062 8.4062 8.7290 8.7290 8.8410 8.8410 8.9139 8.9139 9.3153 9.3153 9.4332 9.4332 9.7287 9.7287 9.9026 9.9026 9.9214 9.9214 10.0021 10.0021 10.1011 10.1011 10.2104 10.2104 10.8403 10.8403 11.1752 11.1752 11.5403 11.5403 12.0697 12.0697 12.9225 12.9225 13.9228 13.9228 14.2697 14.2697 15.1241 15.1241 15.8470 15.8470 k = 0.5000-0.2764-0.2565 ( 4130 PWs) bands (ev): -2.3845 -2.3845 -2.2963 -2.2963 -1.4050 -1.4050 -1.3629 -1.3629 -1.2703 -1.2703 -1.2538 -1.2538 0.6864 0.6864 0.7212 0.7212 0.7711 0.7711 0.8090 0.8090 0.8780 0.8780 0.8943 0.8943 3.7799 3.7799 4.1578 4.1578 5.9164 5.9164 6.6423 6.6423 6.6867 6.6867 6.9838 6.9838 7.6025 7.6025 7.7981 7.7981 8.4076 8.4076 8.7002 8.7002 8.8592 8.8592 8.9200 8.9200 9.2963 9.2963 9.4527 9.4527 9.7264 9.7264 9.8932 9.8932 9.9230 9.9230 10.0014 10.0014 10.1045 10.1045 10.2111 10.2111 10.8211 10.8211 11.1825 11.1825 11.5284 11.5284 12.0850 12.0850 12.9362 12.9362 13.9081 13.9081 14.2942 14.2942 15.1467 15.1467 15.8494 15.8494 k = 0.5000-0.2665-0.2706 ( 4136 PWs) bands (ev): -2.3837 -2.3837 -2.2956 -2.2956 -1.4049 -1.4049 -1.3624 -1.3624 -1.2723 -1.2723 -1.2512 -1.2512 0.6869 0.6869 0.7212 0.7212 0.7714 0.7714 0.8094 0.8094 0.8754 0.8754 0.8971 0.8971 3.7731 3.7731 4.1509 4.1509 5.9002 5.9002 6.6332 6.6332 6.6972 6.6972 7.0227 7.0227 7.6030 7.6030 7.7923 7.7923 8.4094 8.4094 8.6696 8.6696 8.8756 8.8756 8.9283 8.9283 9.2762 9.2762 9.4734 9.4734 9.7232 9.7232 9.8816 9.8816 9.9239 9.9239 10.0004 10.0004 10.1088 10.1088 10.2122 10.2122 10.7981 10.7981 11.1877 11.1877 11.5123 11.5123 12.1089 12.1089 12.9541 12.9541 13.8895 13.8895 14.3257 14.3257 15.1779 15.1779 15.8533 15.8533 k = 0.5000-0.2566-0.2848 ( 4130 PWs) bands (ev): -2.3828 -2.3828 -2.2949 -2.2949 -1.4048 -1.4048 -1.3618 -1.3618 -1.2743 -1.2743 -1.2484 -1.2484 0.6875 0.6875 0.7211 0.7211 0.7720 0.7720 0.8099 0.8099 0.8729 0.8729 0.8998 0.8998 3.7645 3.7645 4.1419 4.1419 5.8827 5.8827 6.6001 6.6001 6.7388 6.7388 7.0620 7.0620 7.6036 7.6036 7.7851 7.7851 8.4114 8.4114 8.6381 8.6381 8.8905 8.8905 8.9382 8.9382 9.2560 9.2560 9.4945 9.4945 9.7192 9.7192 9.8680 9.8680 9.9245 9.9245 9.9995 9.9995 10.1135 10.1135 10.2136 10.2136 10.7733 10.7733 11.1885 11.1885 11.4924 11.4924 12.1429 12.1429 12.9752 12.9752 13.8679 13.8679 14.3627 14.3627 15.2172 15.2172 15.8591 15.8591 k = 0.5000-0.2467-0.2989 ( 4130 PWs) bands (ev): -2.3816 -2.3816 -2.2939 -2.2939 -1.4047 -1.4047 -1.3611 -1.3611 -1.2762 -1.2762 -1.2456 -1.2456 0.6883 0.6883 0.7211 0.7211 0.7727 0.7727 0.8105 0.8105 0.8706 0.8706 0.9025 0.9025 3.7544 3.7544 4.1308 4.1308 5.8652 5.8652 6.5656 6.5656 6.7886 6.7886 7.1003 7.1003 7.6042 7.6042 7.7767 7.7767 8.4133 8.4133 8.6064 8.6064 8.9043 8.9043 8.9490 8.9490 9.2362 9.2362 9.5155 9.5155 9.7145 9.7145 9.8525 9.8525 9.9249 9.9249 9.9984 9.9984 10.1183 10.1183 10.2154 10.2154 10.7482 10.7482 11.1835 11.1835 11.4693 11.4693 12.1878 12.1878 12.9983 12.9983 13.8436 13.8436 14.4039 14.4039 15.2641 15.2641 15.8674 15.8674 k = 0.5000-0.2368-0.3130 ( 4132 PWs) bands (ev): -2.3803 -2.3803 -2.2929 -2.2929 -1.4046 -1.4046 -1.3602 -1.3602 -1.2780 -1.2780 -1.2426 -1.2426 0.6892 0.6892 0.7210 0.7210 0.7736 0.7736 0.8112 0.8112 0.8683 0.8683 0.9052 0.9052 3.7427 3.7427 4.1178 4.1178 5.8489 5.8489 6.5322 6.5322 6.8429 6.8429 7.1366 7.1366 7.6049 7.6049 7.7675 7.7675 8.4146 8.4146 8.5753 8.5753 8.9173 8.9173 8.9603 8.9603 9.2171 9.2171 9.5358 9.5358 9.7092 9.7092 9.8354 9.8354 9.9252 9.9252 9.9971 9.9971 10.1229 10.1229 10.2176 10.2176 10.7235 10.7235 11.1726 11.1726 11.4435 11.4435 12.2438 12.2438 13.0227 13.0227 13.8171 13.8171 14.4481 14.4481 15.3176 15.3176 15.8787 15.8787 k = 0.5000-0.2269-0.3272 ( 4132 PWs) bands (ev): -2.3787 -2.3787 -2.2918 -2.2918 -1.4044 -1.4044 -1.3593 -1.3593 -1.2797 -1.2797 -1.2396 -1.2396 0.6901 0.6901 0.7209 0.7209 0.7748 0.7748 0.8118 0.8118 0.8661 0.8661 0.9077 0.9077 3.7297 3.7297 4.1026 4.1026 5.8346 5.8346 6.5008 6.5008 6.9004 6.9004 7.1701 7.1701 7.6053 7.6053 7.7579 7.7579 8.4145 8.4145 8.5458 8.5458 8.9295 8.9295 8.9725 8.9725 9.1991 9.1991 9.5551 9.5551 9.7036 9.7036 9.8170 9.8170 9.9254 9.9254 9.9957 9.9957 10.1271 10.1271 10.2202 10.2202 10.7000 10.7000 11.1563 11.1563 11.4157 11.4157 12.3104 12.3104 13.0475 13.0475 13.7884 13.7884 14.4944 14.4944 15.3768 15.3768 15.8934 15.8934 k = 0.5000-0.2170-0.3413 ( 4126 PWs) bands (ev): -2.3770 -2.3770 -2.2906 -2.2906 -1.4042 -1.4042 -1.3583 -1.3583 -1.2814 -1.2814 -1.2365 -1.2365 0.6911 0.6911 0.7207 0.7207 0.7761 0.7761 0.8125 0.8125 0.8641 0.8641 0.9102 0.9102 3.7157 3.7157 4.0855 4.0855 5.8228 5.8228 6.4717 6.4717 6.9597 6.9597 7.2000 7.2000 7.6056 7.6056 7.7485 7.7485 8.4114 8.4114 8.5197 8.5197 8.9401 8.9401 8.9863 8.9863 9.1825 9.1825 9.5729 9.5729 9.6980 9.6980 9.7979 9.7979 9.9257 9.9257 9.9938 9.9938 10.1308 10.1308 10.2232 10.2232 10.6779 10.6779 11.1361 11.1361 11.3865 11.3865 12.3866 12.3866 13.0723 13.0723 13.7576 13.7576 14.5420 14.5420 15.4400 15.4400 15.9121 15.9121 k = 0.5000-0.2071-0.3554 ( 4122 PWs) bands (ev): -2.3750 -2.3750 -2.2895 -2.2895 -1.4040 -1.4040 -1.3573 -1.3573 -1.2829 -1.2829 -1.2333 -1.2333 0.6921 0.6921 0.7206 0.7206 0.7777 0.7777 0.8132 0.8132 0.8622 0.8622 0.9126 0.9126 3.7009 3.7009 4.0664 4.0664 5.8141 5.8141 6.4451 6.4451 7.0199 7.0199 7.2251 7.2251 7.6056 7.6056 7.7402 7.7402 8.4032 8.4032 8.4993 8.4993 8.9481 8.9481 9.0025 9.0025 9.1676 9.1676 9.5880 9.5880 9.6929 9.6929 9.7784 9.7784 9.9261 9.9261 9.9914 9.9914 10.1342 10.1342 10.2265 10.2265 10.6572 10.6572 11.1131 11.1131 11.3565 11.3565 12.4709 12.4709 13.0967 13.0967 13.7251 13.7251 14.5903 14.5903 15.5055 15.5055 15.9352 15.9352 k = 0.5000-0.1973-0.3696 ( 4114 PWs) bands (ev): -2.3729 -2.3729 -2.2883 -2.2883 -1.4037 -1.4037 -1.3562 -1.3562 -1.2844 -1.2844 -1.2302 -1.2302 0.6931 0.6931 0.7205 0.7205 0.7796 0.7796 0.8139 0.8139 0.8604 0.8604 0.9149 0.9149 3.6854 3.6854 4.0453 4.0453 5.8086 5.8086 6.4212 6.4212 7.0801 7.0801 7.2448 7.2448 7.6053 7.6053 7.7338 7.7338 8.3881 8.3881 8.4866 8.4866 8.9533 8.9533 9.0217 9.0217 9.1547 9.1547 9.5989 9.5989 9.6896 9.6896 9.7595 9.7595 9.9267 9.9267 9.9884 9.9884 10.1370 10.1370 10.2299 10.2299 10.6379 10.6379 11.0889 11.0889 11.3263 11.3263 12.5620 12.5620 13.1206 13.1206 13.6911 13.6911 14.6388 14.6388 15.5707 15.5707 15.9632 15.9632 k = 0.5000-0.1874-0.3837 ( 4114 PWs) bands (ev): -2.3706 -2.3706 -2.2871 -2.2871 -1.4034 -1.4034 -1.3551 -1.3551 -1.2857 -1.2857 -1.2270 -1.2270 0.6941 0.6941 0.7204 0.7204 0.7816 0.7816 0.8146 0.8146 0.8587 0.8587 0.9170 0.9170 3.6696 3.6696 4.0224 4.0224 5.8066 5.8066 6.4001 6.4001 7.1394 7.1394 7.2580 7.2580 7.6047 7.6047 7.7301 7.7301 8.3671 8.3671 8.4806 8.4806 8.9558 8.9558 9.0429 9.0429 9.1447 9.1447 9.6032 9.6032 9.6893 9.6893 9.7422 9.7422 9.9275 9.9275 9.9846 9.9846 10.1395 10.1395 10.2334 10.2334 10.6197 10.6197 11.0649 11.0649 11.2964 11.2964 12.6578 12.6578 13.1440 13.1440 13.6562 13.6562 14.6874 14.6874 15.6326 15.6326 15.9965 15.9965 k = 0.5000-0.1775-0.3979 ( 4120 PWs) bands (ev): -2.3681 -2.3681 -2.2860 -2.2860 -1.4031 -1.4031 -1.3541 -1.3541 -1.2870 -1.2870 -1.2238 -1.2238 0.6949 0.6949 0.7205 0.7205 0.7838 0.7838 0.8152 0.8152 0.8572 0.8572 0.9190 0.9190 3.6538 3.6538 3.9976 3.9976 5.8080 5.8080 6.3818 6.3818 7.1969 7.1969 7.2645 7.2645 7.6039 7.6039 7.7298 7.7298 8.3428 8.3428 8.4788 8.4788 8.9558 8.9558 9.0644 9.0644 9.1394 9.1394 9.5995 9.5995 9.6913 9.6913 9.7290 9.7290 9.9286 9.9286 9.9798 9.9798 10.1417 10.1417 10.2371 10.2371 10.6023 10.6023 11.0423 11.0423 11.2671 11.2671 12.7562 12.7562 13.1675 13.1675 13.6215 13.6215 14.7357 14.7357 15.6878 15.6878 16.0354 16.0354 k = 0.5000-0.1676-0.4120 ( 4120 PWs) bands (ev): -2.3654 -2.3654 -2.2851 -2.2851 -1.4028 -1.4028 -1.3530 -1.3530 -1.2881 -1.2881 -1.2206 -1.2206 0.6956 0.6956 0.7207 0.7207 0.7861 0.7861 0.8157 0.8157 0.8558 0.8558 0.9209 0.9209 3.6383 3.6383 3.9713 3.9713 5.8130 5.8130 6.3661 6.3661 7.2494 7.2494 7.2664 7.2664 7.6032 7.6032 7.7332 7.7332 8.3171 8.3171 8.4794 8.4794 8.9537 8.9537 9.0817 9.0817 9.1431 9.1431 9.5885 9.5885 9.6904 9.6904 9.7245 9.7245 9.9301 9.9301 9.9741 9.9741 10.1437 10.1437 10.2407 10.2407 10.5853 10.5853 11.0220 11.0220 11.2391 11.2391 12.8540 12.8540 13.1917 13.1917 13.5889 13.5889 14.7839 14.7839 15.7331 15.7331 16.0789 16.0789 k = 0.5000-0.1577-0.4261 ( 4122 PWs) bands (ev): -2.3626 -2.3626 -2.2843 -2.2843 -1.4025 -1.4025 -1.3520 -1.3520 -1.2892 -1.2892 -1.2174 -1.2174 0.6962 0.6962 0.7211 0.7211 0.7885 0.7885 0.8162 0.8162 0.8547 0.8547 0.9226 0.9226 3.6232 3.6232 3.9434 3.9434 5.8215 5.8215 6.3528 6.3528 7.2550 7.2550 7.3049 7.3049 7.6032 7.6032 7.7402 7.7402 8.2913 8.2913 8.4813 8.4813 8.9499 8.9499 9.0900 9.0900 9.1602 9.1602 9.5721 9.5721 9.6835 9.6835 9.7304 9.7304 9.9321 9.9321 9.9674 9.9674 10.1457 10.1457 10.2443 10.2443 10.5682 10.5682 11.0050 11.0050 11.2126 11.2126 12.9461 12.9461 13.2173 13.2173 13.5622 13.5622 14.8318 14.8318 15.7664 15.7664 16.1244 16.1244 k = 0.5000-0.1478-0.4403 ( 4120 PWs) bands (ev): -2.3596 -2.3596 -2.2837 -2.2837 -1.4021 -1.4021 -1.3511 -1.3511 -1.2902 -1.2902 -1.2142 -1.2142 0.6966 0.6966 0.7216 0.7216 0.7909 0.7909 0.8165 0.8165 0.8537 0.8537 0.9241 0.9241 3.6091 3.6091 3.9142 3.9142 5.8334 5.8334 6.3417 6.3417 7.2429 7.2429 7.3504 7.3504 7.6048 7.6048 7.7502 7.7502 8.2657 8.2657 8.4842 8.4842 8.9444 8.9444 9.0921 9.0921 9.1877 9.1877 9.5522 9.5522 9.6746 9.6746 9.7408 9.7408 9.9345 9.9345 9.9598 9.9598 10.1476 10.1476 10.2480 10.2480 10.5507 10.5507 10.9919 10.9919 11.1879 11.1879 13.0253 13.0253 13.2436 13.2436 13.5489 13.5489 14.8797 14.8797 15.7869 15.7869 16.1674 16.1674 k = 0.5000-0.1379-0.4544 ( 4128 PWs) bands (ev): -2.3565 -2.3565 -2.2833 -2.2833 -1.4017 -1.4017 -1.3503 -1.3503 -1.2911 -1.2911 -1.2112 -1.2112 0.6968 0.6968 0.7223 0.7223 0.7934 0.7934 0.8168 0.8168 0.8529 0.8529 0.9255 0.9255 3.5960 3.5960 3.8839 3.8839 5.8486 5.8486 6.3325 6.3325 7.2262 7.2262 7.3888 7.3888 7.6096 7.6096 7.7625 7.7625 8.2406 8.2406 8.4877 8.4877 8.9374 8.9374 9.0927 9.0927 9.2203 9.2203 9.5301 9.5301 9.6659 9.6659 9.7524 9.7524 9.9369 9.9369 9.9519 9.9519 10.1497 10.1497 10.2516 10.2516 10.5326 10.5326 10.9828 10.9828 11.1654 11.1654 13.0850 13.0850 13.2637 13.2637 13.5623 13.5623 14.9275 14.9275 15.7947 15.7947 16.2022 16.2022 k = 0.5000-0.1280-0.4686 ( 4132 PWs) bands (ev): -2.3532 -2.3532 -2.2831 -2.2831 -1.4013 -1.4013 -1.3495 -1.3495 -1.2919 -1.2919 -1.2082 -1.2082 0.6969 0.6969 0.7233 0.7233 0.7958 0.7958 0.8170 0.8170 0.8524 0.8524 0.9266 0.9266 3.5842 3.5842 3.8526 3.8526 5.8670 5.8670 6.3247 6.3247 7.2065 7.2065 7.4174 7.4174 7.6199 7.6199 7.7763 7.7763 8.2162 8.2162 8.4920 8.4920 8.9290 8.9290 9.0941 9.0941 9.2553 9.2553 9.5069 9.5069 9.6579 9.6579 9.7638 9.7638 9.9358 9.9358 9.9475 9.9475 10.1519 10.1519 10.2553 10.2553 10.5136 10.5136 10.9780 10.9780 11.1453 11.1453 13.1239 13.1239 13.2676 13.2676 13.6134 13.6134 14.9753 14.9753 15.7902 15.7902 16.2243 16.2243 k = 0.5000-0.1181-0.4827 ( 4124 PWs) bands (ev): -2.3498 -2.3498 -2.2833 -2.2833 -1.4008 -1.4008 -1.3489 -1.3489 -1.2926 -1.2926 -1.2052 -1.2052 0.6968 0.6968 0.7243 0.7243 0.7980 0.7980 0.8171 0.8171 0.8521 0.8521 0.9276 0.9276 3.5741 3.5741 3.8206 3.8206 5.8884 5.8884 6.3180 6.3180 7.1853 7.1853 7.4343 7.4343 7.6371 7.6371 7.7910 7.7910 8.1924 8.1924 8.4971 8.4971 8.9195 8.9195 9.0970 9.0970 9.2910 9.2910 9.4840 9.4840 9.6506 9.6506 9.7745 9.7745 9.9280 9.9280 9.9504 9.9504 10.1542 10.1542 10.2591 10.2591 10.4938 10.4938 10.9774 10.9774 11.1278 11.1278 13.1454 13.1454 13.2570 13.2570 13.6969 13.6969 15.0229 15.0229 15.7739 15.7739 16.2329 16.2329 k = 0.5000-0.1083-0.4968 ( 4124 PWs) bands (ev): -2.3463 -2.3463 -2.2837 -2.2837 -1.4004 -1.4004 -1.3483 -1.3483 -1.2933 -1.2933 -1.2024 -1.2024 0.6966 0.6966 0.7256 0.7256 0.7999 0.7999 0.8172 0.8172 0.8521 0.8521 0.9284 0.9284 3.5659 3.5659 3.7880 3.7880 5.9126 5.9126 6.3118 6.3118 7.1639 7.1639 7.4401 7.4401 7.6605 7.6605 7.8061 7.8061 8.1692 8.1692 8.5031 8.5031 8.9089 8.9089 9.1016 9.1016 9.3256 9.3256 9.4624 9.4624 9.6438 9.6438 9.7838 9.7838 9.9183 9.9183 9.9561 9.9561 10.1567 10.1567 10.2626 10.2626 10.4733 10.4733 10.9804 10.9804 11.1131 11.1131 13.1506 13.1506 13.2435 13.2435 13.7996 13.7996 15.0698 15.0698 15.7465 15.7465 16.2305 16.2305 k = 0.5000-0.0984-0.5110 ( 4122 PWs) bands (ev): -2.3426 -2.3426 -2.2845 -2.2845 -1.3998 -1.3998 -1.3479 -1.3479 -1.2939 -1.2939 -1.1998 -1.1998 0.6963 0.6963 0.7269 0.7269 0.8014 0.8014 0.8173 0.8173 0.8524 0.8524 0.9291 0.9291 3.5597 3.5597 3.7551 3.7551 5.9395 5.9395 6.3055 6.3055 7.1432 7.1432 7.4370 7.4370 7.6878 7.6878 7.8212 7.8212 8.1465 8.1465 8.5102 8.5102 8.8974 8.8974 9.1080 9.1080 9.3556 9.3556 9.4453 9.4453 9.6373 9.6373 9.7914 9.7914 9.9087 9.9087 9.9632 9.9632 10.1593 10.1593 10.2659 10.2659 10.4526 10.4526 10.9867 10.9867 11.1014 11.1014 13.1384 13.1384 13.2376 13.2376 13.9113 13.9113 15.1152 15.1152 15.7095 15.7095 16.2220 16.2220 k = 0.5000-0.0885-0.5251 ( 4124 PWs) bands (ev): -2.3389 -2.3389 -2.2856 -2.2856 -1.3993 -1.3993 -1.3477 -1.3477 -1.2945 -1.2945 -1.1972 -1.1972 0.6960 0.6960 0.7282 0.7282 0.8023 0.8023 0.8177 0.8177 0.8529 0.8529 0.9295 0.9295 3.5557 3.5557 3.7220 3.7220 5.9688 5.9688 6.2987 6.2987 7.1244 7.1244 7.4274 7.4274 7.7164 7.7164 7.8360 7.8360 8.1242 8.1242 8.5184 8.5184 8.8853 8.8853 9.1160 9.1160 9.3713 9.3713 9.4419 9.4419 9.6312 9.6312 9.7966 9.7966 9.9004 9.9004 9.9716 9.9716 10.1621 10.1621 10.2683 10.2683 10.4320 10.4320 10.9957 10.9957 11.0929 11.0929 13.1141 13.1141 13.2396 13.2396 14.0260 14.0260 15.1573 15.1573 15.6652 15.6652 16.2123 16.2123 k = 0.5000-0.0786-0.5393 ( 4124 PWs) bands (ev): -2.3352 -2.3352 -2.2871 -2.2871 -1.3987 -1.3987 -1.3475 -1.3475 -1.2951 -1.2951 -1.1949 -1.1949 0.6956 0.6956 0.7297 0.7297 0.8025 0.8025 0.8185 0.8185 0.8536 0.8536 0.9297 0.9297 3.5542 3.5542 3.6890 3.6890 6.0005 6.0005 6.2909 6.2909 7.1081 7.1081 7.4134 7.4134 7.7446 7.7446 7.8503 7.8503 8.1022 8.1022 8.5278 8.5278 8.8727 8.8727 9.1256 9.1256 9.3655 9.3655 9.4586 9.4586 9.6254 9.6254 9.7988 9.7988 9.8942 9.8942 9.9811 9.9811 10.1648 10.1648 10.2693 10.2693 10.4124 10.4124 11.0067 11.0067 11.0878 11.0878 13.0850 13.0850 13.2451 13.2451 14.1393 14.1393 15.1925 15.1925 15.6186 15.6186 16.2052 16.2052 k = 0.5000-0.0687-0.5534 ( 4122 PWs) bands (ev): -2.3314 -2.3314 -2.2890 -2.2890 -1.3982 -1.3982 -1.3475 -1.3475 -1.2957 -1.2957 -1.1927 -1.1927 0.6952 0.6952 0.7311 0.7311 0.8020 0.8020 0.8195 0.8195 0.8544 0.8544 0.9297 0.9297 3.5553 3.5553 3.6563 3.6563 6.0341 6.0341 6.2817 6.2817 7.0949 7.0949 7.3961 7.3961 7.7714 7.7714 7.8642 7.8642 8.0805 8.0805 8.5384 8.5384 8.8599 8.8599 9.1367 9.1367 9.3498 9.3498 9.4833 9.4833 9.6200 9.6200 9.7978 9.7978 9.8910 9.8910 9.9915 9.9915 10.1675 10.1675 10.2678 10.2678 10.3950 10.3950 11.0189 11.0189 11.0863 11.0863 13.0555 13.0555 13.2519 13.2519 14.2474 14.2474 15.2135 15.2135 15.5785 15.5785 16.2039 16.2039 k = 0.5000-0.0588-0.5675 ( 4118 PWs) bands (ev): -2.3276 -2.3276 -2.2911 -2.2911 -1.3975 -1.3975 -1.3476 -1.3476 -1.2963 -1.2963 -1.1907 -1.1907 0.6948 0.6948 0.7326 0.7326 0.8009 0.8009 0.8208 0.8208 0.8554 0.8554 0.9295 0.9295 3.5591 3.5591 3.6239 3.6239 6.0696 6.0696 6.2711 6.2711 7.0852 7.0852 7.3764 7.3764 7.7960 7.7960 7.8776 7.8776 8.0589 8.0589 8.5502 8.5502 8.8473 8.8473 9.1490 9.1490 9.3320 9.3320 9.5075 9.5075 9.6154 9.6154 9.7937 9.7937 9.8909 9.8909 10.0028 10.0028 10.1702 10.1702 10.2623 10.2623 10.3814 10.3814 11.0312 11.0312 11.0890 11.0890 13.0281 13.0281 13.2592 13.2592 14.3462 14.3462 15.2107 15.2107 15.5574 15.5574 16.2106 16.2106 k = 0.5000-0.0489-0.5817 ( 4124 PWs) bands (ev): -2.3239 -2.3239 -2.2934 -2.2934 -1.3969 -1.3969 -1.3478 -1.3478 -1.2969 -1.2969 -1.1890 -1.1890 0.6945 0.6945 0.7341 0.7341 0.7993 0.7993 0.8222 0.8222 0.8564 0.8564 0.9292 0.9292 3.5656 3.5656 3.5922 3.5922 6.1064 6.1064 6.2589 6.2589 7.0790 7.0790 7.3549 7.3549 7.8182 7.8182 7.8904 7.8904 8.0375 8.0375 8.5629 8.5629 8.8350 8.8350 9.1620 9.1620 9.3143 9.3143 9.5275 9.5275 9.6124 9.6124 9.7875 9.7875 9.8931 9.8931 10.0147 10.0147 10.1726 10.1726 10.2517 10.2517 10.3728 10.3728 11.0425 11.0425 11.0960 11.0960 13.0040 13.0040 13.2667 13.2667 14.4307 14.4307 15.1804 15.1804 15.5626 15.5626 16.2267 16.2267 k = 0.5000-0.0390-0.5958 ( 4126 PWs) bands (ev): -2.3206 -2.3206 -2.2958 -2.2958 -1.3962 -1.3962 -1.3482 -1.3482 -1.2976 -1.2976 -1.1874 -1.1874 0.6941 0.6941 0.7355 0.7355 0.7974 0.7974 0.8236 0.8236 0.8574 0.8574 0.9286 0.9286 3.5605 3.5605 3.5758 3.5758 6.1440 6.1440 6.2458 6.2458 7.0762 7.0762 7.3324 7.3324 7.8377 7.8377 7.9027 7.9027 8.0162 8.0162 8.5767 8.5767 8.8235 8.8235 9.1756 9.1756 9.2978 9.2978 9.5406 9.5406 9.6130 9.6130 9.7801 9.7801 9.8971 9.8971 10.0266 10.0266 10.1748 10.1748 10.2362 10.2362 10.3694 10.3694 11.0524 11.0524 11.1072 11.1072 12.9842 12.9842 13.2747 13.2747 14.4943 14.4943 15.1336 15.1336 15.5890 15.5890 16.2518 16.2518 k = 0.5000-0.0291-0.6099 ( 4120 PWs) bands (ev): -2.3181 -2.3181 -2.2978 -2.2978 -1.3956 -1.3956 -1.3486 -1.3486 -1.2983 -1.2983 -1.1861 -1.1861 0.6938 0.6938 0.7370 0.7370 0.7952 0.7952 0.8249 0.8249 0.8584 0.8584 0.9279 0.9279 3.5305 3.5305 3.5881 3.5881 6.1800 6.1800 6.2339 6.2339 7.0765 7.0765 7.3092 7.3092 7.8544 7.8544 7.9141 7.9141 7.9953 7.9953 8.5911 8.5911 8.8132 8.8132 9.1890 9.1890 9.2833 9.2833 9.5453 9.5453 9.6184 9.6184 9.7725 9.7725 9.9021 9.9021 10.0382 10.0382 10.1764 10.1764 10.2175 10.2175 10.3704 10.3704 11.0610 11.0610 11.1218 11.1218 12.9694 12.9694 13.2832 13.2832 14.5283 14.5283 15.0879 15.0879 15.6268 15.6268 16.2827 16.2827 k = 0.5000-0.0193-0.6241 ( 4118 PWs) bands (ev): -2.3171 -2.3171 -2.2987 -2.2987 -1.3949 -1.3949 -1.3491 -1.3491 -1.2992 -1.2992 -1.1851 -1.1851 0.6934 0.6934 0.7385 0.7385 0.7929 0.7929 0.8260 0.8260 0.8593 0.8593 0.9270 0.9270 3.5010 3.5010 3.6037 3.6037 6.1985 6.1985 6.2394 6.2394 7.0794 7.0794 7.2860 7.2860 7.8683 7.8683 7.9241 7.9241 7.9752 7.9752 8.6061 8.6061 8.8044 8.8044 9.2004 9.2004 9.2722 9.2722 9.5429 9.5429 9.6274 9.6274 9.7651 9.7651 9.9077 9.9077 10.0488 10.0488 10.1744 10.1744 10.2001 10.2001 10.3744 10.3744 11.0687 11.0687 11.1383 11.1383 12.9600 12.9600 13.2924 13.2924 14.5245 14.5245 15.0583 15.0583 15.6691 15.6691 16.3098 16.3098 k = 0.7554 0.1239-0.2321 ( 4118 PWs) bands (ev): -2.3171 -2.3171 -2.2987 -2.2987 -1.3949 -1.3949 -1.3491 -1.3491 -1.2992 -1.2992 -1.1851 -1.1851 0.6934 0.6934 0.7385 0.7385 0.7929 0.7929 0.8260 0.8260 0.8593 0.8593 0.9270 0.9270 3.5011 3.5011 3.6037 3.6037 6.1985 6.1985 6.2394 6.2394 7.0794 7.0794 7.2860 7.2860 7.8683 7.8683 7.9241 7.9241 7.9751 7.9751 8.6061 8.6061 8.8043 8.8043 9.2005 9.2005 9.2722 9.2722 9.5429 9.5429 9.6274 9.6274 9.7652 9.7652 9.9078 9.9078 10.0488 10.0488 10.1744 10.1744 10.2002 10.2002 10.3745 10.3745 11.0687 11.0687 11.1383 11.1383 12.9601 12.9601 13.2923 13.2923 14.5245 14.5245 15.0583 15.0583 15.6691 15.6691 16.3098 16.3098 k = 0.7469 0.1291-0.2179 ( 4122 PWs) bands (ev): -2.3184 -2.3184 -2.2976 -2.2976 -1.3942 -1.3942 -1.3496 -1.3496 -1.3001 -1.3001 -1.1843 -1.1843 0.6931 0.6931 0.7400 0.7400 0.7905 0.7905 0.8268 0.8268 0.8602 0.8602 0.9260 0.9260 3.4723 3.4723 3.6225 3.6225 6.1884 6.1884 6.2735 6.2735 7.0844 7.0844 7.2630 7.2630 7.8792 7.8792 7.9288 7.9288 7.9595 7.9595 8.6217 8.6217 8.7972 8.7972 9.2070 9.2070 9.2672 9.2672 9.5357 9.5357 9.6377 9.6377 9.7584 9.7584 9.9137 9.9137 10.0575 10.0575 10.1603 10.1603 10.1944 10.1944 10.3807 10.3807 11.0758 11.0758 11.1561 11.1561 12.9564 12.9564 13.3026 13.3026 14.4817 14.4817 15.0500 15.0500 15.7117 15.7117 16.3169 16.3169 k = 0.7384 0.1343-0.2036 ( 4118 PWs) bands (ev): -2.3216 -2.3216 -2.2949 -2.2949 -1.3934 -1.3934 -1.3502 -1.3502 -1.3012 -1.3012 -1.1837 -1.1837 0.6928 0.6928 0.7415 0.7415 0.7880 0.7880 0.8274 0.8274 0.8610 0.8610 0.9248 0.9248 3.4446 3.4446 3.6445 3.6445 6.1727 6.1727 6.3130 6.3130 7.0908 7.0908 7.2410 7.2410 7.8869 7.8869 7.9188 7.9188 7.9581 7.9581 8.6374 8.6374 8.7925 8.7925 9.2059 9.2059 9.2709 9.2709 9.5261 9.5261 9.6476 9.6476 9.7523 9.7523 9.9197 9.9197 10.0631 10.0631 10.1384 10.1384 10.1978 10.1978 10.3886 10.3886 11.0823 11.0823 11.1743 11.1743 12.9584 12.9584 13.3139 13.3139 14.4095 14.4095 15.0575 15.0575 15.7512 15.7512 16.2958 16.2958 k = 0.7299 0.1395-0.1893 ( 4120 PWs) bands (ev): -2.3261 -2.3261 -2.2914 -2.2914 -1.3927 -1.3927 -1.3509 -1.3509 -1.3023 -1.3023 -1.1835 -1.1835 0.6924 0.6924 0.7430 0.7430 0.7856 0.7856 0.8277 0.8277 0.8617 0.8617 0.9234 0.9234 3.4180 3.4180 3.6696 3.6696 6.1564 6.1564 6.3529 6.3529 7.0979 7.0979 7.2208 7.2208 7.8889 7.8889 7.9018 7.9018 7.9650 7.9650 8.6533 8.6533 8.7904 8.7904 9.1990 9.1990 9.2808 9.2808 9.5149 9.5149 9.6566 9.6566 9.7471 9.7471 9.9255 9.9255 10.0642 10.0642 10.1165 10.1165 10.2049 10.2049 10.3978 10.3978 11.0880 11.0880 11.1924 11.1924 12.9657 12.9657 13.3264 13.3264 14.3199 14.3199 15.0724 15.0724 15.7845 15.7845 16.2569 16.2569 k = 0.7213 0.1447-0.1751 ( 4120 PWs) bands (ev): -2.3313 -2.3313 -2.2874 -2.2874 -1.3921 -1.3921 -1.3515 -1.3515 -1.3035 -1.3035 -1.1834 -1.1834 0.6920 0.6920 0.7444 0.7444 0.7833 0.7833 0.8276 0.8276 0.8623 0.8623 0.9219 0.9219 3.3925 3.3925 3.6978 3.6978 6.1408 6.1408 6.3919 6.3919 7.1054 7.1054 7.2030 7.2030 7.8734 7.8734 7.8967 7.8967 7.9730 7.9730 8.6690 8.6690 8.7911 8.7911 9.1896 9.1896 9.2934 9.2934 9.5030 9.5030 9.6643 9.6643 9.7428 9.7428 9.9313 9.9313 10.0582 10.0582 10.0987 10.0987 10.2148 10.2148 10.4081 10.4081 11.0927 11.0927 11.2100 11.2100 12.9775 12.9775 13.3401 13.3401 14.2224 14.2224 15.0889 15.0889 15.8074 15.8074 16.2135 16.2135 k = 0.7128 0.1499-0.1608 ( 4124 PWs) bands (ev): -2.3371 -2.3371 -2.2833 -2.2833 -1.3914 -1.3914 -1.3522 -1.3522 -1.3049 -1.3049 -1.1837 -1.1837 0.6915 0.6915 0.7459 0.7459 0.7811 0.7811 0.8272 0.8272 0.8628 0.8628 0.9203 0.9203 3.3680 3.3680 3.7291 3.7291 6.1264 6.1264 6.4289 6.4289 7.1126 7.1126 7.1884 7.1884 7.8506 7.8506 7.8945 7.8945 7.9804 7.9804 8.6847 8.6847 8.7948 8.7948 9.1794 9.1794 9.3061 9.3061 9.4907 9.4907 9.6703 9.6703 9.7399 9.7399 9.9368 9.9368 10.0443 10.0443 10.0870 10.0870 10.2270 10.2270 10.4194 10.4194 11.0963 11.0963 11.2269 11.2269 12.9923 12.9923 13.3553 13.3553 14.1233 14.1233 15.1042 15.1042 15.8146 15.8146 16.1760 16.1760 k = 0.7043 0.1551-0.1465 ( 4124 PWs) bands (ev): -2.3433 -2.3433 -2.2790 -2.2790 -1.3908 -1.3908 -1.3529 -1.3529 -1.3063 -1.3063 -1.1842 -1.1842 0.6910 0.6910 0.7473 0.7473 0.7791 0.7791 0.8264 0.8264 0.8631 0.8631 0.9185 0.9185 3.3447 3.3447 3.7633 3.7633 6.1137 6.1137 6.4630 6.4630 7.1193 7.1193 7.1780 7.1780 7.8264 7.8264 7.8896 7.8896 7.9865 7.9865 8.7003 8.7003 8.8011 8.8011 9.1693 9.1693 9.3179 9.3179 9.4783 9.4783 9.6742 9.6742 9.7391 9.7391 9.9420 9.9420 10.0266 10.0266 10.0786 10.0786 10.2413 10.2413 10.4319 10.4319 11.0989 11.0989 11.2429 11.2429 13.0080 13.0080 13.3718 13.3718 14.0275 14.0275 15.1172 15.1172 15.8007 15.8007 16.1517 16.1517 k = 0.6958 0.1603-0.1322 ( 4114 PWs) bands (ev): -2.3498 -2.3498 -2.2747 -2.2747 -1.3902 -1.3902 -1.3535 -1.3535 -1.3078 -1.3078 -1.1849 -1.1849 0.6903 0.6903 0.7487 0.7487 0.7774 0.7774 0.8253 0.8253 0.8634 0.8634 0.9166 0.9166 3.3224 3.3224 3.8003 3.8003 6.1031 6.1031 6.4934 6.4934 7.1254 7.1254 7.1725 7.1725 7.8014 7.8014 7.8814 7.8814 7.9910 7.9910 8.7159 8.7159 8.8100 8.8100 9.1595 9.1595 9.3280 9.3280 9.4657 9.4657 9.6756 9.6756 9.7412 9.7412 9.9469 9.9469 10.0095 10.0095 10.0705 10.0705 10.2575 10.2575 10.4455 10.4455 11.1006 11.1006 11.2580 11.2580 13.0214 13.0214 13.3897 13.3897 13.9395 13.9395 15.1276 15.1276 15.7646 15.7646 16.1423 16.1423 k = 0.6873 0.1655-0.1180 ( 4112 PWs) bands (ev): -2.3566 -2.3566 -2.2703 -2.2703 -1.3897 -1.3897 -1.3540 -1.3540 -1.3094 -1.3094 -1.1859 -1.1859 0.6896 0.6896 0.7501 0.7501 0.7760 0.7760 0.8238 0.8238 0.8635 0.8635 0.9145 0.9145 3.3012 3.3012 3.8401 3.8401 6.0950 6.0950 6.5191 6.5191 7.1307 7.1307 7.1727 7.1727 7.7755 7.7755 7.8699 7.8699 7.9937 7.9937 8.7314 8.7314 8.8208 8.8208 9.1499 9.1499 9.3359 9.3359 9.4527 9.4527 9.6744 9.6744 9.7465 9.7465 9.9511 9.9511 9.9953 9.9953 10.0619 10.0619 10.2750 10.2750 10.4604 10.4604 11.1014 11.1014 11.2721 11.2721 13.0283 13.0283 13.4091 13.4091 13.8640 13.8640 15.1355 15.1355 15.7110 15.7110 16.1435 16.1435 k = 0.6788 0.1708-0.1037 ( 4112 PWs) bands (ev): -2.3636 -2.3636 -2.2661 -2.2661 -1.3893 -1.3893 -1.3545 -1.3545 -1.3111 -1.3111 -1.1871 -1.1871 0.6887 0.6887 0.7514 0.7514 0.7749 0.7749 0.8221 0.8221 0.8636 0.8636 0.9122 0.9122 3.2811 3.2811 3.8824 3.8824 6.0896 6.0896 6.5393 6.5393 7.1349 7.1349 7.1793 7.1793 7.7487 7.7487 7.8551 7.8551 7.9943 7.9943 8.7465 8.7465 8.8329 8.8329 9.1405 9.1405 9.3412 9.3412 9.4392 9.4392 9.6718 9.6718 9.7545 9.7545 9.9537 9.9537 9.9859 9.9859 10.0531 10.0531 10.2939 10.2939 10.4766 10.4766 11.1017 11.1017 11.2851 11.2851 13.0237 13.0237 13.4301 13.4301 13.8057 13.8057 15.1407 15.1407 15.6459 15.6459 16.1491 16.1491 k = 0.6703 0.1760-0.0894 ( 4110 PWs) bands (ev): -2.3707 -2.3707 -2.2618 -2.2618 -1.3889 -1.3889 -1.3549 -1.3549 -1.3128 -1.3128 -1.1885 -1.1885 0.6876 0.6876 0.7526 0.7526 0.7742 0.7742 0.8202 0.8202 0.8635 0.8635 0.9098 0.9098 3.2619 3.2619 3.9271 3.9271 6.0871 6.0871 6.5538 6.5538 7.1379 7.1379 7.1928 7.1928 7.7211 7.7211 7.8370 7.8370 7.9930 7.9930 8.7614 8.7614 8.8458 8.8458 9.1312 9.1312 9.3436 9.3436 9.4246 9.4246 9.6694 9.6694 9.7642 9.7642 9.9537 9.9537 9.9828 9.9828 10.0444 10.0444 10.3140 10.3140 10.4947 10.4947 11.1015 11.1015 11.2972 11.2972 13.0034 13.0034 13.4525 13.4525 13.7686 13.7686 15.1432 15.1432 15.5743 15.5743 16.1544 16.1544 k = 0.6617 0.1812-0.0752 ( 4104 PWs) bands (ev): -2.3779 -2.3779 -2.2577 -2.2577 -1.3887 -1.3887 -1.3553 -1.3553 -1.3145 -1.3145 -1.1901 -1.1901 0.6864 0.6864 0.7538 0.7538 0.7740 0.7740 0.8180 0.8180 0.8633 0.8633 0.9073 0.9073 3.2437 3.2437 3.9741 3.9741 6.0876 6.0876 6.5626 6.5626 7.1395 7.1395 7.2131 7.2131 7.6924 7.6924 7.8158 7.8158 7.9897 7.9897 8.7757 8.7757 8.8585 8.8585 9.1220 9.1220 9.3427 9.3427 9.4087 9.4087 9.6690 9.6690 9.7747 9.7747 9.9520 9.9520 9.9853 9.9853 10.0368 10.0368 10.3353 10.3353 10.5147 10.5147 11.1012 11.1012 11.3083 11.3083 12.9660 12.9660 13.4754 13.4754 13.7543 13.7543 15.1422 15.1422 15.4997 15.4997 16.1567 16.1567 k = 0.6532 0.1864-0.0609 ( 4104 PWs) bands (ev): -2.3851 -2.3851 -2.2536 -2.2536 -1.3886 -1.3886 -1.3555 -1.3555 -1.3163 -1.3163 -1.1918 -1.1918 0.6851 0.6851 0.7549 0.7549 0.7741 0.7741 0.8157 0.8157 0.8629 0.8629 0.9046 0.9046 3.2264 3.2264 4.0230 4.0230 6.0913 6.0913 6.5664 6.5664 7.1398 7.1398 7.2391 7.2391 7.6628 7.6628 7.7921 7.7921 7.9847 7.9847 8.7893 8.7893 8.8705 8.8705 9.1125 9.1125 9.3382 9.3382 9.3911 9.3911 9.6722 9.6722 9.7848 9.7848 9.9506 9.9506 9.9904 9.9904 10.0317 10.0317 10.3576 10.3576 10.5372 10.5372 11.1010 11.1010 11.3186 11.3186 12.9131 12.9131 13.4972 13.4972 13.7612 13.7612 15.1364 15.1364 15.4259 15.4259 16.1541 16.1541 k = 0.6447 0.1916-0.0466 ( 4104 PWs) bands (ev): -2.3922 -2.3922 -2.2497 -2.2497 -1.3885 -1.3885 -1.3556 -1.3556 -1.3180 -1.3180 -1.1937 -1.1937 0.6836 0.6836 0.7560 0.7560 0.7746 0.7746 0.8134 0.8134 0.8624 0.8624 0.9017 0.9017 3.2100 3.2100 4.0737 4.0737 6.0981 6.0981 6.5658 6.5658 7.1392 7.1392 7.2693 7.2693 7.6320 7.6320 7.7664 7.7664 7.9782 7.9782 8.8019 8.8019 8.8811 8.8811 9.1027 9.1027 9.3299 9.3299 9.3718 9.3718 9.6798 9.6798 9.7939 9.7939 9.9503 9.9503 9.9960 9.9960 10.0311 10.0311 10.3809 10.3809 10.5626 10.5626 11.1010 11.1010 11.3282 11.3282 12.8490 12.8490 13.5159 13.5159 13.7862 13.7862 15.1226 15.1226 15.3574 15.3574 16.1459 16.1459 k = 0.6362 0.1968-0.0324 ( 4110 PWs) bands (ev): -2.3993 -2.3993 -2.2459 -2.2459 -1.3886 -1.3886 -1.3556 -1.3556 -1.3197 -1.3197 -1.1957 -1.1957 0.6820 0.6820 0.7571 0.7571 0.7753 0.7753 0.8111 0.8111 0.8618 0.8618 0.8987 0.8987 3.1945 3.1945 4.1259 4.1259 6.1082 6.1082 6.5618 6.5618 7.1376 7.1376 7.3019 7.3019 7.6002 7.6002 7.7398 7.7398 7.9704 7.9704 8.8136 8.8136 8.8899 8.8899 9.0925 9.0925 9.3176 9.3176 9.3512 9.3512 9.6917 9.6917 9.8012 9.8012 9.9505 9.9505 10.0009 10.0009 10.0368 10.0368 10.4052 10.4052 10.5915 10.5915 11.1015 11.1015 11.3372 11.3372 12.7777 12.7777 13.5296 13.5296 13.8249 13.8249 15.0959 15.0959 15.3011 15.3011 16.1315 16.1315 k = 0.6277 0.2020-0.0181 ( 4106 PWs) bands (ev): -2.4063 -2.4063 -2.2422 -2.2422 -1.3888 -1.3888 -1.3555 -1.3555 -1.3214 -1.3214 -1.1978 -1.1978 0.6803 0.6803 0.7583 0.7583 0.7763 0.7763 0.8089 0.8089 0.8610 0.8610 0.8956 0.8956 3.1798 3.1798 4.1791 4.1791 6.1215 6.1215 6.5553 6.5553 7.1353 7.1353 7.3342 7.3342 7.5672 7.5672 7.7141 7.7141 7.9618 7.9618 8.8244 8.8244 8.8966 8.8966 9.0817 9.0817 9.3012 9.3012 9.3302 9.3302 9.7069 9.7069 9.8069 9.8069 9.9508 9.9508 10.0060 10.0060 10.0485 10.0485 10.4302 10.4302 10.6246 10.6246 11.1026 11.1026 11.3460 11.3460 12.7028 12.7028 13.5369 13.5369 13.8735 13.8735 15.0525 15.0525 15.2624 15.2624 16.1106 16.1106 k = 0.6192 0.2072-0.0038 ( 4100 PWs) bands (ev): -2.4131 -2.4131 -2.2387 -2.2387 -1.3891 -1.3891 -1.3554 -1.3554 -1.3230 -1.3230 -1.2000 -1.2000 0.6786 0.6786 0.7595 0.7595 0.7775 0.7775 0.8068 0.8068 0.8601 0.8601 0.8924 0.8924 3.1660 3.1660 4.2332 4.2332 6.1379 6.1379 6.5472 6.5472 7.1325 7.1325 7.3626 7.3626 7.5331 7.5331 7.6924 7.6924 7.9525 7.9525 8.8342 8.8342 8.9013 8.9013 9.0702 9.0702 9.2807 9.2807 9.3094 9.3094 9.7241 9.7241 9.8110 9.8110 9.9507 9.9507 10.0134 10.0134 10.0638 10.0638 10.4558 10.4558 10.6626 10.6626 11.1045 11.1045 11.3547 11.3547 12.6268 12.6268 13.5362 13.5362 13.9288 13.9288 14.9964 14.9964 15.2394 15.2394 16.0834 16.0834 k = 0.6107 0.2124 0.0105 ( 4116 PWs) bands (ev): -2.4196 -2.4196 -2.2354 -2.2354 -1.3895 -1.3895 -1.3552 -1.3552 -1.3245 -1.3245 -1.2022 -1.2022 0.6768 0.6768 0.7607 0.7607 0.7786 0.7786 0.8050 0.8050 0.8591 0.8591 0.8890 0.8890 3.1530 3.1530 4.2875 4.2875 6.1572 6.1572 6.5381 6.5381 7.1292 7.1292 7.3817 7.3817 7.4982 7.4982 7.6792 7.6792 7.9427 7.9427 8.8429 8.8429 8.9040 8.9040 9.0581 9.0581 9.2566 9.2566 9.2895 9.2895 9.7411 9.7411 9.8138 9.8138 9.9506 9.9506 10.0235 10.0235 10.0811 10.0811 10.4816 10.4816 10.7058 10.7058 11.1071 11.1071 11.3637 11.3637 12.5517 12.5517 13.5257 13.5257 13.9881 13.9881 14.9362 14.9362 15.2258 15.2258 16.0498 16.0498 k = 0.6022 0.2177 0.0247 ( 4118 PWs) bands (ev): -2.4259 -2.4259 -2.2323 -2.2323 -1.3899 -1.3899 -1.3549 -1.3549 -1.3260 -1.3260 -1.2044 -1.2044 0.6749 0.6749 0.7621 0.7621 0.7795 0.7795 0.8037 0.8037 0.8580 0.8580 0.8856 0.8856 3.1409 3.1409 4.3418 4.3418 6.1793 6.1793 6.5287 6.5287 7.1257 7.1257 7.3861 7.3861 7.4627 7.4627 7.6798 7.6798 7.9329 7.9329 8.8505 8.8505 8.9050 8.9050 9.0457 9.0457 9.2298 9.2298 9.2710 9.2710 9.7566 9.7566 9.8161 9.8161 9.9508 9.9508 10.0366 10.0366 10.0993 10.0993 10.5073 10.5073 10.7544 10.7544 11.1107 11.1107 11.3734 11.3734 12.4788 12.4788 13.5035 13.5035 14.0495 14.0495 14.8792 14.8792 15.2169 15.2169 16.0104 16.0104 k = 0.5936 0.2229 0.0390 ( 4104 PWs) bands (ev): -2.4318 -2.4318 -2.2293 -2.2293 -1.3903 -1.3903 -1.3546 -1.3546 -1.3273 -1.3273 -1.2065 -1.2065 0.6731 0.6731 0.7635 0.7635 0.7802 0.7802 0.8030 0.8030 0.8568 0.8568 0.8821 0.8821 3.1297 3.1297 4.3955 4.3955 6.2039 6.2039 6.5194 6.5194 7.1220 7.1220 7.3736 7.3736 7.4269 7.4269 7.6959 7.6959 7.9232 7.9232 8.8568 8.8568 8.9044 8.9044 9.0332 9.0332 9.2009 9.2009 9.2539 9.2539 9.7693 9.7693 9.8185 9.8185 9.9516 9.9516 10.0521 10.0521 10.1173 10.1173 10.5329 10.5329 10.8082 10.8082 11.1154 11.1154 11.3843 11.3843 12.4094 12.4094 13.4681 13.4681 14.1113 14.1113 14.8301 14.8301 15.2101 15.2101 15.9658 15.9658 k = 0.5851 0.2281 0.0533 ( 4106 PWs) bands (ev): -2.4374 -2.4374 -2.2266 -2.2266 -1.3908 -1.3908 -1.3543 -1.3543 -1.3285 -1.3285 -1.2087 -1.2087 0.6714 0.6714 0.7649 0.7649 0.7804 0.7804 0.8030 0.8030 0.8555 0.8555 0.8786 0.8786 3.1193 3.1193 4.4481 4.4481 6.2307 6.2307 6.5105 6.5105 7.1182 7.1182 7.3477 7.3477 7.3906 7.3906 7.7245 7.7245 7.9138 7.9138 8.8618 8.8618 8.9024 8.9024 9.0208 9.0208 9.1706 9.1706 9.2383 9.2383 9.7783 9.7783 9.8214 9.8214 9.9528 9.9528 10.0693 10.0693 10.1344 10.1344 10.5579 10.5579 10.8660 10.8660 11.1210 11.1210 11.3970 11.3970 12.3445 12.3445 13.4186 13.4186 14.1719 14.1719 14.7921 14.7921 15.2043 15.2043 15.9166 15.9166 k = 0.5766 0.2333 0.0675 ( 4110 PWs) bands (ev): -2.4425 -2.4425 -2.2241 -2.2241 -1.3913 -1.3913 -1.3541 -1.3541 -1.3295 -1.3295 -1.2107 -1.2107 0.6697 0.6697 0.7664 0.7664 0.7803 0.7803 0.8036 0.8036 0.8540 0.8540 0.8751 0.8751 3.1098 3.1098 4.4989 4.4989 6.2593 6.2593 6.5025 6.5025 7.1145 7.1145 7.3139 7.3139 7.3535 7.3535 7.7608 7.7608 7.9050 7.9050 8.8651 8.8651 8.8994 8.8994 9.0090 9.0090 9.1397 9.1397 9.2246 9.2246 9.7839 9.7839 9.8249 9.8249 9.9543 9.9543 10.0873 10.0873 10.1503 10.1503 10.5821 10.5821 10.9261 10.9261 11.1276 11.1276 11.4123 11.4123 12.2854 12.2854 13.3549 13.3549 14.2298 14.2298 14.7672 14.7672 15.1985 15.1985 15.8638 15.8638 k = 0.5681 0.2385 0.0818 ( 4106 PWs) bands (ev): -2.4473 -2.4473 -2.2219 -2.2219 -1.3918 -1.3918 -1.3538 -1.3538 -1.3304 -1.3304 -1.2126 -1.2126 0.6681 0.6681 0.7679 0.7679 0.7797 0.7797 0.8050 0.8050 0.8525 0.8525 0.8717 0.8717 3.1012 3.1012 4.5473 4.5473 6.2890 6.2890 6.4955 6.4955 7.1110 7.1110 7.2763 7.2763 7.3157 7.3157 7.8006 7.8006 7.8971 7.8971 8.8666 8.8666 8.8956 8.8956 8.9982 8.9982 9.1091 9.1091 9.2126 9.2126 9.7870 9.7870 9.8288 9.8288 9.9559 9.9559 10.1053 10.1053 10.1646 10.1646 10.6051 10.6051 10.9862 10.9862 11.1353 11.1353 11.4311 11.4311 12.2337 12.2337 13.2780 13.2780 14.2832 14.2832 14.7563 14.7563 15.1922 15.1922 15.8087 15.8087 k = 0.5596 0.2437 0.0961 ( 4104 PWs) bands (ev): -2.4515 -2.4515 -2.2199 -2.2199 -1.3923 -1.3923 -1.3536 -1.3536 -1.3311 -1.3311 -1.2144 -1.2144 0.6667 0.6667 0.7694 0.7694 0.7790 0.7790 0.8068 0.8068 0.8509 0.8509 0.8684 0.8684 3.0936 3.0936 4.5925 4.5925 6.3193 6.3193 6.4898 6.4898 7.1076 7.1076 7.2378 7.2378 7.2782 7.2782 7.8405 7.8405 7.8910 7.8910 8.8660 8.8660 8.8910 8.8910 8.9885 8.9885 9.0799 9.0799 9.2024 9.2024 9.7884 9.7884 9.8326 9.8326 9.9575 9.9575 10.1225 10.1225 10.1772 10.1772 10.6267 10.6267 11.0432 11.0432 11.1440 11.1440 11.4538 11.4538 12.1914 12.1914 13.1898 13.1898 14.3306 14.3306 14.7595 14.7595 15.1849 15.1849 15.7523 15.7523 k = 0.5511 0.2489 0.1103 ( 4102 PWs) bands (ev): -2.4552 -2.4552 -2.2181 -2.2181 -1.3927 -1.3927 -1.3535 -1.3535 -1.3318 -1.3318 -1.2160 -1.2160 0.6654 0.6654 0.7707 0.7707 0.7781 0.7781 0.8090 0.8090 0.8492 0.8492 0.8654 0.8654 3.0869 3.0869 4.6339 4.6339 6.3491 6.3491 6.4856 6.4856 7.1046 7.1046 7.2000 7.2000 7.2418 7.2418 7.8701 7.8701 7.8953 7.8953 8.8636 8.8636 8.8853 8.8853 8.9802 8.9802 9.0534 9.0534 9.1939 9.1939 9.7889 9.7889 9.8359 9.8359 9.9591 9.9591 10.1383 10.1383 10.1881 10.1881 10.6465 10.6465 11.0933 11.0933 11.1542 11.1542 11.4802 11.4802 12.1614 12.1614 13.0926 13.0926 14.3707 14.3707 14.7760 14.7760 15.1759 15.1759 15.6964 15.6964 k = 0.5426 0.2541 0.1246 ( 4096 PWs) bands (ev): -2.4584 -2.4584 -2.2166 -2.2166 -1.3931 -1.3931 -1.3533 -1.3533 -1.3322 -1.3322 -1.2174 -1.2174 0.6642 0.6642 0.7720 0.7720 0.7773 0.7773 0.8114 0.8114 0.8474 0.8474 0.8626 0.8626 3.0812 3.0812 4.6706 4.6706 6.3773 6.3773 6.4833 6.4833 7.1019 7.1019 7.1643 7.1643 7.2079 7.2079 7.8718 7.8718 7.9259 7.9259 8.8598 8.8598 8.8783 8.8783 8.9734 8.9734 9.0309 9.0309 9.1869 9.1869 9.7891 9.7891 9.8387 9.8387 9.9604 9.9604 10.1521 10.1521 10.1972 10.1972 10.6640 10.6640 11.1319 11.1319 11.1680 11.1680 11.5081 11.5081 12.1472 12.1472 12.9892 12.9892 14.4028 14.4028 14.8044 14.8044 15.1643 15.1643 15.6426 15.6426 k = 0.5341 0.2593 0.1389 ( 4088 PWs) bands (ev): -2.4611 -2.4611 -2.2153 -2.2153 -1.3934 -1.3934 -1.3532 -1.3532 -1.3326 -1.3326 -1.2185 -1.2185 0.6633 0.6633 0.7731 0.7731 0.7765 0.7765 0.8138 0.8138 0.8455 0.8455 0.8602 0.8602 3.0765 3.0765 4.7019 4.7019 6.4021 6.4021 6.4834 6.4834 7.0996 7.0996 7.1322 7.1322 7.1775 7.1775 7.8682 7.8682 7.9589 7.9589 8.8552 8.8552 8.8698 8.8698 8.9681 8.9681 9.0133 9.0133 9.1813 9.1813 9.7891 9.7891 9.8410 9.8410 9.9616 9.9616 10.1637 10.1637 10.2046 10.2046 10.6789 10.6789 11.1539 11.1539 11.1891 11.1891 11.5339 11.5339 12.1525 12.1525 12.8827 12.8827 14.4272 14.4272 14.8420 14.8420 15.1489 15.1489 15.5934 15.5934 k = 0.5255 0.2646 0.1532 ( 4086 PWs) bands (ev): -2.4632 -2.4632 -2.2144 -2.2144 -1.3937 -1.3937 -1.3532 -1.3532 -1.3328 -1.3328 -1.2195 -1.2195 0.6626 0.6626 0.7740 0.7740 0.7759 0.7759 0.8162 0.8162 0.8436 0.8436 0.8583 0.8583 3.0728 3.0728 4.7271 4.7271 6.4213 6.4213 6.4863 6.4863 7.0974 7.0974 7.1053 7.1053 7.1521 7.1521 7.8647 7.8647 7.9873 7.9873 8.8498 8.8498 8.8614 8.8614 8.9641 8.9641 9.0007 9.0007 9.1771 9.1771 9.7890 9.7890 9.8427 9.8427 9.9625 9.9625 10.1728 10.1728 10.2104 10.2104 10.6908 10.6908 11.1649 11.1649 11.2117 11.2117 11.5537 11.5537 12.1789 12.1789 12.7765 12.7765 14.4450 14.4450 14.8859 14.8859 15.1284 15.1284 15.5511 15.5511 k = 0.5170 0.2698 0.1674 ( 4094 PWs) bands (ev): -2.4647 -2.4647 -2.2137 -2.2137 -1.3939 -1.3939 -1.3532 -1.3532 -1.3330 -1.3330 -1.2202 -1.2202 0.6620 0.6620 0.7746 0.7746 0.7754 0.7754 0.8183 0.8183 0.8418 0.8418 0.8569 0.8569 3.0701 3.0701 4.7456 4.7456 6.4336 6.4336 6.4918 6.4918 7.0834 7.0834 7.0970 7.0970 7.1329 7.1329 7.8621 7.8621 8.0090 8.0090 8.8435 8.8435 8.8552 8.8552 8.9614 8.9614 8.9925 8.9925 9.1741 9.1741 9.7888 9.7888 9.8439 9.8439 9.9632 9.9632 10.1794 10.1794 10.2144 10.2144 10.6994 10.6994 11.1715 11.1715 11.2292 11.2292 11.5661 11.5661 12.2233 12.2233 12.6761 12.6761 14.4569 14.4569 14.9329 14.9329 15.1017 15.1017 15.5186 15.5186 k = 0.5085 0.2750 0.1817 ( 4092 PWs) bands (ev): -2.4656 -2.4656 -2.2133 -2.2133 -1.3940 -1.3940 -1.3531 -1.3531 -1.3331 -1.3331 -1.2206 -1.2206 0.6617 0.6617 0.7750 0.7750 0.7751 0.7751 0.8199 0.8199 0.8405 0.8405 0.8561 0.8561 3.0686 3.0686 4.7569 4.7569 6.4398 6.4398 6.4973 6.4973 7.0701 7.0701 7.0961 7.0961 7.1209 7.1209 7.8605 7.8605 8.0226 8.0226 8.8382 8.8382 8.8520 8.8520 8.9600 8.9600 8.9881 8.9881 9.1723 9.1723 9.7888 9.7888 9.8446 9.8446 9.9636 9.9636 10.1834 10.1834 10.2168 10.2168 10.7047 10.7047 11.1753 11.1753 11.2400 11.2400 11.5721 11.5721 12.2741 12.2741 12.5927 12.5927 14.4638 14.4638 14.9797 14.9797 15.0685 15.0685 15.4982 15.4982 k = 0.5000 0.2802 0.1960 ( 4092 PWs) bands (ev): -2.4659 -2.4659 -2.2131 -2.2131 -1.3941 -1.3941 -1.3531 -1.3531 -1.3331 -1.3331 -1.2207 -1.2207 0.6616 0.6616 0.7750 0.7750 0.7752 0.7752 0.8204 0.8204 0.8400 0.8400 0.8559 0.8559 3.0680 3.0680 4.7607 4.7607 6.4416 6.4416 6.4995 6.4995 7.0655 7.0655 7.0958 7.0958 7.1168 7.1168 7.8599 7.8599 8.0273 8.0273 8.8361 8.8361 8.8510 8.8510 8.9594 8.9594 8.9866 8.9866 9.1717 9.1717 9.7888 9.7888 9.8449 9.8449 9.9637 9.9637 10.1847 10.1847 10.2177 10.2177 10.7064 10.7064 11.1765 11.1765 11.2437 11.2437 11.5737 11.5737 12.3008 12.3008 12.5554 12.5554 14.4660 14.4660 15.0147 15.0147 15.0382 15.0382 15.4912 15.4912 k = 0.5000 0.2802 0.1960 ( 4092 PWs) bands (ev): -2.4659 -2.4659 -2.2131 -2.2131 -1.3941 -1.3941 -1.3531 -1.3531 -1.3331 -1.3331 -1.2207 -1.2207 0.6616 0.6616 0.7750 0.7750 0.7752 0.7752 0.8204 0.8204 0.8400 0.8400 0.8559 0.8559 3.0680 3.0680 4.7607 4.7607 6.4416 6.4416 6.4995 6.4995 7.0655 7.0655 7.0958 7.0958 7.1168 7.1168 7.8599 7.8599 8.0273 8.0273 8.8361 8.8361 8.8510 8.8510 8.9594 8.9594 8.9866 8.9866 9.1717 9.1717 9.7888 9.7888 9.8449 9.8449 9.9637 9.9637 10.1847 10.1847 10.2177 10.2177 10.7064 10.7064 11.1765 11.1765 11.2437 11.2437 11.5737 11.5737 12.3008 12.3008 12.5554 12.5554 14.4660 14.4660 15.0147 15.0147 15.0382 15.0382 15.4912 15.4912 k = 0.4857 0.2722 0.1904 ( 4086 PWs) bands (ev): -2.4686 -2.4686 -2.2107 -2.2107 -1.3941 -1.3941 -1.3532 -1.3532 -1.3336 -1.3336 -1.2203 -1.2203 0.6614 0.6614 0.7749 0.7749 0.7749 0.7749 0.8198 0.8198 0.8402 0.8402 0.8564 0.8564 3.0702 3.0702 4.7610 4.7610 6.4408 6.4408 6.4984 6.4984 7.0675 7.0675 7.0896 7.0896 7.1193 7.1193 7.8539 7.8539 8.0403 8.0403 8.8365 8.8365 8.8512 8.8512 8.9597 8.9597 8.9873 8.9873 9.1716 9.1716 9.7888 9.7888 9.8449 9.8449 9.9638 9.9638 10.1848 10.1848 10.2177 10.2177 10.7065 10.7065 11.1727 11.1727 11.2420 11.2420 11.5739 11.5739 12.2979 12.2979 12.5527 12.5527 14.4442 14.4442 15.0001 15.0001 15.0781 15.0781 15.4917 15.4917 k = 0.4714 0.2642 0.1848 ( 4092 PWs) bands (ev): -2.4763 -2.4763 -2.2038 -2.2038 -1.3941 -1.3941 -1.3533 -1.3533 -1.3348 -1.3348 -1.2192 -1.2192 0.6610 0.6610 0.7741 0.7741 0.7746 0.7746 0.8179 0.8179 0.8408 0.8408 0.8579 0.8579 3.0769 3.0769 4.7620 4.7620 6.4387 6.4387 6.4950 6.4950 7.0696 7.0696 7.0755 7.0755 7.1268 7.1268 7.8407 7.8407 8.0740 8.0740 8.8376 8.8376 8.8518 8.8518 8.9603 8.9603 8.9891 8.9891 9.1711 9.1711 9.7888 9.7888 9.8449 9.8449 9.9638 9.9638 10.1848 10.1848 10.2178 10.2178 10.7065 10.7065 11.1614 11.1614 11.2370 11.2370 11.5742 11.5742 12.2893 12.2893 12.5443 12.5443 14.3882 14.3882 14.9925 14.9925 15.1515 15.1515 15.4932 15.4932 k = 0.4571 0.2562 0.1792 ( 4092 PWs) bands (ev): -2.4883 -2.4883 -2.1930 -2.1930 -1.3942 -1.3942 -1.3534 -1.3534 -1.3368 -1.3368 -1.2175 -1.2175 0.6602 0.6602 0.7727 0.7727 0.7741 0.7741 0.8151 0.8151 0.8416 0.8416 0.8600 0.8600 3.0878 3.0878 4.7636 4.7636 6.4353 6.4353 6.4897 6.4897 7.0417 7.0417 7.0844 7.0844 7.1391 7.1391 7.8274 7.8274 8.1201 8.1201 8.8394 8.8394 8.8527 8.8527 8.9613 8.9613 8.9922 8.9922 9.1704 9.1704 9.7889 9.7889 9.8450 9.8450 9.9640 9.9640 10.1850 10.1850 10.2179 10.2179 10.7065 10.7065 11.1430 11.1430 11.2287 11.2287 11.5744 11.5744 12.2750 12.2750 12.5300 12.5300 14.3152 14.3152 14.9919 14.9919 15.2393 15.2393 15.4955 15.4955 k = 0.4429 0.2482 0.1736 ( 4107 PWs) bands (ev): -2.5038 -2.5038 -2.1792 -2.1792 -1.3944 -1.3944 -1.3537 -1.3537 -1.3394 -1.3394 -1.2153 -1.2153 0.6591 0.6591 0.7709 0.7709 0.7734 0.7734 0.8118 0.8118 0.8428 0.8428 0.8623 0.8623 3.1031 3.1031 4.7660 4.7660 6.4307 6.4307 6.4826 6.4826 7.0033 7.0033 7.0983 7.0983 7.1557 7.1557 7.8176 7.8176 8.1733 8.1733 8.8418 8.8418 8.8539 8.8539 8.9627 8.9627 8.9965 8.9965 9.1691 9.1691 9.7888 9.7888 9.8449 9.8449 9.9640 9.9640 10.1853 10.1853 10.2182 10.2182 10.7065 10.7065 11.1183 11.1183 11.2172 11.2172 11.5739 11.5739 12.2555 12.2555 12.5094 12.5094 14.2377 14.2377 14.9950 14.9950 15.3285 15.3285 15.4980 15.4980 k = 0.4286 0.2402 0.1680 ( 4110 PWs) bands (ev): -2.5219 -2.5219 -2.1632 -2.1632 -1.3946 -1.3946 -1.3540 -1.3540 -1.3424 -1.3424 -1.2127 -1.2127 0.6577 0.6577 0.7686 0.7686 0.7725 0.7725 0.8082 0.8082 0.8441 0.8441 0.8648 0.8648 3.1225 3.1225 4.7692 4.7692 6.4252 6.4252 6.4742 6.4742 6.9573 6.9573 7.1158 7.1158 7.1765 7.1765 7.8123 7.8123 8.2304 8.2304 8.8449 8.8449 8.8554 8.8554 8.9645 8.9645 9.0023 9.0023 9.1677 9.1677 9.7889 9.7889 9.8450 9.8450 9.9642 9.9642 10.1856 10.1856 10.2184 10.2184 10.7065 10.7065 11.0879 11.0879 11.2024 11.2024 11.5724 11.5724 12.2309 12.2309 12.4821 12.4821 14.1630 14.1630 15.0005 15.0005 15.4069 15.4069 15.5005 15.5005 k = 0.4143 0.2322 0.1624 ( 4122 PWs) bands (ev): -2.5420 -2.5420 -2.1455 -2.1455 -1.3948 -1.3948 -1.3543 -1.3543 -1.3459 -1.3459 -1.2099 -1.2099 0.6559 0.6559 0.7660 0.7660 0.7713 0.7713 0.8046 0.8046 0.8457 0.8457 0.8672 0.8672 3.1459 3.1459 4.7733 4.7733 6.4191 6.4191 6.4647 6.4647 6.9058 6.9058 7.1365 7.1365 7.2008 7.2008 7.8114 7.8114 8.2896 8.2896 8.8484 8.8484 8.8571 8.8571 8.9668 8.9668 9.0094 9.0094 9.1660 9.1660 9.7888 9.7888 9.8449 9.8449 9.9645 9.9645 10.1860 10.1860 10.2187 10.2187 10.7065 10.7065 11.0525 11.0525 11.1845 11.1845 11.5693 11.5693 12.2016 12.2016 12.4478 12.4478 14.0950 14.0950 15.0075 15.0075 15.4621 15.4621 15.5023 15.5023 k = 0.4000 0.2241 0.1568 ( 4119 PWs) bands (ev): -2.5636 -2.5636 -2.1265 -2.1265 -1.3950 -1.3950 -1.3547 -1.3547 -1.3497 -1.3497 -1.2071 -1.2071 0.6538 0.6538 0.7632 0.7632 0.7697 0.7697 0.8011 0.8011 0.8474 0.8474 0.8694 0.8694 3.1730 3.1730 4.7784 4.7784 6.4124 6.4124 6.4545 6.4545 6.8502 6.8502 7.1600 7.1600 7.2283 7.2283 7.8146 7.8146 8.3494 8.3494 8.8524 8.8524 8.8590 8.8590 8.9695 8.9695 9.0180 9.0180 9.1640 9.1640 9.7889 9.7889 9.8451 9.8451 9.9648 9.9648 10.1865 10.1865 10.2192 10.2192 10.7065 10.7065 11.0131 11.0131 11.1636 11.1636 11.5644 11.5644 12.1682 12.1682 12.4064 12.4064 14.0359 14.0359 15.0156 15.0156 15.4822 15.4822 15.5029 15.5029 k = 0.3857 0.2161 0.1512 ( 4116 PWs) bands (ev): -2.5862 -2.5862 -2.1066 -2.1066 -1.3953 -1.3953 -1.3552 -1.3552 -1.3535 -1.3535 -1.2045 -1.2045 0.6514 0.6514 0.7601 0.7601 0.7678 0.7678 0.7978 0.7978 0.8491 0.8491 0.8714 0.8714 3.2038 3.2038 4.7847 4.7847 6.4056 6.4056 6.4439 6.4439 6.7920 6.7920 7.1861 7.1861 7.2586 7.2586 7.8212 7.8212 8.4086 8.4086 8.8567 8.8567 8.8609 8.8609 8.9725 8.9725 9.0281 9.0281 9.1620 9.1620 9.7890 9.7890 9.8452 9.8452 9.9651 9.9651 10.1871 10.1871 10.2196 10.2196 10.7065 10.7065 10.9701 10.9701 11.1398 11.1398 11.5575 11.5575 12.1310 12.1310 12.3581 12.3581 13.9863 13.9863 15.0244 15.0244 15.4603 15.4603 15.5020 15.5020 k = 0.3714 0.2081 0.1456 ( 4104 PWs) bands (ev): -2.6096 -2.6096 -2.0860 -2.0860 -1.3956 -1.3956 -1.3575 -1.3575 -1.3557 -1.3557 -1.2021 -1.2021 0.6487 0.6487 0.7568 0.7568 0.7654 0.7654 0.7950 0.7950 0.8509 0.8509 0.8730 0.8730 3.2378 3.2378 4.7923 4.7923 6.3987 6.3987 6.4333 6.4333 6.7324 6.7324 7.2144 7.2144 7.2912 7.2912 7.8305 7.8305 8.4665 8.4665 8.8613 8.8613 8.8630 8.8630 8.9758 8.9758 9.0398 9.0398 9.1599 9.1599 9.7892 9.7892 9.8453 9.8453 9.9655 9.9655 10.1878 10.1878 10.2202 10.2202 10.7064 10.7064 10.9243 10.9243 11.1133 11.1133 11.5483 11.5483 12.0905 12.0905 12.3038 12.3038 13.9456 13.9456 15.0334 15.0334 15.3990 15.3990 15.4993 15.4993 k = 0.3571 0.2001 0.1400 ( 4092 PWs) bands (ev): -2.6335 -2.6335 -2.0648 -2.0648 -1.3959 -1.3959 -1.3615 -1.3615 -1.3562 -1.3562 -1.2000 -1.2000 0.6457 0.6457 0.7533 0.7533 0.7625 0.7625 0.7925 0.7925 0.8527 0.8527 0.8744 0.8744 3.2747 3.2747 4.8015 4.8015 6.3918 6.3918 6.4227 6.4227 6.6723 6.6723 7.2447 7.2447 7.3260 7.3260 7.8418 7.8418 8.5224 8.5224 8.8651 8.8651 8.8660 8.8660 8.9791 8.9791 9.0530 9.0530 9.1582 9.1582 9.7893 9.7893 9.8454 9.8454 9.9658 9.9658 10.1886 10.1886 10.2209 10.2209 10.7064 10.7064 10.8762 10.8762 11.0841 11.0841 11.5367 11.5367 12.0470 12.0470 12.2443 12.2443 13.9118 13.9118 15.0410 15.0410 15.3096 15.3096 15.4946 15.4946 k = 0.3429 0.1921 0.1344 ( 4092 PWs) bands (ev): -2.6577 -2.6577 -2.0431 -2.0431 -1.3963 -1.3963 -1.3654 -1.3654 -1.3568 -1.3568 -1.1984 -1.1984 0.6423 0.6423 0.7498 0.7498 0.7592 0.7592 0.7905 0.7905 0.8545 0.8545 0.8755 0.8755 3.3142 3.3142 4.8126 4.8126 6.3851 6.3851 6.4124 6.4124 6.6124 6.6124 7.2766 7.2766 7.3624 7.3624 7.8545 7.8545 8.5756 8.5756 8.8670 8.8670 8.8705 8.8705 8.9822 8.9822 9.0678 9.0678 9.1570 9.1570 9.7893 9.7893 9.8454 9.8454 9.9662 9.9662 10.1894 10.1894 10.2215 10.2215 10.7063 10.7063 10.8263 10.8263 11.0526 11.0526 11.5229 11.5229 12.0011 12.0011 12.1811 12.1811 13.8819 13.8819 15.0418 15.0418 15.2111 15.2111 15.4880 15.4880 k = 0.3286 0.1841 0.1288 ( 4092 PWs) bands (ev): -2.6820 -2.6820 -2.0209 -2.0209 -1.3966 -1.3966 -1.3693 -1.3693 -1.3574 -1.3574 -1.1974 -1.1974 0.6386 0.6386 0.7462 0.7462 0.7554 0.7554 0.7889 0.7889 0.8563 0.8563 0.8762 0.8762 3.3558 3.3558 4.8257 4.8257 6.3784 6.3784 6.4025 6.4025 6.5537 6.5537 7.3097 7.3097 7.4003 7.4003 7.8679 7.8679 8.6258 8.6258 8.8689 8.8689 8.8750 8.8750 8.9848 8.9848 9.0843 9.0843 9.1570 9.1570 9.7893 9.7893 9.8453 9.8453 9.9667 9.9667 10.1902 10.1902 10.2222 10.2222 10.7061 10.7061 10.7753 10.7753 11.0188 11.0188 11.5067 11.5067 11.9530 11.9530 12.1154 12.1154 13.8513 13.8513 15.0104 15.0104 15.1412 15.1412 15.4797 15.4797 k = 0.3143 0.1761 0.1232 ( 4078 PWs) bands (ev): -2.7062 -2.7062 -1.9984 -1.9984 -1.3970 -1.3970 -1.3730 -1.3730 -1.3580 -1.3580 -1.1970 -1.1970 0.6345 0.6345 0.7426 0.7426 0.7512 0.7512 0.7878 0.7878 0.8580 0.8580 0.8768 0.8768 3.3991 3.3991 4.8412 4.8412 6.3717 6.3717 6.3931 6.3931 6.4967 6.4967 7.3440 7.3440 7.4393 7.4393 7.8813 7.8813 8.6726 8.6726 8.8707 8.8707 8.8792 8.8792 8.9867 8.9867 9.1023 9.1023 9.1590 9.1590 9.7892 9.7892 9.8451 9.8451 9.9673 9.9673 10.1911 10.1911 10.2229 10.2229 10.7051 10.7051 10.7243 10.7243 10.9832 10.9832 11.4883 11.4883 11.9032 11.9032 12.0488 12.0488 13.8141 13.8141 14.9295 14.9295 15.1289 15.1289 15.4698 15.4698 k = 0.3000 0.1681 0.1176 ( 4078 PWs) bands (ev): -2.7303 -2.7303 -1.9755 -1.9755 -1.3974 -1.3974 -1.3767 -1.3767 -1.3587 -1.3587 -1.1974 -1.1974 0.6302 0.6302 0.7389 0.7389 0.7468 0.7468 0.7869 0.7869 0.8597 0.8597 0.8771 0.8771 3.4435 3.4435 4.8595 4.8595 6.3638 6.3638 6.3843 6.3843 6.4430 6.4430 7.3790 7.3790 7.4792 7.4792 7.8936 7.8936 8.7159 8.7159 8.8724 8.8724 8.8831 8.8831 8.9875 8.9875 9.1219 9.1219 9.1633 9.1633 9.7890 9.7890 9.8447 9.8447 9.9677 9.9677 10.1921 10.1921 10.2236 10.2236 10.6702 10.6702 10.7068 10.7068 10.9459 10.9459 11.4679 11.4679 11.8518 11.8518 11.9825 11.9825 13.7634 13.7634 14.8424 14.8424 15.1409 15.1409 15.4588 15.4588 k = 0.2857 0.1601 0.1120 ( 4066 PWs) bands (ev): -2.7541 -2.7541 -1.9523 -1.9523 -1.3979 -1.3979 -1.3802 -1.3802 -1.3594 -1.3594 -1.1985 -1.1985 0.6255 0.6255 0.7353 0.7353 0.7421 0.7421 0.7864 0.7864 0.8612 0.8612 0.8772 0.8772 3.4885 3.4885 4.8810 4.8810 6.3497 6.3497 6.3762 6.3762 6.3981 6.3981 7.4145 7.4145 7.5196 7.5196 7.9041 7.9041 8.7554 8.7554 8.8740 8.8740 8.8866 8.8866 8.9875 8.9875 9.1431 9.1431 9.1707 9.1707 9.7887 9.7887 9.8442 9.8442 9.9684 9.9684 10.1931 10.1931 10.2243 10.2243 10.6183 10.6183 10.7064 10.7064 10.9073 10.9073 11.4454 11.4454 11.7993 11.7993 11.9177 11.9177 13.6935 13.6935 14.7729 14.7729 15.1619 15.1619 15.4470 15.4470 k = 0.2714 0.1521 0.1064 ( 4075 PWs) bands (ev): -2.7775 -2.7775 -1.9288 -1.9288 -1.3983 -1.3983 -1.3835 -1.3835 -1.3601 -1.3601 -1.2004 -1.2004 0.6205 0.6205 0.7317 0.7317 0.7373 0.7373 0.7861 0.7861 0.8627 0.8627 0.8772 0.8772 3.5335 3.5335 4.9059 4.9059 6.3165 6.3165 6.3687 6.3687 6.3749 6.3749 7.4502 7.4502 7.5605 7.5605 7.9113 7.9113 8.7911 8.7911 8.8754 8.8754 8.8898 8.8898 8.9870 8.9870 9.1655 9.1655 9.1813 9.1813 9.7883 9.7883 9.8435 9.8435 9.9689 9.9689 10.1940 10.1940 10.2250 10.2250 10.5666 10.5666 10.7061 10.7061 10.8677 10.8677 11.4212 11.4212 11.7458 11.7458 11.8554 11.8554 13.6012 13.6012 14.7276 14.7276 15.1892 15.1892 15.4349 15.4349 k = 0.2571 0.1441 0.1008 ( 4075 PWs) bands (ev): -2.8003 -2.8003 -1.9051 -1.9051 -1.3988 -1.3988 -1.3867 -1.3867 -1.3608 -1.3608 -1.2032 -1.2032 0.6153 0.6153 0.7281 0.7281 0.7323 0.7323 0.7859 0.7859 0.8641 0.8641 0.8771 0.8771 3.5779 3.5779 4.9347 4.9347 6.2717 6.2717 6.3620 6.3620 6.3663 6.3663 7.4859 7.4859 7.6014 7.6014 7.9143 7.9143 8.8230 8.8230 8.8768 8.8768 8.8929 8.8929 8.9871 8.9871 9.1895 9.1895 9.1953 9.1953 9.7877 9.7877 9.8427 9.8427 9.9694 9.9694 10.1951 10.1951 10.2256 10.2256 10.5157 10.5157 10.7058 10.7058 10.8274 10.8274 11.3953 11.3953 11.6917 11.6917 11.7962 11.7962 13.4878 13.4878 14.7063 14.7063 15.2227 15.2227 15.4227 15.4227 k = 0.2429 0.1361 0.0952 ( 4075 PWs) bands (ev): -2.8225 -2.8225 -1.8812 -1.8812 -1.3992 -1.3992 -1.3898 -1.3898 -1.3615 -1.3615 -1.2069 -1.2069 0.6097 0.6097 0.7247 0.7247 0.7274 0.7274 0.7860 0.7860 0.8654 0.8654 0.8769 0.8769 3.6211 3.6211 4.9677 4.9677 6.2259 6.2259 6.3559 6.3559 6.3618 6.3618 7.5211 7.5211 7.6422 7.6422 7.9117 7.9117 8.8512 8.8512 8.8781 8.8781 8.8961 8.8961 8.9888 8.9888 9.2126 9.2126 9.2147 9.2147 9.7868 9.7868 9.8416 9.8416 9.9700 9.9700 10.1961 10.1961 10.2260 10.2260 10.4660 10.4660 10.7056 10.7056 10.7868 10.7868 11.3680 11.3680 11.6371 11.6371 11.7408 11.7408 13.3575 13.3575 14.7046 14.7046 15.2626 15.2626 15.4109 15.4109 k = 0.2286 0.1281 0.0896 ( 4078 PWs) bands (ev): -2.8440 -2.8440 -1.8571 -1.8571 -1.3997 -1.3997 -1.3927 -1.3927 -1.3622 -1.3622 -1.2115 -1.2115 0.6039 0.6039 0.7213 0.7213 0.7225 0.7225 0.7861 0.7861 0.8667 0.8667 0.8766 0.8766 3.6626 3.6626 5.0052 5.0052 6.1817 6.1817 6.3504 6.3504 6.3588 6.3588 7.5555 7.5555 7.6826 7.6826 7.9025 7.9025 8.8756 8.8756 8.8793 8.8793 8.8996 8.8996 8.9932 8.9932 9.2330 9.2330 9.2411 9.2411 9.7860 9.7860 9.8405 9.8405 9.9704 9.9704 10.1971 10.1971 10.2262 10.2262 10.4177 10.4177 10.7053 10.7053 10.7462 10.7462 11.3393 11.3393 11.5822 11.5822 11.6896 11.6896 13.2153 13.2153 14.7171 14.7171 15.3092 15.3092 15.3998 15.3998 k = 0.2143 0.1201 0.0840 ( 4081 PWs) bands (ev): -2.8646 -2.8646 -1.8328 -1.8328 -1.4001 -1.4001 -1.3954 -1.3954 -1.3629 -1.3629 -1.2170 -1.2170 0.5979 0.5979 0.7178 0.7178 0.7180 0.7180 0.7864 0.7864 0.8678 0.8678 0.8763 0.8763 3.7017 3.7017 5.0475 5.0475 6.1398 6.1398 6.3457 6.3457 6.3568 6.3568 7.5886 7.5886 7.7224 7.7224 7.8860 7.8860 8.8803 8.8803 8.8950 8.8950 8.9053 8.9053 9.0011 9.0011 9.2561 9.2561 9.2685 9.2685 9.7850 9.7850 9.8394 9.8394 9.9709 9.9709 10.1981 10.1981 10.2260 10.2260 10.3714 10.3714 10.7048 10.7048 10.7059 10.7059 11.3095 11.3095 11.5274 11.5274 11.6429 11.6429 13.0656 13.0656 14.7390 14.7390 15.3620 15.3620 15.3895 15.3895 k = 0.2000 0.1121 0.0784 ( 4078 PWs) bands (ev): -2.8842 -2.8842 -1.8085 -1.8085 -1.4006 -1.4006 -1.3979 -1.3979 -1.3636 -1.3636 -1.2234 -1.2234 0.5917 0.5917 0.7132 0.7132 0.7149 0.7149 0.7868 0.7868 0.8689 0.8689 0.8759 0.8759 3.7383 3.7383 5.0946 5.0946 6.1006 6.1006 6.3415 6.3415 6.3555 6.3555 7.6195 7.6195 7.7614 7.7614 7.8621 7.8621 8.8813 8.8813 8.9035 8.9035 8.9201 8.9201 9.0128 9.0128 9.2818 9.2818 9.2968 9.2968 9.7838 9.7838 9.8382 9.8382 9.9714 9.9714 10.1991 10.1991 10.2247 10.2247 10.3279 10.3279 10.6662 10.6662 10.7045 10.7045 11.2788 11.2788 11.4729 11.4729 11.6006 11.6006 12.9122 12.9122 14.7663 14.7663 15.3804 15.3804 15.4197 15.4197 k = 0.1857 0.1041 0.0728 ( 4090 PWs) bands (ev): -2.9029 -2.9029 -1.7842 -1.7842 -1.4010 -1.4010 -1.4003 -1.4003 -1.3643 -1.3643 -1.2307 -1.2307 0.5853 0.5853 0.7089 0.7089 0.7120 0.7120 0.7872 0.7872 0.8698 0.8698 0.8756 0.8756 3.7718 3.7718 5.1464 5.1464 6.0641 6.0641 6.3379 6.3379 6.3547 6.3547 7.6463 7.6463 7.7992 7.7992 7.8324 7.8324 8.8822 8.8822 8.9075 8.9075 8.9380 8.9380 9.0284 9.0284 9.3096 9.3096 9.3255 9.3255 9.7826 9.7826 9.8370 9.8370 9.9718 9.9718 10.2000 10.2000 10.2206 10.2206 10.2892 10.2892 10.6275 10.6275 10.7040 10.7040 11.2474 11.2474 11.4190 11.4190 11.5627 11.5627 12.7578 12.7578 14.7967 14.7967 15.3724 15.3724 15.4794 15.4794 k = 0.1714 0.0961 0.0672 ( 4096 PWs) bands (ev): -2.9205 -2.9205 -1.7599 -1.7599 -1.4026 -1.4026 -1.4014 -1.4014 -1.3649 -1.3649 -1.2389 -1.2389 0.5789 0.5789 0.7048 0.7048 0.7092 0.7092 0.7877 0.7877 0.8707 0.8707 0.8753 0.8753 3.8022 3.8022 5.2026 5.2026 6.0305 6.0305 6.3349 6.3349 6.3544 6.3544 7.6641 7.6641 7.8018 7.8018 7.8356 7.8356 8.8829 8.8829 8.9108 8.9108 8.9555 8.9555 9.0478 9.0478 9.3393 9.3393 9.3546 9.3546 9.7816 9.7816 9.8361 9.8361 9.9723 9.9723 10.2009 10.2009 10.2083 10.2083 10.2607 10.2607 10.5900 10.5900 10.7036 10.7036 11.2156 11.2156 11.3660 11.3660 11.5290 11.5290 12.6045 12.6045 14.8287 14.8287 15.3657 15.3657 15.5367 15.5367 k = 0.1571 0.0881 0.0616 ( 4096 PWs) bands (ev): -2.9369 -2.9369 -1.7357 -1.7357 -1.4048 -1.4048 -1.4018 -1.4018 -1.3655 -1.3655 -1.2480 -1.2480 0.5726 0.5726 0.7010 0.7010 0.7065 0.7065 0.7882 0.7882 0.8715 0.8715 0.8750 0.8750 3.8294 3.8294 5.2629 5.2629 5.9999 5.9999 6.3323 6.3323 6.3544 6.3544 7.6604 7.6604 7.7835 7.7835 7.8705 7.8705 8.8835 8.8835 8.9137 8.9137 8.9722 8.9722 9.0711 9.0711 9.3704 9.3704 9.3836 9.3836 9.7809 9.7809 9.8357 9.8357 9.9728 9.9728 10.1830 10.1830 10.2018 10.2018 10.2478 10.2478 10.5539 10.5539 10.7032 10.7032 11.1838 11.1838 11.3143 11.3143 11.4990 11.4990 12.4542 12.4542 14.8616 14.8616 15.3604 15.3604 15.5853 15.5853 k = 0.1429 0.0801 0.0560 ( 4090 PWs) bands (ev): -2.9521 -2.9521 -1.7118 -1.7118 -1.4068 -1.4068 -1.4022 -1.4022 -1.3661 -1.3661 -1.2578 -1.2578 0.5663 0.5663 0.6976 0.6976 0.7041 0.7041 0.7887 0.7887 0.8722 0.8722 0.8748 0.8748 3.8534 3.8534 5.3266 5.3266 5.9722 5.9722 6.3302 6.3302 6.3548 6.3548 7.6260 7.6260 7.7874 7.7874 7.9034 7.9034 8.8841 8.8841 8.9161 8.9161 8.9875 8.9875 9.0982 9.0982 9.4024 9.4024 9.4120 9.4120 9.7812 9.7812 9.8359 9.8359 9.9733 9.9733 10.1516 10.1516 10.2026 10.2026 10.2435 10.2435 10.5196 10.5196 10.7028 10.7028 11.1525 11.1525 11.2643 11.2643 11.4721 11.4721 12.3086 12.3086 14.8952 14.8952 15.3563 15.3563 15.6189 15.6189 k = 0.1286 0.0720 0.0504 ( 4102 PWs) bands (ev): -2.9661 -2.9661 -1.6883 -1.6883 -1.4087 -1.4087 -1.4025 -1.4025 -1.3666 -1.3666 -1.2684 -1.2684 0.5603 0.5603 0.6944 0.6944 0.7018 0.7018 0.7892 0.7892 0.8729 0.8729 0.8745 0.8745 3.8742 3.8742 5.3927 5.3927 5.9477 5.9477 6.3285 6.3285 6.3554 6.3554 7.5723 7.5723 7.8035 7.8035 7.9343 7.9343 8.8845 8.8845 8.9182 8.9182 9.0009 9.0009 9.1286 9.1286 9.4342 9.4342 9.4393 9.4393 9.7829 9.7829 9.8371 9.8371 9.9738 9.9738 10.1203 10.1203 10.2033 10.2033 10.2420 10.2420 10.4870 10.4870 10.7023 10.7023 11.1220 11.1220 11.2163 11.2163 11.4476 11.4476 12.1692 12.1692 14.9293 14.9293 15.3533 15.3533 15.6333 15.6333 k = 0.1143 0.0640 0.0448 ( 4093 PWs) bands (ev): -2.9787 -2.9787 -1.6652 -1.6652 -1.4106 -1.4106 -1.4028 -1.4028 -1.3671 -1.3671 -1.2795 -1.2795 0.5545 0.5545 0.6917 0.6917 0.6998 0.6998 0.7897 0.7897 0.8734 0.8734 0.8743 0.8743 3.8921 3.8921 5.4600 5.4600 5.9265 5.9265 6.3271 6.3271 6.3561 6.3561 7.5095 7.5095 7.8229 7.8229 7.9628 7.9628 8.8849 8.8849 8.9200 8.9200 9.0123 9.0123 9.1614 9.1614 9.4646 9.4646 9.4649 9.4649 9.7869 9.7869 9.8395 9.8395 9.9742 9.9742 10.0912 10.0912 10.2041 10.2041 10.2416 10.2416 10.4565 10.4565 10.7020 10.7020 11.0930 11.0930 11.1711 11.1711 11.4248 11.4248 12.0380 12.0380 14.9643 14.9643 15.3515 15.3515 15.6286 15.6286 k = 0.1000 0.0560 0.0392 ( 4099 PWs) bands (ev): -2.9899 -2.9899 -1.6429 -1.6429 -1.4124 -1.4124 -1.4031 -1.4031 -1.3676 -1.3676 -1.2911 -1.2911 0.5492 0.5492 0.6892 0.6892 0.6980 0.6980 0.7902 0.7902 0.8739 0.8739 0.8741 0.8741 3.9072 3.9072 5.5270 5.5270 5.9090 5.9090 6.3260 6.3260 6.3570 6.3570 7.4427 7.4427 7.8421 7.8421 7.9886 7.9886 8.8852 8.8852 8.9215 8.9215 9.0219 9.0219 9.1953 9.1953 9.4883 9.4883 9.4919 9.4919 9.7941 9.7941 9.8435 9.8435 9.9745 9.9745 10.0652 10.0652 10.2047 10.2047 10.2414 10.2414 10.4281 10.4281 10.7015 10.7015 11.0659 11.0659 11.1291 11.1291 11.4022 11.4022 11.9172 11.9172 15.0002 15.0002 15.3505 15.3505 15.6085 15.6085 k = 0.0857 0.0480 0.0336 ( 4105 PWs) bands (ev): -2.9997 -2.9997 -1.6214 -1.6214 -1.4142 -1.4142 -1.4034 -1.4034 -1.3679 -1.3679 -1.3028 -1.3028 0.5443 0.5443 0.6872 0.6872 0.6964 0.6964 0.7906 0.7906 0.8739 0.8739 0.8744 0.8744 3.9198 3.9198 5.5916 5.5916 5.8956 5.8956 6.3251 6.3251 6.3579 6.3579 7.3751 7.3751 7.8598 7.8598 8.0116 8.0116 8.8854 8.8854 8.9228 8.9228 9.0298 9.0298 9.2292 9.2292 9.5088 9.5088 9.5146 9.5146 9.8050 9.8050 9.8489 9.8489 9.9749 9.9749 10.0432 10.0432 10.2052 10.2052 10.2414 10.2414 10.4021 10.4021 10.7011 10.7011 11.0413 11.0413 11.0910 11.0910 11.3785 11.3785 11.8095 11.8095 15.0371 15.0371 15.3503 15.3503 15.5774 15.5774 k = 0.0714 0.0400 0.0280 ( 4105 PWs) bands (ev): -3.0081 -3.0081 -1.6013 -1.6013 -1.4161 -1.4161 -1.4036 -1.4036 -1.3683 -1.3683 -1.3143 -1.3143 0.5400 0.5400 0.6854 0.6854 0.6950 0.6950 0.7909 0.7909 0.8738 0.8738 0.8747 0.8747 3.9301 3.9301 5.6507 5.6507 5.8873 5.8873 6.3245 6.3245 6.3587 6.3587 7.3094 7.3094 7.8755 7.8755 8.0315 8.0315 8.8855 8.8855 8.9238 8.9238 9.0362 9.0362 9.2616 9.2616 9.5261 9.5261 9.5313 9.5313 9.8191 9.8191 9.8559 9.8559 9.9752 9.9752 10.0259 10.0259 10.2058 10.2058 10.2414 10.2414 10.3787 10.3787 10.7006 10.7006 11.0195 11.0195 11.0572 11.0572 11.3521 11.3521 11.7183 11.7183 15.0751 15.0751 15.3505 15.3505 15.5394 15.5394 k = 0.0571 0.0320 0.0224 ( 4096 PWs) bands (ev): -3.0150 -3.0150 -1.5829 -1.5829 -1.4181 -1.4181 -1.4038 -1.4038 -1.3685 -1.3685 -1.3251 -1.3251 0.5364 0.5364 0.6840 0.6840 0.6939 0.6939 0.7913 0.7913 0.8737 0.8737 0.8750 0.8750 3.9382 3.9382 5.7005 5.7005 5.8858 5.8858 6.3240 6.3240 6.3596 6.3596 7.2486 7.2486 7.8886 7.8886 8.0481 8.0481 8.8857 8.8857 8.9247 8.9247 9.0414 9.0414 9.2913 9.2913 9.5400 9.5400 9.5420 9.5420 9.8346 9.8346 9.8637 9.8637 9.9756 9.9756 10.0141 10.0141 10.2064 10.2064 10.2415 10.2415 10.3582 10.3582 10.7001 10.7001 11.0011 11.0011 11.0286 11.0286 11.3220 11.3220 11.6465 11.6465 15.1140 15.1140 15.3511 15.3511 15.4975 15.4975 k = 0.0429 0.0240 0.0168 ( 4108 PWs) bands (ev): -3.0204 -3.0204 -1.5668 -1.5668 -1.4202 -1.4202 -1.4040 -1.4040 -1.3688 -1.3688 -1.3347 -1.3347 0.5335 0.5335 0.6829 0.6829 0.6930 0.6930 0.7915 0.7915 0.8736 0.8736 0.8752 0.8752 3.9443 3.9443 5.7366 5.7366 5.8922 5.8922 6.3237 6.3237 6.3603 6.3603 7.1958 7.1958 7.8991 7.8991 8.0613 8.0613 8.8857 8.8857 8.9254 8.9254 9.0452 9.0452 9.3169 9.3169 9.5473 9.5473 9.5503 9.5503 9.8484 9.8484 9.8716 9.8716 9.9758 9.9758 10.0085 10.0085 10.2069 10.2069 10.2415 10.2415 10.3412 10.3412 10.6997 10.6997 10.9863 10.9863 11.0056 11.0056 11.2897 11.2897 11.5951 11.5951 15.1533 15.1533 15.3518 15.3518 15.4542 15.4542 k = 0.0286 0.0160 0.0112 ( 4102 PWs) bands (ev): -3.0243 -3.0243 -1.5540 -1.5540 -1.4222 -1.4222 -1.4041 -1.4041 -1.3689 -1.3689 -1.3423 -1.3423 0.5315 0.5315 0.6821 0.6821 0.6924 0.6924 0.7917 0.7917 0.8736 0.8736 0.8754 0.8754 3.9486 3.9486 5.7579 5.7579 5.9048 5.9048 6.3235 6.3235 6.3609 6.3609 7.1546 7.1546 7.9067 7.9067 8.0707 8.0707 8.8858 8.8858 8.9258 8.9258 9.0479 9.0479 9.3370 9.3370 9.5492 9.5492 9.5576 9.5576 9.8583 9.8583 9.8784 9.8784 9.9760 9.9760 10.0082 10.0082 10.2073 10.2073 10.2415 10.2415 10.3283 10.3283 10.6993 10.6993 10.9755 10.9755 10.9888 10.9888 11.2599 11.2599 11.5622 11.5622 15.1918 15.1918 15.3524 15.3524 15.4121 15.4121 k = 0.0143 0.0080 0.0056 ( 4102 PWs) bands (ev): -3.0266 -3.0266 -1.5456 -1.5456 -1.4238 -1.4238 -1.4041 -1.4041 -1.3690 -1.3690 -1.3472 -1.3472 0.5302 0.5302 0.6816 0.6816 0.6920 0.6920 0.7918 0.7918 0.8735 0.8735 0.8755 0.8755 3.9512 3.9512 5.7678 5.7678 5.9169 5.9169 6.3233 6.3233 6.3613 6.3613 7.1281 7.1281 7.9113 7.9113 8.0765 8.0765 8.8858 8.8858 8.9261 8.9261 9.0495 9.0495 9.3499 9.3499 9.5493 9.5493 9.5617 9.5617 9.8637 9.8637 9.8830 9.8830 9.9760 9.9760 10.0103 10.0103 10.2077 10.2077 10.2414 10.2414 10.3202 10.3202 10.6991 10.6991 10.9688 10.9688 10.9786 10.9786 11.2388 11.2388 11.5444 11.5444 15.2254 15.2254 15.3528 15.3528 15.3760 15.3760 k = 0.0000 0.0000 0.0000 ( 4111 PWs) bands (ev): -3.0274 -3.0274 -1.5427 -1.5427 -1.4244 -1.4244 -1.4042 -1.4042 -1.3690 -1.3690 -1.3490 -1.3490 0.5298 0.5298 0.6815 0.6815 0.6919 0.6919 0.7918 0.7918 0.8735 0.8735 0.8755 0.8755 3.9520 3.9520 5.7705 5.7705 5.9218 5.9218 6.3233 6.3233 6.3614 6.3614 7.1190 7.1190 7.9128 7.9128 8.0784 8.0784 8.8858 8.8858 8.9262 8.9262 9.0500 9.0500 9.3544 9.3544 9.5491 9.5491 9.5631 9.5631 9.8652 9.8652 9.8847 9.8847 9.9759 9.9759 10.0114 10.0114 10.2078 10.2078 10.2414 10.2414 10.3175 10.3175 10.6990 10.6990 10.9666 10.9666 10.9751 10.9751 11.2311 11.2311 11.5388 11.5388 15.2411 15.2411 15.3530 15.3530 15.3594 15.3594 k = 0.0000 0.0000 0.0000 ( 4111 PWs) bands (ev): -3.0274 -3.0274 -1.5427 -1.5427 -1.4244 -1.4244 -1.4042 -1.4042 -1.3690 -1.3690 -1.3490 -1.3490 0.5298 0.5298 0.6815 0.6815 0.6919 0.6919 0.7918 0.7918 0.8735 0.8735 0.8755 0.8755 3.9520 3.9520 5.7705 5.7705 5.9218 5.9218 6.3233 6.3233 6.3614 6.3614 7.1190 7.1190 7.9128 7.9128 8.0784 8.0784 8.8858 8.8858 8.9262 8.9262 9.0500 9.0500 9.3544 9.3544 9.5491 9.5491 9.5631 9.5631 9.8652 9.8652 9.8847 9.8847 9.9759 9.9759 10.0114 10.0114 10.2078 10.2078 10.2414 10.2414 10.3175 10.3175 10.6990 10.6990 10.9666 10.9666 10.9751 10.9751 11.2311 11.2311 11.5388 11.5388 15.2411 15.2411 15.3530 15.3530 15.3594 15.3594 k = 0.0087-0.0053-0.0145 ( 4107 PWs) bands (ev): -3.0266 -3.0266 -1.5455 -1.5455 -1.4241 -1.4241 -1.4038 -1.4038 -1.3677 -1.3677 -1.3487 -1.3487 0.5302 0.5302 0.6816 0.6816 0.6919 0.6919 0.7919 0.7919 0.8735 0.8735 0.8755 0.8755 3.9514 3.9514 5.7687 5.7687 5.9218 5.9218 6.3224 6.3224 6.3606 6.3606 7.1181 7.1181 7.9132 7.9132 8.0781 8.0781 8.8857 8.8857 8.9261 8.9261 9.0513 9.0513 9.3515 9.3515 9.5493 9.5493 9.5634 9.5634 9.8633 9.8633 9.8800 9.8800 9.9758 9.9758 10.0100 10.0100 10.2121 10.2121 10.2327 10.2327 10.3197 10.3197 10.7042 10.7042 10.9711 10.9711 10.9778 10.9778 11.2377 11.2377 11.5422 11.5422 15.2288 15.2288 15.3600 15.3600 15.3666 15.3666 k = 0.0173-0.0106-0.0290 ( 4103 PWs) bands (ev): -3.0243 -3.0243 -1.5535 -1.5535 -1.4234 -1.4234 -1.4029 -1.4029 -1.3640 -1.3640 -1.3476 -1.3476 0.5315 0.5315 0.6821 0.6821 0.6922 0.6922 0.7919 0.7919 0.8735 0.8735 0.8757 0.8757 3.9495 3.9495 5.7630 5.7630 5.9221 5.9221 6.3197 6.3197 6.3584 6.3584 7.1154 7.1154 7.9142 7.9142 8.0773 8.0773 8.8854 8.8854 8.9260 8.9260 9.0550 9.0550 9.3430 9.3430 9.5498 9.5498 9.5644 9.5644 9.8531 9.8531 9.8706 9.8706 9.9750 9.9750 10.0072 10.0072 10.2062 10.2062 10.2267 10.2267 10.3258 10.3258 10.7179 10.7179 10.9813 10.9813 10.9885 10.9885 11.2575 11.2575 11.5531 11.5531 15.2005 15.2005 15.3649 15.3649 15.3957 15.3957 k = 0.0260-0.0159-0.0435 ( 4099 PWs) bands (ev): -3.0205 -3.0205 -1.5656 -1.5656 -1.4225 -1.4225 -1.4018 -1.4018 -1.3591 -1.3591 -1.3451 -1.3451 0.5337 0.5337 0.6828 0.6828 0.6926 0.6926 0.7919 0.7919 0.8734 0.8734 0.8761 0.8761 3.9463 3.9463 5.7526 5.7526 5.9232 5.9232 6.3157 6.3157 6.3550 6.3550 7.1109 7.1109 7.9158 7.9158 8.0761 8.0761 8.8848 8.8848 8.9258 8.9258 9.0610 9.0610 9.3296 9.3296 9.5503 9.5503 9.5658 9.5658 9.8285 9.8285 9.8633 9.8633 9.9736 9.9736 10.0055 10.0055 10.1746 10.1746 10.2411 10.2411 10.3354 10.3354 10.7368 10.7368 10.9909 10.9909 11.0111 11.0111 11.2890 11.2890 11.5732 11.5732 15.1651 15.1651 15.3724 15.3724 15.4325 15.4325 k = 0.0346-0.0212-0.0581 ( 4095 PWs) bands (ev): -3.0152 -3.0152 -1.5809 -1.5809 -1.4218 -1.4218 -1.4005 -1.4005 -1.3551 -1.3551 -1.3396 -1.3396 0.5366 0.5366 0.6839 0.6839 0.6931 0.6931 0.7919 0.7919 0.8731 0.8731 0.8767 0.8767 3.9420 3.9420 5.7367 5.7367 5.9257 5.9257 6.3108 6.3108 6.3509 6.3509 7.1045 7.1045 7.9176 7.9176 8.0744 8.0744 8.8837 8.8837 8.9255 8.9255 9.0688 9.0688 9.3123 9.3123 9.5506 9.5506 9.5676 9.5676 9.7944 9.7944 9.8545 9.8545 9.9715 9.9715 10.0057 10.0057 10.1404 10.1404 10.2554 10.2554 10.3485 10.3485 10.7579 10.7579 11.0006 11.0006 11.0428 11.0428 11.3286 11.3286 11.6057 11.6057 15.1253 15.1253 15.3825 15.3825 15.4735 15.4735 k = 0.0433-0.0265-0.0726 ( 4089 PWs) bands (ev): -3.0085 -3.0085 -1.5985 -1.5985 -1.4211 -1.4211 -1.3993 -1.3993 -1.3528 -1.3528 -1.3309 -1.3309 0.5403 0.5403 0.6852 0.6852 0.6939 0.6939 0.7919 0.7919 0.8726 0.8726 0.8777 0.8777 3.9365 3.9365 5.7143 5.7143 5.9303 5.9303 6.3053 6.3053 6.3466 6.3466 7.0960 7.0960 7.9195 7.9195 8.0725 8.0725 8.8819 8.8819 8.9254 8.9254 9.0777 9.0777 9.2923 9.2923 9.5504 9.5504 9.5698 9.5698 9.7551 9.7551 9.8414 9.8414 9.9688 9.9688 10.0071 10.0071 10.1100 10.1100 10.2672 10.2672 10.3645 10.3645 10.7803 10.7803 11.0098 11.0098 11.0827 11.0827 11.3705 11.3705 11.6549 11.6549 15.0814 15.0814 15.3951 15.3951 15.5175 15.5175 k = 0.0519-0.0318-0.0871 ( 4093 PWs) bands (ev): -3.0002 -3.0002 -1.6178 -1.6178 -1.4205 -1.4205 -1.3981 -1.3981 -1.3514 -1.3514 -1.3207 -1.3207 0.5448 0.5448 0.6867 0.6867 0.6948 0.6948 0.7919 0.7919 0.8721 0.8721 0.8789 0.8789 3.9298 3.9298 5.6848 5.6848 5.9373 5.9373 6.2996 6.2996 6.3430 6.3430 7.0852 7.0852 7.9212 7.9212 8.0703 8.0703 8.8792 8.8792 8.9253 8.9253 9.0869 9.0869 9.2712 9.2712 9.5492 9.5492 9.5721 9.5721 9.7130 9.7130 9.8224 9.8224 9.9661 9.9661 10.0088 10.0088 10.0872 10.0872 10.2761 10.2761 10.3820 10.3820 10.8038 10.8038 11.0180 11.0180 11.1304 11.1304 11.4093 11.4093 11.7235 11.7235 15.0329 15.0329 15.4099 15.4099 15.5640 15.5640 k = 0.0606-0.0371-0.1016 ( 4101 PWs) bands (ev): -2.9906 -2.9906 -1.6384 -1.6384 -1.4200 -1.4200 -1.3969 -1.3969 -1.3503 -1.3503 -1.3098 -1.3098 0.5498 0.5498 0.6885 0.6885 0.6960 0.6960 0.7919 0.7919 0.8714 0.8714 0.8803 0.8803 3.9221 3.9221 5.6481 5.6481 5.9469 5.9469 6.2934 6.2934 6.3410 6.3410 7.0720 7.0720 7.9225 7.9225 8.0678 8.0678 8.8752 8.8752 8.9251 8.9251 9.0950 9.0950 9.2506 9.2506 9.5463 9.5463 9.5743 9.5743 9.6703 9.6703 9.7977 9.7977 9.9637 9.9637 10.0099 10.0099 10.0734 10.0734 10.2826 10.2826 10.3993 10.3993 10.8290 10.8290 11.0255 11.0255 11.1856 11.1856 11.4427 11.4427 11.8109 11.8109 14.9793 14.9793 15.4262 15.4262 15.6124 15.6124 k = 0.0693-0.0424-0.1161 ( 4095 PWs) bands (ev): -2.9795 -2.9795 -1.6599 -1.6599 -1.4195 -1.4195 -1.3957 -1.3957 -1.3492 -1.3492 -1.2989 -1.2989 0.5554 0.5554 0.6905 0.6905 0.6974 0.6974 0.7919 0.7919 0.8706 0.8706 0.8820 0.8820 3.9134 3.9134 5.6044 5.6044 5.9592 5.9592 6.2865 6.2865 6.3416 6.3416 7.0562 7.0562 7.9235 7.9235 8.0652 8.0652 8.8701 8.8701 8.9247 8.9247 9.1002 9.1002 9.2328 9.2328 9.5413 9.5413 9.5749 9.5749 9.6301 9.6301 9.7693 9.7693 9.9625 9.9625 10.0100 10.0100 10.0676 10.0676 10.2876 10.2876 10.4155 10.4155 10.8565 10.8565 11.0325 11.0325 11.2475 11.2475 11.4720 11.4720 11.9141 11.9141 14.9199 14.9199 15.4438 15.4438 15.6625 15.6625 k = 0.0779-0.0477-0.1306 ( 4093 PWs) bands (ev): -2.9671 -2.9671 -1.6822 -1.6822 -1.4189 -1.4189 -1.3944 -1.3944 -1.3481 -1.3481 -1.2882 -1.2882 0.5614 0.5614 0.6925 0.6925 0.6992 0.6992 0.7918 0.7918 0.8697 0.8697 0.8839 0.8839 3.9038 3.9038 5.5542 5.5542 5.9741 5.9741 6.2789 6.2789 6.3455 6.3455 7.0376 7.0376 7.9241 7.9241 8.0622 8.0622 8.8634 8.8634 8.9237 8.9237 9.1005 9.1005 9.2197 9.2197 9.5325 9.5325 9.5658 9.5658 9.6029 9.6029 9.7396 9.7396 9.9626 9.9626 10.0095 10.0095 10.0673 10.0673 10.2913 10.2913 10.4297 10.4297 10.8866 10.8866 11.0396 11.0396 11.3152 11.3152 11.4991 11.4991 12.0291 12.0291 14.8543 14.8543 15.4618 15.4618 15.7139 15.7139 k = 0.0866-0.0530-0.1451 ( 4103 PWs) bands (ev): -2.9533 -2.9533 -1.7050 -1.7050 -1.4184 -1.4184 -1.3930 -1.3930 -1.3469 -1.3469 -1.2779 -1.2779 0.5679 0.5679 0.6944 0.6944 0.7014 0.7014 0.7917 0.7917 0.8687 0.8687 0.8861 0.8861 3.8933 3.8933 5.4982 5.4982 5.9915 5.9915 6.2707 6.2707 6.3528 6.3528 7.0162 7.0162 7.9245 7.9245 8.0588 8.0588 8.8550 8.8550 8.9216 8.9216 9.0954 9.0954 9.2119 9.2119 9.5139 9.5139 9.5442 9.5442 9.5978 9.5978 9.7114 9.7114 9.9636 9.9636 10.0088 10.0088 10.0699 10.0699 10.2939 10.2939 10.4414 10.4414 10.9192 10.9192 11.0476 11.0476 11.3870 11.3870 11.5260 11.5260 12.1532 12.1532 14.7825 14.7825 15.4796 15.4796 15.7662 15.7662 k = 0.0952-0.0583-0.1596 ( 4113 PWs) bands (ev): -2.9383 -2.9383 -1.7282 -1.7282 -1.4179 -1.4179 -1.3916 -1.3916 -1.3457 -1.3457 -1.2682 -1.2682 0.5746 0.5746 0.6963 0.6963 0.7041 0.7041 0.7915 0.7915 0.8676 0.8676 0.8885 0.8885 3.8821 3.8821 5.4372 5.4372 6.0112 6.0112 6.2621 6.2621 6.3635 6.3635 6.9916 6.9916 7.9248 7.9248 8.0550 8.0550 8.8448 8.8448 8.9179 8.9179 9.0864 9.0864 9.2075 9.2075 9.4828 9.4828 9.5291 9.5291 9.5996 9.5996 9.6866 9.6866 9.9655 9.9655 10.0085 10.0085 10.0740 10.0740 10.2958 10.2958 10.4505 10.4505 10.9532 10.9532 11.0578 11.0578 11.4595 11.4595 11.5565 11.5565 12.2842 12.2842 14.7048 14.7048 15.4965 15.4965 15.8194 15.8194 k = 0.1039-0.0636-0.1742 ( 4111 PWs) bands (ev): -2.9221 -2.9221 -1.7517 -1.7517 -1.4174 -1.4174 -1.3901 -1.3901 -1.3444 -1.3444 -1.2591 -1.2591 0.5815 0.5815 0.6980 0.6980 0.7073 0.7073 0.7913 0.7913 0.8664 0.8664 0.8911 0.8911 3.8702 3.8702 5.3719 5.3719 6.0332 6.0332 6.2537 6.2537 6.3773 6.3773 6.9641 6.9641 7.9253 7.9253 8.0507 8.0507 8.8325 8.8325 8.9122 8.9122 9.0763 9.0763 9.2033 9.2033 9.4492 9.4492 9.5179 9.5179 9.6009 9.6009 9.6677 9.6677 9.9678 9.9678 10.0086 10.0086 10.0787 10.0787 10.2970 10.2970 10.4572 10.4572 10.9853 10.9853 11.0740 11.0740 11.5221 11.5221 11.6007 11.6007 12.4203 12.4203 14.6219 14.6219 15.5119 15.5119 15.8736 15.8736 k = 0.1126-0.0689-0.1887 ( 4113 PWs) bands (ev): -2.9047 -2.9047 -1.7755 -1.7755 -1.4168 -1.4168 -1.3885 -1.3885 -1.3430 -1.3430 -1.2508 -1.2508 0.5885 0.5885 0.6998 0.6998 0.7108 0.7108 0.7910 0.7910 0.8653 0.8653 0.8939 0.8939 3.8579 3.8579 5.3031 5.3031 6.0573 6.0573 6.2459 6.2459 6.3941 6.3941 6.9334 6.9334 7.9259 7.9259 8.0459 8.0459 8.8180 8.8180 8.9042 8.9042 9.0671 9.0671 9.1968 9.1968 9.4180 9.4180 9.5083 9.5083 9.5984 9.5984 9.6569 9.6569 9.9703 9.9703 10.0093 10.0093 10.0833 10.0833 10.2975 10.2975 10.4615 10.4615 11.0102 11.0102 11.1016 11.1016 11.5626 11.5626 11.6701 11.6701 12.5603 12.5603 14.5347 14.5347 15.5254 15.5254 15.9292 15.9292 k = 0.1212-0.0742-0.2032 ( 4105 PWs) bands (ev): -2.8862 -2.8862 -1.7993 -1.7993 -1.4162 -1.4162 -1.3869 -1.3869 -1.3414 -1.3414 -1.2431 -1.2431 0.5956 0.5956 0.7014 0.7014 0.7147 0.7147 0.7907 0.7907 0.8640 0.8640 0.8969 0.8969 3.8452 3.8452 5.2315 5.2315 6.0835 6.0835 6.2389 6.2389 6.4136 6.4136 6.8998 6.8998 7.9268 7.9268 8.0407 8.0407 8.8011 8.8011 8.8941 8.8941 9.0596 9.0596 9.1870 9.1870 9.3902 9.3902 9.5008 9.5008 9.5904 9.5904 9.6552 9.6552 9.9726 9.9726 10.0108 10.0108 10.0877 10.0877 10.2976 10.2976 10.4638 10.4638 11.0257 11.0257 11.1424 11.1424 11.5898 11.5898 11.7551 11.7551 12.7030 12.7030 14.4449 14.4449 15.5368 15.5368 15.9866 15.9866 k = 0.1299-0.0795-0.2177 ( 4103 PWs) bands (ev): -2.8668 -2.8668 -1.8232 -1.8232 -1.4156 -1.4156 -1.3852 -1.3852 -1.3398 -1.3398 -1.2362 -1.2362 0.6026 0.6026 0.7031 0.7031 0.7190 0.7190 0.7903 0.7903 0.8627 0.8627 0.9000 0.9000 3.8323 3.8323 5.1576 5.1576 6.1115 6.1115 6.2332 6.2332 6.4356 6.4356 6.8632 6.8632 7.9280 7.9280 8.0351 8.0351 8.7819 8.7819 8.8818 8.8818 9.0534 9.0534 9.1745 9.1745 9.3655 9.3655 9.4959 9.4959 9.5791 9.5791 9.6597 9.6597 9.9744 9.9744 10.0129 10.0129 10.0916 10.0916 10.2973 10.2973 10.4642 10.4642 11.0352 11.0352 11.1931 11.1931 11.6115 11.6115 11.8468 11.8468 12.8472 12.8472 14.3541 14.3541 15.5463 15.5463 16.0460 16.0460 k = 0.1385-0.0848-0.2322 ( 4111 PWs) bands (ev): -2.8463 -2.8463 -1.8470 -1.8470 -1.4150 -1.4150 -1.3834 -1.3834 -1.3380 -1.3380 -1.2301 -1.2301 0.6095 0.6095 0.7048 0.7048 0.7234 0.7234 0.7899 0.7899 0.8614 0.8614 0.9032 0.9032 3.8192 3.8192 5.0820 5.0820 6.1409 6.1409 6.2294 6.2294 6.4600 6.4600 6.8241 6.8241 7.9295 7.9295 8.0293 8.0293 8.7603 8.7603 8.8677 8.8677 9.0476 9.0476 9.1613 9.1613 9.3431 9.3431 9.4933 9.4933 9.5672 9.5672 9.6672 9.6672 9.9757 9.9757 10.0155 10.0155 10.0949 10.0949 10.2966 10.2966 10.4630 10.4630 11.0416 11.0416 11.2503 11.2503 11.6297 11.6297 11.9421 11.9421 12.9913 12.9913 14.2646 14.2646 15.5541 15.5541 16.1071 16.1071 k = 0.1472-0.0901-0.2467 ( 4113 PWs) bands (ev): -2.8250 -2.8250 -1.8707 -1.8707 -1.4144 -1.4144 -1.3817 -1.3817 -1.3362 -1.3362 -1.2248 -1.2248 0.6162 0.6162 0.7065 0.7065 0.7281 0.7281 0.7895 0.7895 0.8601 0.8601 0.9065 0.9065 3.8061 3.8061 5.0052 5.0052 6.1703 6.1703 6.2289 6.2289 6.4867 6.4867 6.7825 6.7825 7.9312 7.9312 8.0234 8.0234 8.7368 8.7368 8.8516 8.8516 9.0409 9.0409 9.1502 9.1502 9.3225 9.3225 9.4922 9.4922 9.5565 9.5565 9.6763 9.6763 9.9763 9.9763 10.0185 10.0185 10.0979 10.0979 10.2957 10.2957 10.4606 10.4606 11.0466 11.0466 11.3124 11.3124 11.6444 11.6444 12.0398 12.0398 13.1334 13.1334 14.1795 14.1795 15.5606 15.5606 16.1687 16.1687 k = 0.1558-0.0954-0.2612 ( 4119 PWs) bands (ev): -2.8030 -2.8030 -1.8943 -1.8943 -1.4137 -1.4137 -1.3799 -1.3799 -1.3342 -1.3342 -1.2202 -1.2202 0.6228 0.6228 0.7082 0.7082 0.7330 0.7330 0.7890 0.7890 0.8587 0.8587 0.9097 0.9097 3.7932 3.7932 4.9277 4.9277 6.1949 6.1949 6.2367 6.2367 6.5154 6.5154 6.7390 6.7390 7.9329 7.9329 8.0175 8.0175 8.7114 8.7114 8.8336 8.8336 9.0326 9.0326 9.1428 9.1428 9.3034 9.3034 9.4902 9.4902 9.5487 9.5487 9.6861 9.6861 9.9763 9.9763 10.0215 10.0215 10.1006 10.1006 10.2946 10.2946 10.4571 10.4571 11.0507 11.0507 11.3784 11.3784 11.6553 11.6553 12.1389 12.1389 13.2701 13.2701 14.1030 14.1030 15.5663 15.5663 16.2287 16.2287 k = 0.1645-0.1007-0.2758 ( 4117 PWs) bands (ev): -2.7802 -2.7802 -1.9176 -1.9176 -1.4131 -1.4131 -1.3780 -1.3780 -1.3320 -1.3320 -1.2163 -1.2163 0.6292 0.6292 0.7099 0.7099 0.7380 0.7380 0.7886 0.7886 0.8574 0.8574 0.9129 0.9129 3.7807 3.7807 4.8498 4.8498 6.2065 6.2065 6.2606 6.2606 6.5460 6.5460 6.6940 6.6940 7.9346 7.9346 8.0118 8.0118 8.6846 8.6846 8.8134 8.8134 9.0231 9.0231 9.1396 9.1396 9.2859 9.2859 9.4853 9.4853 9.5456 9.5456 9.6962 9.6962 9.9758 9.9758 10.0241 10.0241 10.1032 10.1032 10.2933 10.2933 10.4528 10.4528 11.0543 11.0543 11.4475 11.4475 11.6619 11.6619 12.2389 12.2389 13.3950 13.3950 14.0426 14.0426 15.5714 15.5714 16.2832 16.2832 k = 0.1732-0.1060-0.2903 ( 4119 PWs) bands (ev): -2.7569 -2.7569 -1.9407 -1.9407 -1.4124 -1.4124 -1.3762 -1.3762 -1.3297 -1.3297 -1.2132 -1.2132 0.6353 0.6353 0.7115 0.7115 0.7431 0.7431 0.7883 0.7883 0.8560 0.8560 0.9159 0.9159 3.7685 3.7685 4.7721 4.7721 6.2106 6.2106 6.2951 6.2951 6.5784 6.5784 6.6484 6.6484 7.9359 7.9359 8.0063 8.0063 8.6566 8.6566 8.7909 8.7909 9.0134 9.0134 9.1398 9.1398 9.2702 9.2702 9.4766 9.4766 9.5476 9.5476 9.7061 9.7061 9.9748 9.9748 10.0259 10.0259 10.1059 10.1059 10.2919 10.2919 10.4478 10.4478 11.0575 11.0575 11.5190 11.5190 11.6637 11.6637 12.3389 12.3389 13.4952 13.4952 14.0122 14.0122 15.5762 15.5762 16.3273 16.3273 k = 0.1818-0.1113-0.3048 ( 4129 PWs) bands (ev): -2.7331 -2.7331 -1.9634 -1.9634 -1.4117 -1.4117 -1.3744 -1.3744 -1.3273 -1.3273 -1.2108 -1.2108 0.6411 0.6411 0.7132 0.7132 0.7483 0.7483 0.7880 0.7880 0.8546 0.8546 0.9187 0.9187 3.7569 3.7569 4.6947 4.6947 6.2127 6.2127 6.3338 6.3338 6.6002 6.6002 6.6153 6.6153 7.9369 7.9369 8.0010 8.0010 8.6276 8.6276 8.7663 8.7663 9.0044 9.0044 9.1422 9.1422 9.2570 9.2570 9.4648 9.4648 9.5532 9.5532 9.7158 9.7158 9.9733 9.9733 10.0265 10.0265 10.1091 10.1091 10.2903 10.2903 10.4424 10.4424 11.0606 11.0606 11.5900 11.5900 11.6627 11.6627 12.4384 12.4384 13.5521 13.5521 14.0310 14.0310 15.5808 15.5808 16.3582 16.3582 k = 0.1905-0.1166-0.3193 ( 4135 PWs) bands (ev): -2.7089 -2.7089 -1.9858 -1.9858 -1.4110 -1.4110 -1.3725 -1.3725 -1.3247 -1.3247 -1.2091 -1.2091 0.6467 0.6467 0.7148 0.7148 0.7536 0.7536 0.7878 0.7878 0.8533 0.8533 0.9212 0.9212 3.7461 3.7461 4.6181 4.6181 6.2137 6.2137 6.3750 6.3750 6.5581 6.5581 6.6494 6.6494 7.9371 7.9371 7.9959 7.9959 8.5978 8.5978 8.7397 8.7397 8.9966 8.9966 9.1452 9.1452 9.2470 9.2470 9.4516 9.4516 9.5609 9.5609 9.7251 9.7251 9.9713 9.9713 10.0258 10.0258 10.1128 10.1128 10.2887 10.2887 10.4369 10.4369 11.0634 11.0634 11.6311 11.6311 11.6874 11.6874 12.5367 12.5367 13.5615 13.5615 14.1038 14.1038 15.5854 15.5854 16.3775 16.3775 k = 0.1991-0.1219-0.3338 ( 4131 PWs) bands (ev): -2.6844 -2.6844 -2.0078 -2.0078 -1.4103 -1.4103 -1.3707 -1.3707 -1.3220 -1.3220 -1.2080 -1.2080 0.6519 0.6519 0.7163 0.7163 0.7588 0.7588 0.7879 0.7879 0.8520 0.8520 0.9235 0.9235 3.7360 3.7360 4.5426 4.5426 6.2122 6.2122 6.4176 6.4176 6.5184 6.5184 6.6868 6.6868 7.9366 7.9366 7.9909 7.9909 8.5675 8.5675 8.7115 8.7115 8.9904 8.9904 9.1475 9.1475 9.2410 9.2410 9.4376 9.4376 9.5697 9.5697 9.7340 9.7340 9.9689 9.9689 10.0238 10.0238 10.1172 10.1172 10.2872 10.2872 10.4312 10.4312 11.0661 11.0661 11.6201 11.6201 11.7593 11.7593 12.6331 12.6331 13.5427 13.5427 14.2117 14.2117 15.5897 15.5897 16.3891 16.3891 k = 0.2078-0.1272-0.3483 ( 4123 PWs) bands (ev): -2.6598 -2.6598 -2.0293 -2.0293 -1.4095 -1.4095 -1.3689 -1.3689 -1.3190 -1.3190 -1.2075 -1.2075 0.6569 0.6569 0.7177 0.7177 0.7639 0.7639 0.7882 0.7882 0.8507 0.8507 0.9254 0.9254 3.7268 3.7268 4.4684 4.4684 6.2057 6.2057 6.4567 6.4567 6.4906 6.4906 6.7255 6.7255 7.9351 7.9351 7.9858 7.9858 8.5369 8.5369 8.6821 8.6821 8.9855 8.9855 9.1481 9.1481 9.2399 9.2399 9.4235 9.4235 9.5789 9.5789 9.7425 9.7425 9.9660 9.9660 10.0206 10.0206 10.1222 10.1222 10.2857 10.2857 10.4257 10.4257 11.0687 11.0687 11.5964 11.5964 11.8390 11.8390 12.7271 12.7271 13.5146 13.5146 14.3354 14.3354 15.5936 15.5936 16.3963 16.3963 k = 0.2165-0.1325-0.3628 ( 4115 PWs) bands (ev): -2.6352 -2.6352 -2.0504 -2.0504 -1.4088 -1.4088 -1.3671 -1.3671 -1.3160 -1.3160 -1.2076 -1.2076 0.6616 0.6616 0.7191 0.7191 0.7687 0.7687 0.7890 0.7890 0.8495 0.8495 0.9269 0.9269 3.7186 3.7186 4.3960 4.3960 6.1910 6.1910 6.4542 6.4542 6.5160 6.5160 6.7656 6.7656 7.9322 7.9322 7.9804 7.9804 8.5063 8.5063 8.6519 8.6519 8.9815 8.9815 9.1467 9.1467 9.2436 9.2436 9.4096 9.4096 9.5878 9.5878 9.7506 9.7506 9.9626 9.9626 10.0163 10.0163 10.1277 10.1277 10.2843 10.2843 10.4204 10.4204 11.0711 11.0711 11.5653 11.5653 11.9211 11.9211 12.8178 12.8178 13.4868 13.4868 14.4648 14.4648 15.5969 15.5969 16.4016 16.4016 k = 0.2251-0.1378-0.3774 ( 4107 PWs) bands (ev): -2.6106 -2.6106 -2.0710 -2.0710 -1.4081 -1.4081 -1.3653 -1.3653 -1.3127 -1.3127 -1.2081 -1.2081 0.6660 0.6660 0.7203 0.7203 0.7730 0.7730 0.7904 0.7904 0.8484 0.8484 0.9280 0.9280 3.7112 3.7112 4.3256 4.3256 6.1658 6.1658 6.4449 6.4449 6.5626 6.5626 6.8067 6.8067 7.9275 7.9275 7.9746 7.9746 8.4758 8.4758 8.6214 8.6214 8.9783 8.9783 9.1438 9.1438 9.2514 9.2514 9.3964 9.3964 9.5961 9.5961 9.7585 9.7585 9.9586 9.9586 10.0111 10.0111 10.1334 10.1334 10.2829 10.2829 10.4154 10.4154 11.0731 11.0731 11.5285 11.5285 12.0045 12.0045 12.9046 12.9046 13.4637 13.4637 14.5945 14.5945 15.5993 15.5993 16.4065 16.4065 k = 0.2338-0.1431-0.3919 ( 4109 PWs) bands (ev): -2.5862 -2.5862 -2.0910 -2.0910 -1.4074 -1.4074 -1.3636 -1.3636 -1.3094 -1.3094 -1.2092 -1.2092 0.6702 0.6702 0.7214 0.7214 0.7767 0.7767 0.7926 0.7926 0.8474 0.8474 0.9287 0.9287 3.7048 3.7048 4.2576 4.2576 6.1304 6.1304 6.4468 6.4468 6.6119 6.6119 6.8486 6.8486 7.9203 7.9203 7.9683 7.9683 8.4457 8.4457 8.5912 8.5912 8.9754 8.9754 9.1403 9.1403 9.2623 9.2623 9.3841 9.3841 9.6032 9.6032 9.7662 9.7662 9.9540 9.9540 10.0054 10.0054 10.1393 10.1393 10.2815 10.2815 10.4108 10.4108 11.0746 11.0746 11.4872 11.4872 12.0886 12.0886 12.9867 12.9867 13.4469 13.4469 14.7214 14.7214 15.6006 15.6006 16.4122 16.4122 k = 0.2424-0.1484-0.4064 ( 4103 PWs) bands (ev): -2.5621 -2.5621 -2.1105 -2.1105 -1.4066 -1.4066 -1.3619 -1.3619 -1.3059 -1.3059 -1.2105 -1.2105 0.6740 0.6740 0.7223 0.7223 0.7796 0.7796 0.7956 0.7956 0.8466 0.8466 0.9290 0.9290 3.6990 3.6990 4.1926 4.1926 6.0874 6.0874 6.4589 6.4589 6.6627 6.6627 6.8912 6.8912 7.9097 7.9097 7.9616 7.9616 8.4164 8.4164 8.5621 8.5621 8.9724 8.9724 9.1368 9.1368 9.2751 9.2751 9.3734 9.3734 9.6090 9.6090 9.7738 9.7738 9.9488 9.9488 9.9994 9.9994 10.1454 10.1454 10.2803 10.2803 10.4067 10.4067 11.0752 11.0752 11.4432 11.4432 12.1730 12.1730 13.0634 13.0634 13.4370 13.4370 14.8431 14.8431 15.6008 15.6008 16.4196 16.4196 k = 0.2511-0.1537-0.4209 ( 4113 PWs) bands (ev): -2.5385 -2.5385 -2.1294 -2.1294 -1.4060 -1.4060 -1.3603 -1.3603 -1.3024 -1.3024 -1.2121 -1.2121 0.6775 0.6775 0.7230 0.7230 0.7818 0.7818 0.7992 0.7992 0.8459 0.8459 0.9288 0.9288 3.6936 3.6936 4.1311 4.1311 6.0393 6.0393 6.4788 6.4788 6.7146 6.7146 6.9340 6.9340 7.8946 7.8946 7.9546 7.9546 8.3880 8.3880 8.5348 8.5348 8.9689 8.9689 9.1337 9.1337 9.2889 9.2889 9.3647 9.3647 9.6131 9.6131 9.7815 9.7815 9.9431 9.9431 9.9933 9.9933 10.1513 10.1513 10.2790 10.2790 10.4030 10.4030 11.0745 11.0745 11.3984 11.3984 12.2570 12.2570 13.1340 13.1340 13.4341 13.4341 14.9576 14.9576 15.6003 15.6003 16.4290 16.4290 k = 0.2597-0.1590-0.4354 ( 4111 PWs) bands (ev): -2.5154 -2.5154 -2.1476 -2.1476 -1.4053 -1.4053 -1.3587 -1.3587 -1.2989 -1.2989 -1.2137 -1.2137 0.6808 0.6808 0.7235 0.7235 0.7838 0.7838 0.8031 0.8031 0.8456 0.8456 0.9284 0.9284 3.6879 3.6879 4.0741 4.0741 5.9882 5.9882 6.5047 6.5047 6.7674 6.7674 6.9768 6.9768 7.8741 7.8741 7.9473 7.9473 8.3609 8.3609 8.5105 8.5105 8.9649 8.9649 9.1312 9.1312 9.3025 9.3025 9.3592 9.3592 9.6154 9.6154 9.7891 9.7891 9.9371 9.9371 9.9873 9.9873 10.1574 10.1574 10.2779 10.2779 10.3999 10.3999 11.0715 11.0715 11.3549 11.3549 12.3401 12.3401 13.1977 13.1977 13.4381 13.4381 15.0625 15.0625 15.5999 15.5999 16.4407 16.4407 k = 0.2684-0.1643-0.4499 ( 4113 PWs) bands (ev): -2.4929 -2.4929 -2.1653 -2.1653 -1.4046 -1.4046 -1.3573 -1.3573 -1.2956 -1.2956 -1.2153 -1.2153 0.6838 0.6838 0.7239 0.7239 0.7855 0.7855 0.8069 0.8069 0.8456 0.8456 0.9277 0.9277 3.6809 3.6809 4.0229 4.0229 5.9355 5.9355 6.5353 6.5353 6.8208 6.8208 7.0190 7.0190 7.8477 7.8477 7.9397 7.9397 8.3352 8.3352 8.4901 8.4901 8.9601 8.9601 9.1290 9.1290 9.3139 9.3139 9.3588 9.3588 9.6159 9.6159 9.7966 9.7966 9.9311 9.9311 9.9815 9.9815 10.1632 10.1632 10.2767 10.2767 10.3973 10.3973 11.0648 11.0648 11.3155 11.3155 12.4215 12.4215 13.2536 13.2536 13.4489 13.4489 15.1551 15.1551 15.6015 15.6015 16.4547 16.4547 k = 0.2771-0.1696-0.4644 ( 4115 PWs) bands (ev): -2.4712 -2.4712 -2.1824 -2.1824 -1.4040 -1.4040 -1.3559 -1.3559 -1.2927 -1.2927 -1.2165 -1.2165 0.6866 0.6866 0.7240 0.7240 0.7873 0.7873 0.8103 0.8103 0.8461 0.8461 0.9268 0.9268 3.6712 3.6712 3.9790 3.9790 5.8820 5.8820 6.5698 6.5698 6.8745 6.8745 7.0598 7.0598 7.8153 7.8153 7.9317 7.9317 8.3109 8.3109 8.4744 8.4744 8.9544 8.9544 9.1270 9.1270 9.3207 9.3207 9.3655 9.3655 9.6146 9.6146 9.8036 9.8036 9.9254 9.9254 9.9759 9.9759 10.1691 10.1691 10.2756 10.2756 10.3953 10.3953 11.0531 11.0531 11.2830 11.2830 12.5002 12.5002 13.3011 13.3011 13.4663 13.4663 15.2322 15.2322 15.6079 15.6079 16.4707 16.4707 k = 0.2857-0.1749-0.4789 ( 4115 PWs) bands (ev): -2.4503 -2.4503 -2.1987 -2.1987 -1.4034 -1.4034 -1.3545 -1.3545 -1.2903 -1.2903 -1.2172 -1.2172 0.6890 0.6890 0.7241 0.7241 0.7890 0.7890 0.8131 0.8131 0.8471 0.8471 0.9258 0.9258 3.6568 3.6568 3.9447 3.9447 5.8284 5.8284 6.6075 6.6075 6.9283 6.9283 7.0982 7.0982 7.7776 7.7776 7.9232 7.9232 8.2880 8.2880 8.4641 8.4641 8.9478 8.9478 9.1250 9.1250 9.3238 9.3238 9.3784 9.3784 9.6119 9.6119 9.8098 9.8098 9.9204 9.9204 9.9707 9.9707 10.1748 10.1748 10.2746 10.2746 10.3936 10.3936 11.0349 11.0349 11.2594 11.2594 12.5752 12.5752 13.3403 13.3403 13.4898 13.4898 15.2904 15.2904 15.6226 15.6226 16.4883 16.4883 k = 0.2944-0.1802-0.4935 ( 4115 PWs) bands (ev): -2.4303 -2.4303 -2.2145 -2.2145 -1.4029 -1.4029 -1.3533 -1.3533 -1.2887 -1.2887 -1.2170 -1.2170 0.6911 0.6911 0.7240 0.7240 0.7908 0.7908 0.8151 0.8151 0.8486 0.8486 0.9250 0.9250 3.6363 3.6363 3.9215 3.9215 5.7751 5.7751 6.6481 6.6481 6.9814 6.9814 7.1327 7.1327 7.7366 7.7366 7.9141 7.9141 8.2664 8.2664 8.4594 8.4594 8.9404 8.9404 9.1230 9.1230 9.3257 9.3257 9.3940 9.3940 9.6083 9.6083 9.8145 9.8145 9.9168 9.9168 9.9659 9.9659 10.1803 10.1803 10.2735 10.2735 10.3924 10.3924 11.0107 11.0107 11.2454 11.2454 12.6451 12.6451 13.3726 13.3726 13.5180 13.5180 15.3281 15.3281 15.6474 15.6474 16.5072 16.5072 k = 0.3030-0.1855-0.5080 ( 4115 PWs) bands (ev): -2.4113 -2.4113 -2.2295 -2.2295 -1.4024 -1.4024 -1.3521 -1.3521 -1.2882 -1.2882 -1.2156 -1.2156 0.6929 0.6929 0.7238 0.7238 0.7926 0.7926 0.8164 0.8164 0.8504 0.8504 0.9246 0.9246 3.6094 3.6094 3.9100 3.9100 5.7224 5.7224 6.6909 6.6909 7.0327 7.0327 7.1613 7.1613 7.6953 7.6953 7.9045 7.9045 8.2460 8.2460 8.4603 8.4603 8.9321 8.9321 9.1208 9.1208 9.3278 9.3278 9.4104 9.4104 9.6043 9.6043 9.8176 9.8176 9.9148 9.9148 9.9617 9.9617 10.1857 10.1857 10.2725 10.2725 10.3916 10.3916 10.9824 10.9824 11.2397 11.2397 12.7084 12.7084 13.4000 13.4000 13.5493 13.5493 15.3484 15.3484 15.6801 15.6801 16.5267 16.5267 k = 0.3117-0.1908-0.5225 ( 4109 PWs) bands (ev): -2.3933 -2.3933 -2.2438 -2.2438 -1.4019 -1.4019 -1.3510 -1.3510 -1.2888 -1.2888 -1.2130 -1.2130 0.6944 0.6944 0.7236 0.7236 0.7944 0.7944 0.8170 0.8170 0.8522 0.8522 0.9246 0.9246 3.5773 3.5773 3.9092 3.9092 5.6708 5.6708 6.7357 6.7357 7.0791 7.0791 7.1826 7.1826 7.6587 7.6587 7.8945 7.8945 8.2268 8.2268 8.4663 8.4663 8.9231 8.9231 9.1185 9.1185 9.3304 9.3304 9.4259 9.4259 9.6010 9.6010 9.8188 9.8188 9.9145 9.9145 9.9584 9.9584 10.1907 10.1907 10.2717 10.2717 10.3910 10.3910 10.9523 10.9523 11.2405 11.2405 12.7631 12.7631 13.4245 13.4245 13.5823 13.5823 15.3570 15.3570 15.7157 15.7157 16.5432 16.5432 k = 0.3204-0.1961-0.5370 ( 4117 PWs) bands (ev): -2.3764 -2.3764 -2.2574 -2.2574 -1.4015 -1.4015 -1.3500 -1.3500 -1.2905 -1.2905 -1.2092 -1.2092 0.6955 0.6955 0.7234 0.7234 0.7961 0.7961 0.8172 0.8172 0.8538 0.8538 0.9254 0.9254 3.5418 3.5418 3.9172 3.9172 5.6202 5.6202 6.7820 6.7820 7.1098 7.1098 7.2017 7.2017 7.6326 7.6326 7.8841 7.8841 8.2089 8.2089 8.4768 8.4768 8.9134 8.9134 9.1161 9.1161 9.3333 9.3333 9.4392 9.4392 9.5994 9.5994 9.8182 9.8182 9.9157 9.9157 9.9562 9.9562 10.1950 10.1950 10.2711 10.2711 10.3905 10.3905 10.9224 10.9224 11.2461 11.2461 12.8075 12.8075 13.4472 13.4472 13.6167 13.6167 15.3598 15.3598 15.7494 15.7494 16.5238 16.5238 k = 0.3290-0.2014-0.5515 ( 4119 PWs) bands (ev): -2.3608 -2.3608 -2.2703 -2.2703 -1.4011 -1.4011 -1.3491 -1.3491 -1.2933 -1.2933 -1.2044 -1.2044 0.6961 0.6961 0.7233 0.7233 0.7977 0.7977 0.8170 0.8170 0.8550 0.8550 0.9270 0.9270 3.5046 3.5046 3.9326 3.9326 5.5711 5.5711 6.8294 6.8294 7.1057 7.1057 7.2335 7.2335 7.6218 7.6218 7.8734 7.8734 8.1925 8.1925 8.4913 8.4913 8.9033 8.9033 9.1136 9.1136 9.3361 9.3361 9.4489 9.4489 9.6010 9.6010 9.8163 9.8163 9.9180 9.9180 9.9556 9.9556 10.1982 10.1982 10.2712 10.2712 10.3901 10.3901 10.8940 10.8940 11.2555 11.2555 12.8399 12.8399 13.4691 13.4691 13.6528 13.6528 15.3609 15.3609 15.7778 15.7778 16.4840 16.4840 k = 0.3377-0.2067-0.5660 ( 4113 PWs) bands (ev): -2.3465 -2.3465 -2.2822 -2.2822 -1.4008 -1.4008 -1.3482 -1.3482 -1.2968 -1.2968 -1.1985 -1.1985 0.6964 0.6964 0.7233 0.7233 0.7990 0.7990 0.8165 0.8165 0.8556 0.8556 0.9296 0.9296 3.4671 3.4671 3.9541 3.9541 5.5235 5.5235 6.8771 6.8771 7.0673 7.0673 7.2774 7.2774 7.6269 7.6269 7.8625 7.8625 8.1778 8.1778 8.5091 8.5091 8.8928 8.8928 9.1113 9.1113 9.3385 9.3385 9.4540 9.4540 9.6070 9.6070 9.8134 9.8134 9.9207 9.9207 9.9568 9.9568 10.2001 10.2001 10.2723 10.2723 10.3898 10.3898 10.8679 10.8679 11.2679 11.2679 12.8592 12.8592 13.4900 13.4900 13.6912 13.6912 15.3628 15.3628 15.7986 15.7986 16.4450 16.4450 k = 0.3463-0.2120-0.5805 ( 4113 PWs) bands (ev): -2.3338 -2.3338 -2.2928 -2.2928 -1.4005 -1.4005 -1.3475 -1.3475 -1.3009 -1.3009 -1.1920 -1.1920 0.6962 0.6962 0.7234 0.7234 0.7999 0.7999 0.8161 0.8161 0.8557 0.8557 0.9332 0.9332 3.4303 3.4303 3.9808 3.9808 5.4776 5.4776 6.9229 6.9229 7.0082 7.0082 7.3253 7.3253 7.6448 7.6448 7.8516 7.8516 8.1650 8.1650 8.5295 8.5295 8.8820 8.8820 9.1089 9.1089 9.3402 9.3402 9.4542 9.4542 9.6174 9.6174 9.8100 9.8100 9.9235 9.9235 9.9599 9.9599 10.2001 10.2001 10.2748 10.2748 10.3894 10.3894 10.8444 10.8444 11.2828 11.2828 12.8652 12.8652 13.5098 13.5098 13.7321 13.7321 15.3675 15.3675 15.8102 15.8102 16.4097 16.4097 k = 0.3550-0.2173-0.5951 ( 4115 PWs) bands (ev): -2.3245 -2.3245 -2.3006 -2.3006 -1.4003 -1.4003 -1.3468 -1.3468 -1.3054 -1.3054 -1.1850 -1.1850 0.6957 0.6957 0.7236 0.7236 0.8003 0.8003 0.8157 0.8157 0.8555 0.8555 0.9375 0.9375 3.3945 3.3945 4.0123 4.0123 5.4336 5.4336 6.9184 6.9184 6.9840 6.9840 7.3738 7.3738 7.6712 7.6712 7.8408 7.8408 8.1542 8.1542 8.5519 8.5519 8.8712 8.8712 9.1064 9.1064 9.3409 9.3409 9.4503 9.4503 9.6316 9.6316 9.8064 9.8064 9.9266 9.9266 9.9649 9.9649 10.1980 10.1980 10.2788 10.2788 10.3888 10.3888 10.8237 10.8237 11.3002 11.3002 12.8584 12.8584 13.5280 13.5280 13.7754 13.7754 15.3757 15.3757 15.8113 15.8113 16.3799 16.3799 k = 0.3636-0.2226-0.6096 ( 4115 PWs) bands (ev): -2.3237 -2.3237 -2.3002 -2.3002 -1.4001 -1.4001 -1.3461 -1.3461 -1.3102 -1.3102 -1.1776 -1.1776 0.6948 0.6948 0.7239 0.7239 0.8000 0.8000 0.8155 0.8155 0.8550 0.8550 0.9424 0.9424 3.3604 3.3604 4.0482 4.0482 5.3915 5.3915 6.8357 6.8357 7.0272 7.0272 7.4216 7.4216 7.7026 7.7026 7.8301 7.8301 8.1456 8.1456 8.5758 8.5758 8.8605 8.8605 9.1038 9.1038 9.3406 9.3406 9.4434 9.4434 9.6484 9.6484 9.8026 9.8026 9.9302 9.9302 9.9715 9.9715 10.1939 10.1939 10.2842 10.2842 10.3880 10.3880 10.8056 10.8056 11.3196 11.3196 12.8401 12.8401 13.5441 13.5441 13.8205 13.8205 15.3880 15.3880 15.8015 15.8015 16.3562 16.3562 k = 0.3723-0.2279-0.6241 ( 4129 PWs) bands (ev): -2.3302 -2.3302 -2.2929 -2.2929 -1.3999 -1.3999 -1.3456 -1.3456 -1.3151 -1.3151 -1.1701 -1.1701 0.6937 0.6937 0.7242 0.7242 0.7990 0.7990 0.8156 0.8156 0.8545 0.8545 0.9477 0.9477 3.3280 3.3280 4.0884 4.0884 5.3514 5.3514 6.7418 6.7418 7.0734 7.0734 7.4682 7.4682 7.7366 7.7366 7.8196 7.8196 8.1394 8.1394 8.6007 8.6007 8.8500 8.8500 9.1010 9.1010 9.3392 9.3392 9.4347 9.4347 9.6664 9.6664 9.7988 9.7988 9.9346 9.9346 9.9793 9.9793 10.1878 10.1878 10.2909 10.2909 10.3869 10.3869 10.7900 10.7900 11.3412 11.3412 12.8121 12.8121 13.5578 13.5578 13.8662 13.8662 15.4046 15.4046 15.7811 15.7811 16.3374 16.3374 k = 0.6277 0.0523-0.4281 ( 4129 PWs) bands (ev): -2.3302 -2.3302 -2.2929 -2.2929 -1.3999 -1.3999 -1.3456 -1.3456 -1.3151 -1.3151 -1.1701 -1.1701 0.6937 0.6937 0.7242 0.7242 0.7990 0.7990 0.8156 0.8156 0.8545 0.8545 0.9477 0.9477 3.3279 3.3279 4.0884 4.0884 5.3514 5.3514 6.7418 6.7418 7.0734 7.0734 7.4682 7.4682 7.7366 7.7366 7.8196 7.8196 8.1394 8.1394 8.6007 8.6007 8.8501 8.8501 9.1010 9.1010 9.3392 9.3392 9.4347 9.4347 9.6664 9.6664 9.7988 9.7988 9.9346 9.9346 9.9794 9.9794 10.1877 10.1877 10.2908 10.2908 10.3869 10.3869 10.7900 10.7900 11.3411 11.3411 12.8121 12.8121 13.5578 13.5578 13.8662 13.8662 15.4046 15.4046 15.7811 15.7811 16.3374 16.3374 k = 0.6192 0.0675-0.4281 ( 4127 PWs) bands (ev): -2.3381 -2.3381 -2.2846 -2.2846 -1.3998 -1.3998 -1.3452 -1.3452 -1.3199 -1.3199 -1.1626 -1.1626 0.6924 0.6924 0.7244 0.7244 0.7975 0.7975 0.8160 0.8160 0.8541 0.8541 0.9533 0.9533 3.2980 3.2980 4.1318 4.1318 5.3141 5.3141 6.6442 6.6442 7.1178 7.1178 7.5123 7.5123 7.7710 7.7710 7.8098 7.8098 8.1359 8.1359 8.6255 8.6255 8.8402 8.8402 9.0979 9.0979 9.3369 9.3369 9.4252 9.4252 9.6845 9.6845 9.7954 9.7954 9.9399 9.9399 9.9884 9.9884 10.1803 10.1803 10.2983 10.2983 10.3855 10.3855 10.7770 10.7770 11.3641 11.3641 12.7769 12.7769 13.5687 13.5687 13.9107 13.9107 15.4246 15.4246 15.7522 15.7522 16.3197 16.3197 k = 0.6107 0.0827-0.4281 ( 4129 PWs) bands (ev): -2.3458 -2.3458 -2.2766 -2.2766 -1.3998 -1.3998 -1.3449 -1.3449 -1.3246 -1.3246 -1.1552 -1.1552 0.6909 0.6909 0.7247 0.7247 0.7954 0.7954 0.8165 0.8165 0.8538 0.8538 0.9590 0.9590 3.2700 3.2700 4.1790 4.1790 5.2791 5.2791 6.5430 6.5430 7.1603 7.1603 7.5546 7.5546 7.7971 7.7971 7.8087 7.8087 8.1349 8.1349 8.6501 8.6501 8.8311 8.8311 9.0942 9.0942 9.3338 9.3338 9.4154 9.4154 9.7019 9.7019 9.7926 9.7926 9.9459 9.9459 9.9985 9.9985 10.1716 10.1716 10.3062 10.3062 10.3838 10.3838 10.7659 10.7659 11.3888 11.3888 12.7358 12.7358 13.5770 13.5770 13.9537 13.9537 15.4478 15.4478 15.7168 15.7168 16.2959 16.2959 k = 0.6022 0.0979-0.4281 ( 4129 PWs) bands (ev): -2.3532 -2.3532 -2.2694 -2.2694 -1.3997 -1.3997 -1.3448 -1.3448 -1.3291 -1.3291 -1.1480 -1.1480 0.6893 0.6893 0.7248 0.7248 0.7931 0.7931 0.8171 0.8171 0.8537 0.8537 0.9647 0.9647 3.2441 3.2441 4.2298 4.2298 5.2463 5.2463 6.4395 6.4395 7.2005 7.2005 7.5946 7.5946 7.7899 7.7899 7.8407 7.8407 8.1367 8.1367 8.6739 8.6739 8.8231 8.8231 9.0900 9.0900 9.3301 9.3301 9.4060 9.4060 9.7174 9.7174 9.7913 9.7913 9.9526 9.9526 10.0098 10.0098 10.1621 10.1621 10.3143 10.3143 10.3818 10.3818 10.7565 10.7565 11.4149 11.4149 12.6907 12.6907 13.5826 13.5826 13.9943 13.9943 15.4732 15.4732 15.6771 15.6771 16.2587 16.2587 k = 0.5936 0.1131-0.4281 ( 4129 PWs) bands (ev): -2.3600 -2.3600 -2.2628 -2.2628 -1.3997 -1.3997 -1.3450 -1.3450 -1.3332 -1.3332 -1.1410 -1.1410 0.6877 0.6877 0.7248 0.7248 0.7907 0.7907 0.8177 0.8177 0.8537 0.8537 0.9703 0.9703 3.2202 3.2202 4.2843 4.2843 5.2158 5.2158 6.3346 6.3346 7.2378 7.2378 7.6323 7.6323 7.7814 7.7814 7.8732 7.8732 8.1412 8.1412 8.6959 8.6959 8.8165 8.8165 9.0851 9.0851 9.3258 9.3258 9.3972 9.3972 9.7294 9.7294 9.7927 9.7927 9.9597 9.9597 10.0223 10.0223 10.1519 10.1519 10.3220 10.3220 10.3797 10.3797 10.7484 10.7484 11.4423 11.4423 12.6431 12.6431 13.5856 13.5856 14.0319 14.0319 15.4990 15.4990 15.6357 15.6357 16.2060 16.2060 k = 0.5851 0.1283-0.4281 ( 4123 PWs) bands (ev): -2.3662 -2.3662 -2.2570 -2.2570 -1.3997 -1.3997 -1.3457 -1.3457 -1.3364 -1.3364 -1.1343 -1.1343 0.6861 0.6861 0.7246 0.7246 0.7883 0.7883 0.8184 0.8184 0.8540 0.8540 0.9757 0.9757 3.1985 3.1985 4.3421 4.3421 5.1877 5.1877 6.2291 6.2291 7.2720 7.2720 7.6674 7.6674 7.7733 7.7733 7.9041 7.9041 8.1483 8.1483 8.7151 8.7151 8.8123 8.8123 9.0797 9.0797 9.3211 9.3211 9.3896 9.3896 9.7364 9.7364 9.7982 9.7982 9.9669 9.9669 10.0358 10.0358 10.1415 10.1415 10.3285 10.3285 10.3781 10.3781 10.7416 10.7416 11.4705 11.4705 12.5945 12.5945 13.5861 13.5861 14.0660 14.0660 15.5219 15.5219 15.5957 15.5957 16.1436 16.1436 k = 0.5766 0.1435-0.4281 ( 4123 PWs) bands (ev): -2.3719 -2.3719 -2.2519 -2.2519 -1.3998 -1.3998 -1.3473 -1.3473 -1.3386 -1.3386 -1.1281 -1.1281 0.6845 0.6845 0.7244 0.7244 0.7859 0.7859 0.8189 0.8189 0.8543 0.8543 0.9809 0.9809 3.1788 3.1788 4.4032 4.4032 5.1621 5.1621 6.1235 6.1235 7.3027 7.3027 7.6997 7.6997 7.7659 7.7659 7.9330 7.9330 8.1577 8.1577 8.7299 8.7299 8.8115 8.8115 9.0736 9.0736 9.3160 9.3160 9.3833 9.3833 9.7384 9.7384 9.8076 9.8076 9.9741 9.9741 10.0499 10.0499 10.1314 10.1314 10.3328 10.3328 10.3777 10.3777 10.7357 10.7357 11.4993 11.4993 12.5461 12.5461 13.5843 13.5843 14.0963 14.0963 15.5283 15.5283 15.5696 15.5696 16.0805 16.0805 k = 0.5681 0.1586-0.4281 ( 4117 PWs) bands (ev): -2.3770 -2.3770 -2.2475 -2.2475 -1.3998 -1.3998 -1.3497 -1.3497 -1.3397 -1.3397 -1.1224 -1.1224 0.6830 0.6830 0.7240 0.7240 0.7838 0.7838 0.8194 0.8194 0.8547 0.8547 0.9857 0.9857 3.1613 3.1613 4.4674 4.4674 5.1390 5.1390 6.0187 6.0187 7.3298 7.3298 7.7289 7.7289 7.7593 7.7593 7.9596 7.9596 8.1690 8.1690 8.7392 8.7392 8.8151 8.8151 9.0672 9.0672 9.3107 9.3107 9.3786 9.3786 9.7371 9.7371 9.8193 9.8193 9.9807 9.9807 10.0632 10.0632 10.1230 10.1230 10.3337 10.3337 10.3795 10.3795 10.7308 10.7308 11.5279 11.5279 12.4994 12.4994 13.5804 13.5804 14.1228 14.1228 15.5006 15.5006 15.5730 15.5730 16.0252 16.0252 k = 0.5596 0.1738-0.4281 ( 4119 PWs) bands (ev): -2.3814 -2.3814 -2.2437 -2.2437 -1.3999 -1.3999 -1.3525 -1.3525 -1.3401 -1.3401 -1.1171 -1.1171 0.6816 0.6816 0.7235 0.7235 0.7818 0.7818 0.8199 0.8199 0.8552 0.8552 0.9900 0.9900 3.1459 3.1459 4.5342 4.5342 5.1184 5.1184 5.9153 5.9153 7.3532 7.3532 7.7504 7.7504 7.7581 7.7581 7.9835 7.9835 8.1818 8.1818 8.7431 8.7431 8.8227 8.8227 9.0605 9.0605 9.3052 9.3052 9.3753 9.3753 9.7341 9.7341 9.8317 9.8317 9.9868 9.9868 10.0729 10.0729 10.1193 10.1193 10.3308 10.3308 10.3835 10.3835 10.7266 10.7266 11.5559 11.5559 12.4552 12.4552 13.5748 13.5748 14.1456 14.1456 15.4658 15.4658 15.5763 15.5763 15.9838 15.9838 k = 0.5511 0.1890-0.4281 ( 4119 PWs) bands (ev): -2.3853 -2.3853 -2.2405 -2.2405 -1.4000 -1.4000 -1.3551 -1.3551 -1.3403 -1.3403 -1.1125 -1.1125 0.6804 0.6804 0.7229 0.7229 0.7801 0.7801 0.8203 0.8203 0.8556 0.8556 0.9939 0.9939 3.1325 3.1325 4.6033 4.6033 5.1004 5.1004 5.8141 5.8141 7.3729 7.3729 7.7470 7.7470 7.7794 7.7794 8.0046 8.0046 8.1952 8.1952 8.7434 8.7434 8.8323 8.8323 9.0541 9.0541 9.3000 9.3000 9.3733 9.3733 9.7304 9.7304 9.8440 9.8440 9.9920 9.9920 10.0747 10.0747 10.1245 10.1245 10.3248 10.3248 10.3889 10.3889 10.7230 10.7230 11.5825 11.5825 12.4148 12.4148 13.5680 13.5680 14.1647 14.1647 15.4330 15.4330 15.5695 15.5695 15.9591 15.9591 k = 0.5426 0.2042-0.4281 ( 4119 PWs) bands (ev): -2.3886 -2.3886 -2.2379 -2.2379 -1.4001 -1.4001 -1.3574 -1.3574 -1.3403 -1.3403 -1.1086 -1.1086 0.6792 0.6792 0.7223 0.7223 0.7788 0.7788 0.8206 0.8206 0.8561 0.8561 0.9973 0.9973 3.1212 3.1212 4.6739 4.6739 5.0849 5.0849 5.7161 5.7161 7.3892 7.3892 7.7426 7.7426 7.7991 7.7991 8.0228 8.0228 8.2086 8.2086 8.7419 8.7419 8.8418 8.8418 9.0481 9.0481 9.2951 9.2951 9.3722 9.3722 9.7267 9.7267 9.8556 9.8556 9.9961 9.9961 10.0701 10.0701 10.1372 10.1372 10.3165 10.3165 10.3946 10.3946 10.7199 10.7199 11.6070 11.6070 12.3789 12.3789 13.5606 13.5606 14.1804 14.1804 15.4039 15.4039 15.5534 15.5534 15.9498 15.9498 k = 0.5341 0.2194-0.4281 ( 4123 PWs) bands (ev): -2.3912 -2.3912 -2.2357 -2.2357 -1.4002 -1.4002 -1.3595 -1.3595 -1.3403 -1.3403 -1.1053 -1.1053 0.6783 0.6783 0.7218 0.7218 0.7776 0.7776 0.8209 0.8209 0.8565 0.8565 1.0001 1.0001 3.1120 3.1120 4.7448 4.7448 5.0718 5.0718 5.6228 5.6228 7.4021 7.4021 7.7388 7.7388 7.8155 7.8155 8.0378 8.0378 8.2210 8.2210 8.7398 8.7398 8.8502 8.8502 9.0428 9.0428 9.2910 9.2910 9.3719 9.3719 9.7231 9.7231 9.8661 9.8661 9.9989 9.9989 10.0636 10.0636 10.1528 10.1528 10.3067 10.3067 10.4000 10.4000 10.7175 10.7175 11.6286 11.6286 12.3483 12.3483 13.5532 13.5532 14.1929 14.1929 15.3794 15.3794 15.5324 15.5324 15.9509 15.9509 k = 0.5255 0.2346-0.4281 ( 4123 PWs) bands (ev): -2.3933 -2.3933 -2.2341 -2.2341 -1.4003 -1.4003 -1.3610 -1.3610 -1.3403 -1.3403 -1.1027 -1.1027 0.6775 0.6775 0.7213 0.7213 0.7768 0.7768 0.8211 0.8211 0.8568 0.8568 1.0024 1.0024 3.1049 3.1049 4.8137 4.8137 5.0611 5.0611 5.5369 5.5369 7.4120 7.4120 7.7359 7.7359 7.8283 7.8283 8.0497 8.0497 8.2318 8.2318 8.7378 8.7378 8.8568 8.8568 9.0384 9.0384 9.2876 9.2876 9.3720 9.3720 9.7202 9.7202 9.8751 9.8751 10.0004 10.0004 10.0577 10.0577 10.1689 10.1689 10.2960 10.2960 10.4046 10.4046 10.7156 10.7156 11.6464 11.6464 12.3238 12.3238 13.5466 13.5466 14.2023 14.2023 15.3598 15.3598 15.5116 15.5116 15.9572 15.9572 k = 0.5170 0.2498-0.4281 ( 4124 PWs) bands (ev): -2.3948 -2.3948 -2.2330 -2.2330 -1.4003 -1.4003 -1.3622 -1.3622 -1.3403 -1.3403 -1.1008 -1.1008 0.6770 0.6770 0.7209 0.7209 0.7762 0.7762 0.8212 0.8212 0.8571 0.8571 1.0040 1.0040 3.0998 3.0998 4.8766 4.8766 5.0522 5.0522 5.4630 5.4630 7.4188 7.4188 7.7338 7.7338 7.8376 7.8376 8.0582 8.0582 8.2400 8.2400 8.7361 8.7361 8.8615 8.8615 9.0353 9.0353 9.2851 9.2851 9.3722 9.3722 9.7179 9.7179 9.8822 9.8822 10.0006 10.0006 10.0533 10.0533 10.1836 10.1836 10.2854 10.2854 10.4081 10.4081 10.7141 10.7141 11.6597 11.6597 12.3059 12.3059 13.5413 13.5413 14.2089 14.2089 15.3456 15.3456 15.4945 15.4945 15.9643 15.9643 k = 0.5085 0.2650-0.4281 ( 4122 PWs) bands (ev): -2.3957 -2.3957 -2.2323 -2.2323 -1.4004 -1.4004 -1.3629 -1.3629 -1.3403 -1.3403 -1.0997 -1.0997 0.6766 0.6766 0.7207 0.7207 0.7758 0.7758 0.8213 0.8213 0.8572 0.8572 1.0050 1.0050 3.0967 3.0967 4.9251 4.9251 5.0449 5.0449 5.4098 5.4098 7.4229 7.4229 7.7325 7.7325 7.8432 7.8432 8.0634 8.0634 8.2452 8.2452 8.7351 8.7351 8.8643 8.8643 9.0333 9.0333 9.2836 9.2836 9.3724 9.3724 9.7165 9.7165 9.8868 9.8868 10.0003 10.0003 10.0507 10.0507 10.1947 10.1947 10.2768 10.2768 10.4103 10.4103 10.7134 10.7134 11.6679 11.6679 12.2950 12.2950 13.5379 13.5379 14.2128 14.2128 15.3369 15.3369 15.4835 15.4835 15.9695 15.9695 k = 0.5000 0.2802-0.4281 ( 4120 PWs) bands (ev): -2.3960 -2.3960 -2.2321 -2.2321 -1.4004 -1.4004 -1.3631 -1.3631 -1.3403 -1.3403 -1.0993 -1.0993 0.6765 0.6765 0.7206 0.7206 0.7757 0.7757 0.8214 0.8214 0.8573 0.8573 1.0053 1.0053 3.0957 3.0957 4.9447 4.9447 5.0414 5.0414 5.3897 5.3897 7.4243 7.4243 7.7321 7.7321 7.8450 7.8450 8.0651 8.0651 8.2470 8.2470 8.7347 8.7347 8.8653 8.8653 9.0327 9.0327 9.2831 9.2831 9.3725 9.3725 9.7161 9.7161 9.8883 9.8883 10.0001 10.0001 10.0498 10.0498 10.1991 10.1991 10.2733 10.2733 10.4111 10.4111 10.7131 10.7131 11.6707 11.6707 12.2914 12.2914 13.5368 13.5368 14.2141 14.2141 15.3340 15.3340 15.4797 15.4797 15.9714 15.9714 k = 0.5000 0.2802-0.4281 ( 4120 PWs) bands (ev): -2.3960 -2.3960 -2.2321 -2.2321 -1.4004 -1.4004 -1.3631 -1.3631 -1.3403 -1.3403 -1.0993 -1.0993 0.6765 0.6765 0.7206 0.7206 0.7757 0.7757 0.8214 0.8214 0.8573 0.8573 1.0053 1.0053 3.0957 3.0957 4.9447 4.9447 5.0414 5.0414 5.3897 5.3897 7.4243 7.4243 7.7321 7.7321 7.8450 7.8450 8.0651 8.0651 8.2470 8.2470 8.7347 8.7347 8.8653 8.8653 9.0327 9.0327 9.2831 9.2831 9.3725 9.3725 9.7161 9.7161 9.8883 9.8883 10.0001 10.0001 10.0498 10.0498 10.1991 10.1991 10.2733 10.2733 10.4111 10.4111 10.7131 10.7131 11.6707 11.6707 12.2914 12.2914 13.5368 13.5368 14.2141 14.2141 15.3340 15.3340 15.4797 15.4797 15.9714 15.9714 k = 0.5091 0.2853-0.4141 ( 4117 PWs) bands (ev): -2.3957 -2.3957 -2.2322 -2.2322 -1.4003 -1.4003 -1.3631 -1.3631 -1.3401 -1.3401 -1.0997 -1.0997 0.6767 0.6767 0.7207 0.7207 0.7757 0.7757 0.8214 0.8214 0.8572 0.8572 1.0049 1.0049 3.0966 3.0966 4.8867 4.8867 5.1017 5.1017 5.3920 5.3920 7.4221 7.4221 7.7321 7.7321 7.8436 7.8436 8.0646 8.0646 8.2444 8.2444 8.7342 8.7342 8.8656 8.8656 9.0335 9.0335 9.2834 9.2834 9.3722 9.3722 9.7158 9.7158 9.8886 9.8886 9.9989 9.9989 10.0503 10.0503 10.1978 10.1978 10.2712 10.2712 10.4123 10.4123 10.7155 10.7155 11.6690 11.6690 12.2972 12.2972 13.5363 13.5363 14.2092 14.2092 15.3312 15.3312 15.4860 15.4860 15.9706 15.9706 k = 0.5182 0.2904-0.4001 ( 4115 PWs) bands (ev): -2.3950 -2.3950 -2.2327 -2.2327 -1.4000 -1.4000 -1.3630 -1.3630 -1.3398 -1.3398 -1.1009 -1.1009 0.6770 0.6770 0.7212 0.7212 0.7755 0.7755 0.8215 0.8215 0.8571 0.8571 1.0038 1.0038 3.0991 3.0991 4.8000 4.8000 5.1941 5.1941 5.3996 5.3996 7.4158 7.4158 7.7321 7.7321 7.8397 7.8397 8.0631 8.0631 8.2368 8.2368 8.7325 8.7325 8.8667 8.8667 9.0359 9.0359 9.2840 9.2840 9.3711 9.3711 9.7151 9.7151 9.8892 9.8892 9.9955 9.9955 10.0516 10.0516 10.1939 10.1939 10.2652 10.2652 10.4155 10.4155 10.7223 10.7223 11.6640 11.6640 12.3147 12.3147 13.5350 13.5350 14.1949 14.1949 15.3231 15.3231 15.5041 15.5041 15.9687 15.9687 k = 0.5274 0.2955-0.3861 ( 4123 PWs) bands (ev): -2.3938 -2.3938 -2.2336 -2.2336 -1.3996 -1.3996 -1.3628 -1.3628 -1.3392 -1.3392 -1.1029 -1.1029 0.6776 0.6776 0.7220 0.7220 0.7753 0.7753 0.8217 0.8217 0.8569 0.8569 1.0020 1.0020 3.1034 3.1034 4.7130 4.7130 5.2864 5.2864 5.4166 5.4166 7.4052 7.4052 7.7318 7.7318 7.8335 7.8335 8.0606 8.0606 8.2242 8.2242 8.7296 8.7296 8.8683 8.8683 9.0398 9.0398 9.2849 9.2849 9.3694 9.3694 9.7139 9.7139 9.8902 9.8902 9.9900 9.9900 10.0534 10.0534 10.1878 10.1878 10.2561 10.2561 10.4202 10.4202 10.7333 10.7333 11.6559 11.6559 12.3432 12.3432 13.5326 13.5326 14.1719 14.1719 15.3103 15.3103 15.5320 15.5320 15.9670 15.9670 k = 0.5365 0.3006-0.3721 ( 4122 PWs) bands (ev): -2.3921 -2.3921 -2.2349 -2.2349 -1.3989 -1.3989 -1.3627 -1.3627 -1.3384 -1.3384 -1.1056 -1.1056 0.6784 0.6784 0.7231 0.7231 0.7749 0.7749 0.8220 0.8220 0.8565 0.8565 0.9995 0.9995 3.1094 3.1094 4.6285 4.6285 5.3587 5.3587 5.4598 5.4598 7.3902 7.3902 7.7308 7.7308 7.8260 7.8260 8.0570 8.0570 8.2068 8.2068 8.7256 8.7256 8.8705 8.8705 9.0452 9.0452 9.2862 9.2862 9.3671 9.3671 9.7124 9.7124 9.8915 9.8915 9.9829 9.9829 10.0555 10.0555 10.1802 10.1802 10.2449 10.2449 10.4256 10.4256 10.7479 10.7479 11.6450 11.6450 12.3821 12.3821 13.5288 13.5288 14.1411 14.1411 15.2927 15.2927 15.5679 15.5679 15.9673 15.9673 k = 0.5456 0.3057-0.3581 ( 4118 PWs) bands (ev): -2.3899 -2.3899 -2.2365 -2.2365 -1.3982 -1.3982 -1.3624 -1.3624 -1.3372 -1.3372 -1.1091 -1.1091 0.6794 0.6794 0.7244 0.7244 0.7744 0.7744 0.8224 0.8224 0.8562 0.8562 0.9964 0.9964 3.1170 3.1170 4.5473 4.5473 5.3955 5.3955 5.5439 5.5439 7.3707 7.3707 7.7283 7.7283 7.8183 7.8183 8.0525 8.0525 8.1851 8.1851 8.7205 8.7205 8.8731 8.8731 9.0522 9.0522 9.2877 9.2877 9.3642 9.3642 9.7107 9.7107 9.8930 9.8930 9.9744 9.9744 10.0576 10.0576 10.1717 10.1717 10.2325 10.2325 10.4312 10.4312 10.7655 10.7655 11.6318 11.6318 12.4305 12.4305 13.5230 13.5230 14.1037 14.1037 15.2701 15.2701 15.6103 15.6103 15.9716 15.9716 k = 0.5547 0.3109-0.3441 ( 4110 PWs) bands (ev): -2.3872 -2.3872 -2.2386 -2.2386 -1.3973 -1.3973 -1.3622 -1.3622 -1.3358 -1.3358 -1.1132 -1.1132 0.6805 0.6805 0.7260 0.7260 0.7739 0.7739 0.8229 0.8229 0.8558 0.8558 0.9926 0.9926 3.1264 3.1264 4.4698 4.4698 5.4186 5.4186 5.6465 5.6465 7.3466 7.3466 7.7232 7.7232 7.8119 7.8119 8.0468 8.0468 8.1592 8.1592 8.7144 8.7144 8.8761 8.8761 9.0605 9.0605 9.2894 9.2894 9.3611 9.3611 9.7088 9.7088 9.8947 9.8947 9.9648 9.9648 10.0591 10.0591 10.1632 10.1632 10.2197 10.2197 10.4368 10.4368 10.7855 10.7855 11.6165 11.6165 12.4873 12.4873 13.5147 13.5147 14.0609 14.0609 15.2426 15.2426 15.6574 15.6574 15.9811 15.9811 k = 0.5638 0.3160-0.3301 ( 4110 PWs) bands (ev): -2.3840 -2.3840 -2.2412 -2.2412 -1.3965 -1.3965 -1.3619 -1.3619 -1.3341 -1.3341 -1.1180 -1.1180 0.6817 0.6817 0.7279 0.7279 0.7732 0.7732 0.8234 0.8234 0.8555 0.8555 0.9882 0.9882 3.1373 3.1373 4.3962 4.3962 5.4400 5.4400 5.7551 5.7551 7.3181 7.3181 7.7145 7.7145 7.8081 7.8081 8.0400 8.0400 8.1297 8.1297 8.7073 8.7073 8.8792 8.8792 9.0701 9.0701 9.2912 9.2912 9.3576 9.3576 9.7070 9.7070 9.8964 9.8964 9.9543 9.9543 10.0596 10.0596 10.1553 10.1553 10.2071 10.2071 10.4419 10.4419 10.8073 10.8073 11.5996 11.5996 12.5515 12.5515 13.5033 13.5033 14.0140 14.0140 15.2107 15.2107 15.7076 15.7076 15.9964 15.9964 k = 0.5730 0.3211-0.3161 ( 4113 PWs) bands (ev): -2.3804 -2.3804 -2.2442 -2.2442 -1.3955 -1.3955 -1.3617 -1.3617 -1.3321 -1.3321 -1.1234 -1.1234 0.6830 0.6830 0.7299 0.7299 0.7723 0.7723 0.8240 0.8240 0.8552 0.8552 0.9833 0.9833 3.1499 3.1499 4.3268 4.3268 5.4627 5.4627 5.8662 5.8662 7.2852 7.2852 7.7016 7.7016 7.8076 7.8076 8.0318 8.0318 8.0971 8.0971 8.6997 8.6997 8.8824 8.8824 9.0808 9.0808 9.2928 9.2928 9.3541 9.3541 9.7052 9.7052 9.8979 9.8979 9.9434 9.9434 10.0586 10.0586 10.1489 10.1489 10.1952 10.1952 10.4466 10.4466 10.8304 10.8304 11.5811 11.5811 12.6220 12.6220 13.4880 13.4880 13.9640 13.9640 15.1757 15.1757 15.7590 15.7590 16.0172 16.0172 k = 0.5821 0.3262-0.3021 ( 4114 PWs) bands (ev): -2.3762 -2.3762 -2.2479 -2.2479 -1.3946 -1.3946 -1.3614 -1.3614 -1.3298 -1.3298 -1.1293 -1.1293 0.6844 0.6844 0.7321 0.7321 0.7713 0.7713 0.8247 0.8247 0.8550 0.8550 0.9779 0.9779 3.1641 3.1641 4.2617 4.2617 5.4875 5.4875 5.9787 5.9787 7.2482 7.2482 7.6849 7.6849 7.8102 7.8102 8.0214 8.0214 8.0627 8.0627 8.6918 8.6918 8.8855 8.8855 9.0926 9.0926 9.2943 9.2943 9.3506 9.3506 9.7037 9.7037 9.8990 9.8990 9.9323 9.9323 10.0557 10.0557 10.1441 10.1441 10.1850 10.1850 10.4509 10.4509 10.8543 10.8543 11.5615 11.5615 12.6975 12.6975 13.4683 13.4683 13.9120 13.9120 15.1394 15.1394 15.8094 15.8094 16.0425 16.0425 k = 0.5912 0.3313-0.2881 ( 4115 PWs) bands (ev): -2.3716 -2.3716 -2.2521 -2.2521 -1.3937 -1.3937 -1.3612 -1.3612 -1.3272 -1.3272 -1.1356 -1.1356 0.6857 0.6857 0.7344 0.7344 0.7702 0.7702 0.8254 0.8254 0.8551 0.8551 0.9720 0.9720 3.1797 3.1797 4.2010 4.2010 5.5145 5.5145 6.0914 6.0914 7.2077 7.2077 7.6650 7.6650 7.8153 7.8153 8.0040 8.0040 8.0319 8.0319 8.6841 8.6841 8.8885 8.8885 9.1051 9.1051 9.2955 9.2955 9.3473 9.3473 9.7024 9.7024 9.8988 9.8988 9.9222 9.9222 10.0511 10.0511 10.1404 10.1404 10.1774 10.1774 10.4548 10.4548 10.8787 10.8787 11.5409 11.5409 12.7766 12.7766 13.4437 13.4437 13.8590 13.8590 15.1035 15.1035 15.8570 15.8570 16.0703 16.0703 k = 0.6003 0.3364-0.2741 ( 4116 PWs) bands (ev): -2.3666 -2.3666 -2.2569 -2.2569 -1.3929 -1.3929 -1.3610 -1.3610 -1.3243 -1.3243 -1.1422 -1.1422 0.6870 0.6870 0.7368 0.7368 0.7690 0.7690 0.8260 0.8260 0.8554 0.8554 0.9659 0.9659 3.1968 3.1968 4.1451 4.1451 5.5440 5.5440 6.2036 6.2036 7.1643 7.1643 7.6421 7.6421 7.8224 7.8224 7.9706 7.9706 8.0144 8.0144 8.6768 8.6768 8.8913 8.8913 9.1183 9.1183 9.2962 9.2962 9.3443 9.3443 9.7015 9.7015 9.8954 9.8954 9.9151 9.9151 10.0451 10.0451 10.1365 10.1365 10.1734 10.1734 10.4583 10.4583 10.9033 10.9033 11.5194 11.5194 12.8575 12.8575 13.4143 13.4143 13.8059 13.8059 15.0698 15.0698 15.9000 15.9000 16.0975 16.0975 k = 0.6095 0.3415-0.2601 ( 4116 PWs) bands (ev): -2.3612 -2.3612 -2.2622 -2.2622 -1.3922 -1.3922 -1.3609 -1.3609 -1.3213 -1.3213 -1.1491 -1.1491 0.6882 0.6882 0.7393 0.7393 0.7676 0.7676 0.8266 0.8266 0.8560 0.8560 0.9594 0.9594 3.2152 3.2152 4.0941 4.0941 5.5759 5.5759 6.3142 6.3142 7.1190 7.1190 7.6164 7.6164 7.8309 7.8309 7.9286 7.9286 8.0033 8.0033 8.6705 8.6705 8.8939 8.8939 9.1320 9.1320 9.2966 9.2966 9.3419 9.3419 9.7011 9.7011 9.8871 9.8871 9.9127 9.9127 10.0381 10.0381 10.1318 10.1318 10.1736 10.1736 10.4617 10.4617 10.9278 10.9278 11.4973 11.4973 12.9373 12.9373 13.3808 13.3808 13.7539 13.7539 15.0396 15.0396 15.9369 15.9369 16.1211 16.1211 k = 0.6186 0.3466-0.2461 ( 4118 PWs) bands (ev): -2.3558 -2.3558 -2.2679 -2.2679 -1.3915 -1.3915 -1.3608 -1.3608 -1.3182 -1.3182 -1.1561 -1.1561 0.6893 0.6893 0.7418 0.7418 0.7662 0.7662 0.8270 0.8270 0.8569 0.8569 0.9528 0.9528 3.2347 3.2347 4.0481 4.0481 5.6103 5.6103 6.4214 6.4214 7.0733 7.0733 7.5880 7.5880 7.8406 7.8406 7.8835 7.8835 7.9942 7.9942 8.6652 8.6652 8.8963 8.8963 9.1459 9.1459 9.2964 9.2964 9.3400 9.3400 9.7010 9.7010 9.8762 9.8762 9.9128 9.9128 10.0308 10.0308 10.1265 10.1265 10.1772 10.1772 10.4649 10.4649 10.9519 10.9519 11.4748 11.4748 13.0111 13.0111 13.3460 13.3460 13.7046 13.7046 15.0140 15.0140 15.9655 15.9655 16.1393 16.1393 k = 0.6277 0.3517-0.2321 ( 4127 PWs) bands (ev): -2.3505 -2.3505 -2.2737 -2.2737 -1.3909 -1.3909 -1.3608 -1.3608 -1.3151 -1.3151 -1.1630 -1.1630 0.6902 0.6902 0.7442 0.7442 0.7646 0.7646 0.8273 0.8273 0.8582 0.8582 0.9461 0.9461 3.2551 3.2551 4.0075 4.0075 5.6471 5.6471 6.5225 6.5225 7.0298 7.0298 7.5567 7.5567 7.8346 7.8346 7.8528 7.8528 7.9868 7.9868 8.6613 8.6613 8.8983 8.8983 9.1597 9.1597 9.2958 9.2958 9.3387 9.3387 9.7016 9.7016 9.8645 9.8645 9.9136 9.9136 10.0236 10.0236 10.1214 10.1214 10.1831 10.1831 10.4681 10.4681 10.9755 10.9755 11.4520 11.4520 13.0685 13.0685 13.3167 13.3167 13.6611 13.6611 14.9935 14.9935 15.9825 15.9825 16.1530 16.1530 k = 0.6277 0.3517-0.2321 ( 4127 PWs) bands (ev): -2.3505 -2.3505 -2.2737 -2.2737 -1.3909 -1.3909 -1.3608 -1.3608 -1.3151 -1.3151 -1.1630 -1.1630 0.6902 0.6902 0.7442 0.7442 0.7646 0.7646 0.8273 0.8273 0.8582 0.8582 0.9461 0.9461 3.2551 3.2551 4.0075 4.0075 5.6471 5.6471 6.5225 6.5225 7.0298 7.0298 7.5567 7.5567 7.8346 7.8346 7.8528 7.8528 7.9868 7.9868 8.6613 8.6613 8.8983 8.8983 9.1597 9.1597 9.2958 9.2958 9.3387 9.3387 9.7016 9.7016 9.8645 9.8645 9.9136 9.9136 10.0236 10.0236 10.1214 10.1214 10.1831 10.1831 10.4681 10.4681 10.9755 10.9755 11.4520 11.4520 13.0685 13.0685 13.3167 13.3167 13.6611 13.6611 14.9935 14.9935 15.9825 15.9825 16.1530 16.1530 k = 0.6228 0.3490-0.2157 ( 4125 PWs) bands (ev): -2.3496 -2.3496 -2.2751 -2.2751 -1.3902 -1.3902 -1.3605 -1.3605 -1.3147 -1.3147 -1.1662 -1.1662 0.6902 0.6902 0.7458 0.7458 0.7645 0.7645 0.8264 0.8264 0.8592 0.8592 0.9416 0.9416 3.2538 3.2538 3.9953 3.9953 5.6686 5.6686 6.5830 6.5830 7.0256 7.0256 7.5109 7.5109 7.8086 7.8086 7.8613 7.8613 7.9871 7.9871 8.6657 8.6657 8.9036 8.9036 9.1733 9.1733 9.2915 9.2915 9.3303 9.3303 9.7013 9.7013 9.8521 9.8521 9.9158 9.9158 10.0212 10.0212 10.1093 10.1093 10.1979 10.1979 10.4732 10.4732 10.9853 10.9853 11.4577 11.4577 13.0765 13.0765 13.3204 13.3204 13.6448 13.6448 14.9972 14.9972 15.9602 15.9602 16.1433 16.1433 k = 0.6179 0.3462-0.1992 ( 4121 PWs) bands (ev): -2.3511 -2.3511 -2.2746 -2.2746 -1.3896 -1.3896 -1.3602 -1.3602 -1.3146 -1.3146 -1.1695 -1.1695 0.6901 0.6901 0.7474 0.7474 0.7647 0.7647 0.8254 0.8254 0.8601 0.8601 0.9371 0.9371 3.2515 3.2515 3.9895 3.9895 5.6922 5.6922 6.6417 6.6417 7.0190 7.0190 7.4683 7.4683 7.7814 7.7814 7.8638 7.8638 7.9897 7.9897 8.6730 8.6730 8.9086 8.9086 9.1863 9.1863 9.2885 9.2885 9.3209 9.3209 9.7016 9.7016 9.8378 9.8378 9.9180 9.9180 10.0196 10.0196 10.0963 10.0963 10.2155 10.2155 10.4793 10.4793 10.9947 10.9947 11.4626 11.4626 13.0665 13.0665 13.3371 13.3371 13.6333 13.6333 15.0034 15.0034 15.9177 15.9177 16.1455 16.1455 k = 0.6130 0.3435-0.1827 ( 4117 PWs) bands (ev): -2.3546 -2.3546 -2.2727 -2.2727 -1.3891 -1.3891 -1.3599 -1.3599 -1.3147 -1.3147 -1.1727 -1.1727 0.6897 0.6897 0.7488 0.7488 0.7650 0.7650 0.8241 0.8241 0.8609 0.8609 0.9326 0.9326 3.2478 3.2478 3.9903 3.9903 5.7178 5.7178 6.6975 6.6975 7.0104 7.0104 7.4296 7.4296 7.7536 7.7536 7.8604 7.8604 7.9937 7.9937 8.6831 8.6831 8.9132 8.9132 9.1969 9.1969 9.2884 9.2884 9.3108 9.3108 9.7023 9.7023 9.8224 9.8224 9.9202 9.9202 10.0191 10.0191 10.0833 10.0833 10.2349 10.2349 10.4867 10.4867 11.0037 11.0037 11.4663 11.4663 13.0405 13.0405 13.3644 13.3644 13.6278 13.6278 15.0115 15.0115 15.8612 15.8612 16.1535 16.1535 k = 0.6081 0.3407-0.1663 ( 4121 PWs) bands (ev): -2.3594 -2.3594 -2.2697 -2.2697 -1.3886 -1.3886 -1.3596 -1.3596 -1.3150 -1.3150 -1.1759 -1.1759 0.6892 0.6892 0.7501 0.7501 0.7656 0.7656 0.8226 0.8226 0.8615 0.8615 0.9280 0.9280 3.2426 3.2426 3.9977 3.9977 5.7453 5.7453 6.7479 6.7479 7.0014 7.0014 7.3958 7.3958 7.7251 7.7251 7.8519 7.8519 7.9979 7.9979 8.6955 8.6955 8.9172 8.9172 9.2026 9.2026 9.2916 9.2916 9.3018 9.3018 9.7030 9.7030 9.8069 9.8069 9.9224 9.9224 10.0198 10.0198 10.0706 10.0706 10.2557 10.2557 10.4956 10.4956 11.0122 11.0122 11.4685 11.4685 13.0028 13.0028 13.3973 13.3973 13.6296 13.6296 15.0207 15.0207 15.7956 15.7956 16.1625 16.1625 k = 0.6031 0.3380-0.1498 ( 4119 PWs) bands (ev): -2.3652 -2.3652 -2.2660 -2.2660 -1.3883 -1.3883 -1.3593 -1.3593 -1.3155 -1.3155 -1.1790 -1.1790 0.6884 0.6884 0.7513 0.7513 0.7664 0.7664 0.8208 0.8208 0.8620 0.8620 0.9235 0.9235 3.2359 3.2359 4.0116 4.0116 5.7747 5.7747 6.7886 6.7886 6.9956 6.9956 7.3677 7.3677 7.6961 7.6961 7.8395 7.8395 8.0010 8.0010 8.7099 8.7099 8.9207 8.9207 9.2017 9.2017 9.2864 9.2864 9.3071 9.3071 9.7031 9.7031 9.7930 9.7930 9.9245 9.9245 10.0219 10.0219 10.0584 10.0584 10.2776 10.2776 10.5063 10.5063 11.0205 11.0205 11.4689 11.4689 12.9573 12.9573 13.4316 13.4316 13.6399 13.6399 15.0302 15.0302 15.7235 15.7235 16.1698 16.1698 k = 0.5982 0.3352-0.1333 ( 4106 PWs) bands (ev): -2.3716 -2.3716 -2.2621 -2.2621 -1.3881 -1.3881 -1.3589 -1.3589 -1.3162 -1.3162 -1.1821 -1.1821 0.6875 0.6875 0.7525 0.7525 0.7675 0.7675 0.8189 0.8189 0.8623 0.8623 0.9190 0.9190 3.2278 3.2278 4.0318 4.0318 5.8060 5.8060 6.8127 6.8127 6.9996 6.9996 7.3460 7.3460 7.6664 7.6664 7.8239 7.8239 8.0022 8.0022 8.7259 8.7259 8.9234 8.9234 9.1947 9.1947 9.2761 9.2761 9.3220 9.3220 9.7020 9.7020 9.7824 9.7824 9.9267 9.9267 10.0252 10.0252 10.0471 10.0471 10.3006 10.3006 10.5192 10.5192 11.0284 11.0284 11.4675 11.4675 12.9062 12.9062 13.4638 13.4638 13.6598 13.6598 15.0390 15.0390 15.6469 15.6469 16.1739 16.1739 k = 0.5933 0.3325-0.1169 ( 4110 PWs) bands (ev): -2.3784 -2.3784 -2.2580 -2.2580 -1.3880 -1.3880 -1.3585 -1.3585 -1.3171 -1.3171 -1.1851 -1.1851 0.6863 0.6863 0.7536 0.7536 0.7688 0.7688 0.8168 0.8168 0.8624 0.8624 0.9146 0.9146 3.2184 3.2184 4.0577 4.0577 5.8388 5.8388 6.8153 6.8153 7.0177 7.0177 7.3315 7.3315 7.6361 7.6361 7.8056 7.8056 8.0010 8.0010 8.7425 8.7425 8.9253 8.9253 9.1833 9.1833 9.2655 9.2655 9.3384 9.3384 9.6997 9.6997 9.7763 9.7763 9.9288 9.9288 10.0282 10.0282 10.0387 10.0387 10.3245 10.3245 10.5346 10.5346 11.0361 11.0361 11.4645 11.4645 12.8512 12.8512 13.4920 13.4920 13.6894 13.6894 15.0461 15.0461 15.5676 15.5676 16.1738 16.1738 k = 0.5884 0.3297-0.1004 ( 4114 PWs) bands (ev): -2.3854 -2.3854 -2.2540 -2.2540 -1.3880 -1.3880 -1.3581 -1.3581 -1.3182 -1.3182 -1.1880 -1.1880 0.6850 0.6850 0.7546 0.7546 0.7703 0.7703 0.8146 0.8146 0.8623 0.8623 0.9103 0.9103 3.2081 3.2081 4.0889 4.0889 5.8733 5.8733 6.8003 6.8003 7.0449 7.0449 7.3250 7.3250 7.6052 7.6052 7.7852 7.7852 7.9973 7.9973 8.7595 8.7595 8.9265 8.9265 9.1686 9.1686 9.2551 9.2551 9.3525 9.3525 9.6979 9.6979 9.7748 9.7748 9.9310 9.9310 10.0240 10.0240 10.0404 10.0404 10.3491 10.3491 10.5530 10.5530 11.0436 11.0436 11.4603 11.4603 12.7934 12.7934 13.5151 13.5151 13.7278 13.7278 15.0497 15.0497 15.4878 15.4878 16.1686 16.1686 k = 0.5835 0.3270-0.0839 ( 4116 PWs) bands (ev): -2.3924 -2.3924 -2.2500 -2.2500 -1.3881 -1.3881 -1.3576 -1.3576 -1.3194 -1.3194 -1.1909 -1.1909 0.6836 0.6836 0.7557 0.7557 0.7718 0.7718 0.8123 0.8123 0.8621 0.8621 0.9061 0.9061 3.1970 3.1970 4.1248 4.1248 5.9092 5.9092 6.7751 6.7751 7.0728 7.0728 7.3277 7.3277 7.5738 7.5738 7.7631 7.7631 7.9913 7.9913 8.7761 8.7761 8.9268 8.9268 9.1519 9.1519 9.2448 9.2448 9.3612 9.3612 9.6997 9.6997 9.7768 9.7768 9.9333 9.9333 10.0173 10.0173 10.0482 10.0482 10.3744 10.3744 10.5747 10.5747 11.0509 11.0509 11.4550 11.4550 12.7337 12.7337 13.5330 13.5330 13.7734 13.7734 15.0477 15.0477 15.4110 15.4110 16.1578 16.1578 k = 0.5786 0.3242-0.0675 ( 4108 PWs) bands (ev): -2.3995 -2.3995 -2.2461 -2.2461 -1.3883 -1.3883 -1.3572 -1.3572 -1.3207 -1.3207 -1.1937 -1.1937 0.6820 0.6820 0.7568 0.7568 0.7735 0.7735 0.8101 0.8101 0.8616 0.8616 0.9020 0.9020 3.1854 3.1854 4.1648 4.1648 5.9463 5.9463 6.7448 6.7448 7.0953 7.0953 7.3400 7.3400 7.5418 7.5418 7.7400 7.7400 7.9833 7.9833 8.7920 8.7920 8.9263 8.9263 9.1339 9.1339 9.2344 9.2344 9.3620 9.3620 9.7069 9.7069 9.7809 9.7809 9.9357 9.9357 10.0126 10.0126 10.0582 10.0582 10.4003 10.4003 10.6005 10.6005 11.0582 11.0582 11.4493 11.4493 12.6728 12.6728 13.5453 13.5453 13.8243 13.8243 15.0365 15.0365 15.3422 15.3422 16.1411 16.1411 k = 0.5737 0.3215-0.0510 ( 4114 PWs) bands (ev): -2.4064 -2.4064 -2.2424 -2.2424 -1.3886 -1.3886 -1.3567 -1.3567 -1.3221 -1.3221 -1.1964 -1.1964 0.6803 0.6803 0.7579 0.7579 0.7752 0.7752 0.8079 0.8079 0.8610 0.8610 0.8979 0.8979 3.1737 3.1737 4.2083 4.2083 5.9847 5.9847 6.7123 6.7123 7.1103 7.1103 7.3601 7.3601 7.5093 7.5093 7.7171 7.7171 7.9738 7.9738 8.8069 8.8069 8.9249 8.9249 9.1150 9.1150 9.2238 9.2238 9.3544 9.3544 9.7196 9.7196 9.7860 9.7860 9.9382 9.9382 10.0110 10.0110 10.0697 10.0697 10.4267 10.4267 10.6310 10.6310 11.0655 11.0655 11.4436 11.4436 12.6113 12.6113 13.5511 13.5511 13.8792 13.8792 15.0117 15.0117 15.2873 15.2873 16.1182 16.1182 k = 0.5688 0.3187-0.0345 ( 4112 PWs) bands (ev): -2.4131 -2.4131 -2.2388 -2.2388 -1.3890 -1.3890 -1.3562 -1.3562 -1.3234 -1.3234 -1.1990 -1.1990 0.6785 0.6785 0.7592 0.7592 0.7768 0.7768 0.8059 0.8059 0.8602 0.8602 0.8940 0.8940 3.1619 3.1619 4.2545 4.2545 6.0240 6.0240 6.6795 6.6795 7.1183 7.1183 7.3834 7.3834 7.4767 7.4767 7.6967 7.6967 7.9632 7.9632 8.8205 8.8205 8.9228 8.9228 9.0959 9.0959 9.2126 9.2126 9.3393 9.3393 9.7356 9.7356 9.7916 9.7916 9.9409 9.9409 10.0133 10.0133 10.0825 10.0825 10.4533 10.4533 10.6666 10.6666 11.0729 11.0729 11.4383 11.4383 12.5498 12.5498 13.5489 13.5489 13.9369 13.9369 14.9722 14.9722 15.2500 15.2500 16.0892 16.0892 k = 0.5638 0.3160-0.0181 ( 4114 PWs) bands (ev): -2.4197 -2.4197 -2.2354 -2.2354 -1.3894 -1.3894 -1.3558 -1.3558 -1.3248 -1.3248 -1.2015 -1.2015 0.6767 0.6767 0.7605 0.7605 0.7783 0.7783 0.8042 0.8042 0.8593 0.8593 0.8901 0.8901 3.1504 3.1504 4.3027 4.3027 6.0641 6.0641 6.6473 6.6473 7.1215 7.1215 7.4015 7.4015 7.4455 7.4455 7.6829 7.6829 7.9519 7.9519 8.8326 8.8326 8.9199 8.9199 9.0771 9.0771 9.2005 9.2005 9.3188 9.3188 9.7519 9.7519 9.7975 9.7975 9.9436 9.9436 10.0203 10.0203 10.0963 10.0963 10.4800 10.4800 10.7080 10.7080 11.0806 11.0806 11.4339 11.4339 12.4889 12.4889 13.5368 13.5368 13.9964 13.9964 14.9227 14.9227 15.2278 15.2278 16.0542 16.0542 k = 0.5589 0.3132-0.0016 ( 4106 PWs) bands (ev): -2.4259 -2.4259 -2.2323 -2.2323 -1.3898 -1.3898 -1.3553 -1.3553 -1.3261 -1.3261 -1.2040 -1.2040 0.6749 0.6749 0.7619 0.7619 0.7795 0.7795 0.8030 0.8030 0.8582 0.8582 0.8863 0.8863 3.1393 3.1393 4.3523 4.3523 6.1047 6.1047 6.6168 6.6168 7.1216 7.1216 7.3969 7.3969 7.4254 7.4254 7.6811 7.6811 7.9405 7.9405 8.8432 8.8432 8.9164 8.9164 9.0590 9.0590 9.1869 9.1869 9.2954 9.2954 9.7659 9.7659 9.8036 9.8036 9.9464 9.9464 10.0319 10.0319 10.1107 10.1107 10.5064 10.5064 10.7553 10.7553 11.0886 11.0886 11.4311 11.4311 12.4293 12.4293 13.5130 13.5130 14.0567 14.0567 14.8715 14.8715 15.2151 15.2151 16.0136 16.0136 k = 0.5540 0.3105 0.0148 ( 4115 PWs) bands (ev): -2.4318 -2.4318 -2.2293 -2.2293 -1.3903 -1.3903 -1.3549 -1.3549 -1.3274 -1.3274 -1.2063 -1.2063 0.6731 0.6731 0.7633 0.7633 0.7803 0.7803 0.8024 0.8024 0.8569 0.8569 0.8825 0.8825 3.1287 3.1287 4.4025 4.4025 6.1456 6.1456 6.5886 6.5886 7.1199 7.1199 7.3675 7.3675 7.4136 7.4136 7.6949 7.6949 7.9292 7.9292 8.8519 8.8519 8.9122 8.9122 9.0418 9.0418 9.1709 9.1709 9.2715 9.2715 9.7760 9.7760 9.8100 9.8100 9.9489 9.9489 10.0473 10.0473 10.1252 10.1252 10.5324 10.5324 10.8084 10.8084 11.0969 11.0969 11.4304 11.4304 12.3717 12.3717 13.4758 13.4758 14.1170 14.1170 14.8255 14.8255 15.2072 15.2072 15.9680 15.9680 k = 0.5491 0.3077 0.0313 ( 4115 PWs) bands (ev): -2.4374 -2.4374 -2.2266 -2.2266 -1.3908 -1.3908 -1.3545 -1.3545 -1.3285 -1.3285 -1.2085 -1.2085 0.6713 0.6713 0.7648 0.7648 0.7806 0.7806 0.8025 0.8025 0.8556 0.8556 0.8788 0.8788 3.1187 3.1187 4.4526 4.4526 6.1865 6.1865 6.5631 6.5631 7.1172 7.1172 7.3335 7.3335 7.3912 7.3912 7.7223 7.7223 7.9185 7.9185 8.8588 8.8588 8.9074 8.9074 9.0261 9.0261 9.1518 9.1518 9.2493 9.2493 9.7824 9.7824 9.8166 9.8166 9.9513 9.9513 10.0655 10.0655 10.1396 10.1396 10.5577 10.5577 10.8661 10.8661 11.1058 11.1058 11.4326 11.4326 12.3169 12.3169 13.4244 13.4244 14.1761 14.1761 14.7893 14.7893 15.2015 15.2015 15.9180 15.9180 k = 0.5442 0.3050 0.0478 ( 4113 PWs) bands (ev): -2.4426 -2.4426 -2.2241 -2.2241 -1.3913 -1.3913 -1.3542 -1.3542 -1.3295 -1.3295 -1.2106 -1.2106 0.6697 0.6697 0.7664 0.7664 0.7804 0.7804 0.8034 0.8034 0.8541 0.8541 0.8752 0.8752 3.1095 3.1095 4.5016 4.5016 6.2270 6.2270 6.5409 6.5409 7.1140 7.1140 7.2987 7.2987 7.3595 7.3595 7.7584 7.7584 7.9087 7.9087 8.8637 8.8637 8.9022 8.9022 9.0120 9.0120 9.1292 9.1292 9.2304 9.2304 9.7859 9.7859 9.8226 9.8226 9.9535 9.9535 10.0847 10.0847 10.1535 10.1535 10.5820 10.5820 10.9268 10.9268 11.1153 11.1153 11.4385 11.4385 12.2662 12.2662 13.3589 13.3589 14.2326 14.2326 14.7656 14.7656 15.1964 15.1964 15.8647 15.8647 k = 0.5393 0.3022 0.0642 ( 4111 PWs) bands (ev): -2.4473 -2.4473 -2.2219 -2.2219 -1.3918 -1.3918 -1.3539 -1.3539 -1.3304 -1.3304 -1.2126 -1.2126 0.6681 0.6681 0.7679 0.7679 0.7798 0.7798 0.8048 0.8048 0.8526 0.8526 0.8718 0.8718 3.1010 3.1010 4.5488 4.5488 6.2666 6.2666 6.5220 6.5220 7.1108 7.1108 7.2637 7.2637 7.3225 7.3225 7.7983 7.7983 7.9001 7.9001 8.8662 8.8662 8.8967 8.8967 8.9997 8.9997 9.1038 9.1038 9.2153 9.2153 9.7878 9.7878 9.8278 9.8278 9.9556 9.9556 10.1038 10.1038 10.1664 10.1664 10.6052 10.6052 10.9879 10.9879 11.1254 11.1254 11.4490 11.4490 12.2211 12.2211 13.2805 13.2805 14.2849 14.2849 14.7555 14.7555 15.1908 15.1908 15.8091 15.8091 k = 0.5344 0.2995 0.0807 ( 4109 PWs) bands (ev): -2.4515 -2.4515 -2.2199 -2.2199 -1.3923 -1.3923 -1.3536 -1.3536 -1.3312 -1.3312 -1.2144 -1.2144 0.6667 0.6667 0.7693 0.7693 0.7790 0.7790 0.8067 0.8067 0.8509 0.8509 0.8684 0.8684 3.0935 3.0935 4.5934 4.5934 6.3047 6.3047 6.5069 6.5069 7.1075 7.1075 7.2289 7.2289 7.2836 7.2836 7.8382 7.8382 7.8937 7.8937 8.8662 8.8662 8.8911 8.8911 8.9892 8.9892 9.0775 9.0775 9.2035 9.2035 9.7887 9.7887 9.8322 9.8322 9.9574 9.9574 10.1217 10.1217 10.1781 10.1781 10.6268 10.6268 11.0459 11.0459 11.1361 11.1361 11.4650 11.4650 12.1839 12.1839 13.1911 13.1911 14.3316 14.3316 14.7592 14.7592 15.1840 15.1840 15.7525 15.7525 k = 0.5295 0.2967 0.0972 ( 4099 PWs) bands (ev): -2.4553 -2.4553 -2.2181 -2.2181 -1.3927 -1.3927 -1.3535 -1.3535 -1.3318 -1.3318 -1.2160 -1.2160 0.6654 0.6654 0.7707 0.7707 0.7782 0.7782 0.8089 0.8089 0.8492 0.8492 0.8653 0.8653 3.0868 3.0868 4.6343 4.6343 6.3405 6.3405 6.4956 6.4956 7.1046 7.1046 7.1947 7.1947 7.2452 7.2452 7.8679 7.8679 7.8977 7.8977 8.8640 8.8640 8.8851 8.8851 8.9805 8.9805 9.0524 9.0524 9.1942 9.1942 9.7891 9.7891 9.8358 9.8358 9.9590 9.9590 10.1379 10.1379 10.1886 10.1886 10.6466 10.6466 11.0969 11.0969 11.1479 11.1479 11.4862 11.4862 12.1574 12.1574 13.0932 13.0932 14.3711 14.3711 14.7760 14.7760 15.1754 15.1754 15.6963 15.6963 k = 0.5246 0.2939 0.1136 ( 4099 PWs) bands (ev): -2.4585 -2.4585 -2.2166 -2.2166 -1.3931 -1.3931 -1.3533 -1.3533 -1.3322 -1.3322 -1.2174 -1.2174 0.6642 0.6642 0.7720 0.7720 0.7773 0.7773 0.8114 0.8114 0.8474 0.8474 0.8626 0.8626 3.0811 3.0811 4.6708 4.6708 6.3729 6.3729 6.4884 6.4884 7.1019 7.1019 7.1618 7.1618 7.2094 7.2094 7.8714 7.8714 7.9264 7.9264 8.8601 8.8601 8.8780 8.8780 8.9735 8.9735 9.0305 9.0305 9.1870 9.1870 9.7891 9.7891 9.8387 9.8387 9.9604 9.9604 10.1520 10.1520 10.1974 10.1974 10.6640 10.6640 11.1352 11.1352 11.1636 11.1636 11.5108 11.5108 12.1455 12.1455 12.9893 12.9893 14.4030 14.4030 14.8045 14.8045 15.1640 15.1640 15.6425 15.6425 k = 0.5196 0.2912 0.1301 ( 4093 PWs) bands (ev): -2.4611 -2.4611 -2.2154 -2.2154 -1.3935 -1.3935 -1.3532 -1.3532 -1.3326 -1.3326 -1.2185 -1.2185 0.6633 0.6633 0.7731 0.7731 0.7765 0.7765 0.8138 0.8138 0.8455 0.8455 0.8602 0.8602 3.0765 3.0765 4.7020 4.7020 6.4003 6.4003 6.4854 6.4854 7.0996 7.0996 7.1313 7.1313 7.1780 7.1780 7.8681 7.8681 7.9591 7.9591 8.8553 8.8553 8.8697 8.8697 8.9680 8.9680 9.0131 9.0131 9.1813 9.1813 9.7891 9.7891 9.8410 9.8410 9.9616 9.9616 10.1637 10.1637 10.2047 10.2047 10.6789 10.6789 11.1550 11.1550 11.1877 11.1877 11.5348 11.5348 12.1519 12.1519 12.8825 12.8825 14.4273 14.4273 14.8421 14.8421 15.1488 15.1488 15.5933 15.5933 k = 0.5147 0.2884 0.1466 ( 4084 PWs) bands (ev): -2.4632 -2.4632 -2.2144 -2.2144 -1.3937 -1.3937 -1.3532 -1.3532 -1.3328 -1.3328 -1.2195 -1.2195 0.6626 0.6626 0.7740 0.7740 0.7759 0.7759 0.8163 0.8163 0.8436 0.8436 0.8583 0.8583 3.0728 3.0728 4.7271 4.7271 6.4209 6.4209 6.4868 6.4868 7.0974 7.0974 7.1051 7.1051 7.1522 7.1522 7.8647 7.8647 7.9873 7.9873 8.8498 8.8498 8.8614 8.8614 8.9641 8.9641 9.0006 9.0006 9.1771 9.1771 9.7890 9.7890 9.8428 9.8428 9.9625 9.9625 10.1729 10.1729 10.2104 10.2104 10.6908 10.6908 11.1651 11.1651 11.2115 11.2115 11.5539 11.5539 12.1788 12.1788 12.7763 12.7763 14.4450 14.4450 14.8860 14.8860 15.1284 15.1284 15.5511 15.5511 k = 0.5098 0.2857 0.1630 ( 4088 PWs) bands (ev): -2.4647 -2.4647 -2.2137 -2.2137 -1.3939 -1.3939 -1.3532 -1.3532 -1.3330 -1.3330 -1.2202 -1.2202 0.6620 0.6620 0.7746 0.7746 0.7754 0.7754 0.8184 0.8184 0.8418 0.8418 0.8569 0.8569 3.0701 3.0701 4.7456 4.7456 6.4336 6.4336 6.4919 6.4919 7.0834 7.0834 7.0970 7.0970 7.1329 7.1329 7.8621 7.8621 8.0090 8.0090 8.8436 8.8436 8.8552 8.8552 8.9615 8.9615 8.9925 8.9925 9.1741 9.1741 9.7889 9.7889 9.8439 9.8439 9.9632 9.9632 10.1794 10.1794 10.2144 10.2144 10.6995 10.6995 11.1715 11.1715 11.2292 11.2292 11.5661 11.5661 12.2234 12.2234 12.6760 12.6760 14.4569 14.4569 14.9329 14.9329 15.1016 15.1016 15.5186 15.5186 k = 0.5049 0.2829 0.1795 ( 4090 PWs) bands (ev): -2.4656 -2.4656 -2.2133 -2.2133 -1.3940 -1.3940 -1.3531 -1.3531 -1.3331 -1.3331 -1.2206 -1.2206 0.6617 0.6617 0.7750 0.7750 0.7751 0.7751 0.8199 0.8199 0.8405 0.8405 0.8561 0.8561 3.0686 3.0686 4.7569 4.7569 6.4398 6.4398 6.4973 6.4973 7.0701 7.0701 7.0961 7.0961 7.1209 7.1209 7.8605 7.8605 8.0226 8.0226 8.8382 8.8382 8.8520 8.8520 8.9600 8.9600 8.9881 8.9881 9.1723 9.1723 9.7888 9.7888 9.8446 9.8446 9.9636 9.9636 10.1834 10.1834 10.2168 10.2168 10.7047 10.7047 11.1753 11.1753 11.2400 11.2400 11.5721 11.5721 12.2742 12.2742 12.5927 12.5927 14.4638 14.4638 14.9797 14.9797 15.0684 15.0684 15.4982 15.4982 k = 0.5000 0.2802 0.1960 ( 4092 PWs) bands (ev): -2.4659 -2.4659 -2.2131 -2.2131 -1.3941 -1.3941 -1.3531 -1.3531 -1.3331 -1.3331 -1.2207 -1.2207 0.6616 0.6616 0.7750 0.7750 0.7752 0.7752 0.8204 0.8204 0.8400 0.8400 0.8559 0.8559 3.0680 3.0680 4.7607 4.7607 6.4416 6.4416 6.4995 6.4995 7.0655 7.0655 7.0958 7.0958 7.1168 7.1168 7.8599 7.8599 8.0273 8.0273 8.8361 8.8361 8.8510 8.8510 8.9594 8.9594 8.9866 8.9866 9.1717 9.1717 9.7888 9.7888 9.8449 9.8449 9.9637 9.9637 10.1847 10.1847 10.2177 10.2177 10.7064 10.7064 11.1765 11.1765 11.2437 11.2437 11.5737 11.5737 12.3008 12.3008 12.5554 12.5554 14.4660 14.4660 15.0147 15.0147 15.0382 15.0382 15.4912 15.4912 k = 0.5000-0.3060-0.2141 ( 4126 PWs) bands (ev): -2.3854 -2.3854 -2.2971 -2.2971 -1.4051 -1.4051 -1.3636 -1.3636 -1.2660 -1.2660 -1.2589 -1.2589 0.6857 0.6857 0.7212 0.7212 0.7706 0.7706 0.8084 0.8084 0.8853 0.8853 0.8867 0.8867 3.7888 3.7888 4.1668 4.1668 5.9416 5.9416 6.5968 6.5968 6.7530 6.7530 6.9062 6.9062 7.6017 7.6017 7.8059 7.8059 8.4050 8.4050 8.7668 8.7668 8.8120 8.8120 8.9090 8.9090 9.3377 9.3377 9.4105 9.4105 9.7306 9.7306 9.9142 9.9142 9.9162 9.9162 10.0029 10.0029 10.0980 10.0980 10.2099 10.2099 10.8580 10.8580 11.1664 11.1664 11.5499 11.5499 12.0586 12.0586 12.9109 12.9109 13.9357 13.9357 14.2486 14.2486 15.1058 15.1058 15.8454 15.8454 k = 0.5106-0.2944-0.2059 ( 4133 PWs) bands (ev): -2.3852 -2.3852 -2.2971 -2.2971 -1.4050 -1.4050 -1.3636 -1.3636 -1.2668 -1.2668 -1.2580 -1.2580 0.6857 0.6857 0.7213 0.7213 0.7705 0.7705 0.8086 0.8086 0.8838 0.8838 0.8883 0.8883 3.7886 3.7886 4.1636 4.1636 5.9420 5.9420 6.5870 6.5870 6.7583 6.7583 6.9159 6.9159 7.6018 7.6018 7.8047 7.8047 8.4041 8.4041 8.7603 8.7603 8.8142 8.8142 8.9129 8.9129 9.3375 9.3375 9.4107 9.4107 9.7304 9.7304 9.9134 9.9134 9.9170 9.9170 10.0018 10.0018 10.0986 10.0986 10.2104 10.2104 10.8562 10.8562 11.1661 11.1661 11.5390 11.5390 12.0696 12.0696 12.9112 12.9112 13.9419 13.9419 14.2526 14.2526 15.0995 15.0995 15.8497 15.8497 k = 0.5213-0.2827-0.1977 ( 4135 PWs) bands (ev): -2.3845 -2.3845 -2.2972 -2.2972 -1.4049 -1.4049 -1.3636 -1.3636 -1.2685 -1.2685 -1.2558 -1.2558 0.6858 0.6858 0.7216 0.7216 0.7702 0.7702 0.8090 0.8090 0.8818 0.8818 0.8904 0.8904 3.7881 3.7881 4.1540 4.1540 5.9432 5.9432 6.5607 6.5607 6.7740 6.7740 6.9420 6.9420 7.6021 7.6021 7.8011 7.8011 8.4013 8.4013 8.7449 8.7449 8.8183 8.8183 8.9239 8.9239 9.3371 9.3371 9.4111 9.4111 9.7297 9.7297 9.9120 9.9120 9.9183 9.9183 9.9988 9.9988 10.1002 10.1002 10.2120 10.2120 10.8508 10.8508 11.1651 11.1651 11.5094 11.5094 12.0996 12.0996 12.9123 12.9123 13.9601 13.9601 14.2648 14.2648 15.0812 15.0812 15.8622 15.8622 k = 0.5319-0.2710-0.1896 ( 4140 PWs) bands (ev): -2.3834 -2.3834 -2.2972 -2.2972 -1.4046 -1.4046 -1.3636 -1.3636 -1.2705 -1.2705 -1.2531 -1.2531 0.6859 0.6859 0.7222 0.7222 0.7697 0.7697 0.8097 0.8097 0.8798 0.8798 0.8926 0.8926 3.7873 3.7873 4.1383 4.1383 5.9461 5.9461 6.5235 6.5235 6.7994 6.7994 6.9786 6.9786 7.6027 7.6027 7.7953 7.7953 8.3964 8.3964 8.7252 8.7252 8.8220 8.8220 8.9395 8.9395 9.3364 9.3364 9.4118 9.4118 9.7287 9.7287 9.9104 9.9104 9.9196 9.9196 9.9942 9.9942 10.1027 10.1027 10.2147 10.2147 10.8416 10.8416 11.1635 11.1635 11.4678 11.4678 12.1429 12.1429 12.9142 12.9142 13.9883 13.9883 14.2861 14.2861 15.0526 15.0526 15.8813 15.8813 k = 0.5426-0.2593-0.1814 ( 4133 PWs) bands (ev): -2.3819 -2.3819 -2.2973 -2.2973 -1.4043 -1.4043 -1.3636 -1.3636 -1.2725 -1.2725 -1.2501 -1.2501 0.6862 0.6862 0.7230 0.7230 0.7690 0.7690 0.8106 0.8106 0.8779 0.8779 0.8949 0.8949 3.7862 3.7862 4.1167 4.1167 5.9516 5.9516 6.4800 6.4800 6.8330 6.8330 7.0210 7.0210 7.6034 7.6034 7.7874 7.7874 8.3891 8.3891 8.7041 8.7041 8.8253 8.8253 8.9575 8.9575 9.3354 9.3354 9.4126 9.4126 9.7275 9.7275 9.9090 9.9090 9.9206 9.9206 9.9886 9.9886 10.1055 10.1055 10.2183 10.2183 10.8283 10.8283 11.1612 11.1612 11.4209 11.4209 12.1942 12.1942 12.9167 12.9167 14.0233 14.0233 14.3185 14.3185 15.0162 15.0162 15.9054 15.9054 k = 0.5532-0.2477-0.1732 ( 4129 PWs) bands (ev): -2.3800 -2.3800 -2.2975 -2.2975 -1.4038 -1.4038 -1.3637 -1.3637 -1.2744 -1.2744 -1.2469 -1.2469 0.6865 0.6865 0.7241 0.7241 0.7682 0.7682 0.8117 0.8117 0.8760 0.8760 0.8971 0.8971 3.7848 3.7848 4.0897 4.0897 5.9605 5.9605 6.4329 6.4329 6.8728 6.8728 7.0664 7.0664 7.6045 7.6045 7.7775 7.7775 8.3790 8.3790 8.6832 8.6832 8.8283 8.8283 8.9765 8.9765 9.3342 9.3342 9.4136 9.4136 9.7259 9.7259 9.9076 9.9076 9.9213 9.9213 9.9825 9.9825 10.1084 10.1084 10.2228 10.2228 10.8104 10.8104 11.1582 11.1582 11.3736 11.3736 12.2498 12.2498 12.9200 12.9200 14.0607 14.0607 14.3641 14.3641 14.9746 14.9746 15.9325 15.9325 k = 0.5638-0.2360-0.1651 ( 4121 PWs) bands (ev): -2.3778 -2.3778 -2.2976 -2.2976 -1.4032 -1.4032 -1.3637 -1.3637 -1.2762 -1.2762 -1.2436 -1.2436 0.6868 0.6868 0.7253 0.7253 0.7672 0.7672 0.8130 0.8130 0.8743 0.8743 0.8994 0.8994 3.7833 3.7833 4.0579 4.0579 5.9737 5.9737 6.3840 6.3840 6.9168 6.9168 7.1133 7.1133 7.6061 7.6061 7.7657 7.7657 8.3655 8.3655 8.6639 8.6639 8.8313 8.8313 8.9958 8.9958 9.3328 9.3328 9.4145 9.4145 9.7241 9.7241 9.9062 9.9062 9.9215 9.9215 9.9765 9.9765 10.1112 10.1112 10.2280 10.2280 10.7878 10.7878 11.1544 11.1544 11.3298 11.3298 12.3077 12.3077 12.9242 12.9242 14.0958 14.0958 14.4250 14.4250 14.9305 14.9305 15.9611 15.9611 k = 0.5745-0.2243-0.1569 ( 4120 PWs) bands (ev): -2.3753 -2.3753 -2.2977 -2.2977 -1.4026 -1.4026 -1.3637 -1.3637 -1.2780 -1.2780 -1.2400 -1.2400 0.6872 0.6872 0.7267 0.7267 0.7662 0.7662 0.8144 0.8144 0.8726 0.8726 0.9016 0.9016 3.7814 3.7814 4.0220 4.0220 5.9919 5.9919 6.3342 6.3342 6.9627 6.9627 7.1608 7.1608 7.6081 7.6081 7.7524 7.7524 8.3483 8.3483 8.6468 8.6468 8.8345 8.8345 9.0148 9.0148 9.3310 9.3310 9.4152 9.4152 9.7221 9.7221 9.9047 9.9047 9.9210 9.9210 9.9712 9.9712 10.1136 10.1136 10.2335 10.2335 10.7605 10.7605 11.1498 11.1498 11.2918 11.2918 12.3669 12.3669 12.9293 12.9293 14.1247 14.1247 14.5014 14.5014 14.8870 14.8870 15.9901 15.9901 k = 0.5851-0.2126-0.1487 ( 4126 PWs) bands (ev): -2.3725 -2.3725 -2.2978 -2.2978 -1.4019 -1.4019 -1.3637 -1.3637 -1.2797 -1.2797 -1.2363 -1.2363 0.6877 0.6877 0.7283 0.7283 0.7651 0.7651 0.8159 0.8159 0.8710 0.8710 0.9038 0.9038 3.7790 3.7790 3.9833 3.9833 6.0153 6.0153 6.2841 6.2841 7.0082 7.0082 7.2082 7.2082 7.6110 7.6110 7.7381 7.7381 8.3273 8.3273 8.6327 8.6327 8.8377 8.8377 9.0331 9.0331 9.3290 9.3290 9.4157 9.4157 9.7201 9.7201 9.9028 9.9028 9.9194 9.9194 9.9670 9.9670 10.1157 10.1157 10.2390 10.2390 10.7291 10.7291 11.1446 11.1446 11.2609 11.2609 12.4268 12.4268 12.9356 12.9356 14.1449 14.1449 14.5910 14.5910 14.8481 14.8481 16.0186 16.0186 k = 0.5958-0.2010-0.1406 ( 4120 PWs) bands (ev): -2.3694 -2.3694 -2.2978 -2.2978 -1.4011 -1.4011 -1.3637 -1.3637 -1.2814 -1.2814 -1.2325 -1.2325 0.6882 0.6882 0.7301 0.7301 0.7640 0.7640 0.8175 0.8175 0.8696 0.8696 0.9060 0.9060 3.7751 3.7751 3.9432 3.9432 6.0443 6.0443 6.2342 6.2342 7.0510 7.0510 7.2552 7.2552 7.6151 7.6151 7.7231 7.7231 8.3027 8.3027 8.6218 8.6218 8.8412 8.8412 9.0508 9.0508 9.3269 9.3269 9.4157 9.4157 9.7181 9.7181 9.9006 9.9006 9.9171 9.9171 9.9645 9.9645 10.1176 10.1176 10.2440 10.2440 10.6950 10.6950 11.1388 11.1388 11.2372 11.2372 12.4871 12.4871 12.9433 12.9433 14.1550 14.1550 14.6854 14.6854 14.8226 14.8226 16.0460 16.0460 k = 0.6064-0.1893-0.1324 ( 4110 PWs) bands (ev): -2.3663 -2.3663 -2.2977 -2.2977 -1.4003 -1.4003 -1.3637 -1.3637 -1.2830 -1.2830 -1.2286 -1.2286 0.6887 0.6887 0.7321 0.7321 0.7629 0.7629 0.8191 0.8191 0.8682 0.8682 0.9082 0.9082 3.7681 3.7681 3.9047 3.9047 6.0785 6.0785 6.1849 6.1849 7.0884 7.0884 7.3016 7.3016 7.6212 7.6212 7.7083 7.7083 8.2750 8.2750 8.6140 8.6140 8.8449 8.8449 9.0675 9.0675 9.3246 9.3246 9.4152 9.4152 9.7161 9.7161 9.8974 9.8974 9.9146 9.9146 9.9636 9.9636 10.1194 10.1194 10.2482 10.2482 10.6599 10.6599 11.1330 11.1330 11.2203 11.2203 12.5477 12.5477 12.9526 12.9526 14.1533 14.1533 14.7422 14.7422 14.8531 14.8531 16.0720 16.0720 k = 0.6171-0.1776-0.1242 ( 4106 PWs) bands (ev): -2.3631 -2.3631 -2.2976 -2.2976 -1.3994 -1.3994 -1.3637 -1.3637 -1.2847 -1.2847 -1.2245 -1.2245 0.6892 0.6892 0.7342 0.7342 0.7617 0.7617 0.8208 0.8208 0.8669 0.8669 0.9104 0.9104 3.7539 3.7539 3.8723 3.8723 6.1172 6.1172 6.1371 6.1371 7.1179 7.1179 7.3470 7.3470 7.6299 7.6299 7.6944 7.6944 8.2450 8.2450 8.6090 8.6090 8.8487 8.8487 9.0832 9.0832 9.3222 9.3222 9.4141 9.4141 9.7144 9.7144 9.8930 9.8930 9.9124 9.9124 9.9642 9.9642 10.1210 10.1210 10.2509 10.2509 10.6252 10.6252 11.1271 11.1271 11.2094 11.2094 12.6084 12.6084 12.9637 12.9637 14.1389 14.1389 14.7428 14.7428 14.9574 14.9574 16.0962 16.0962 k = 0.6277-0.1659-0.1161 ( 4114 PWs) bands (ev): -2.3598 -2.3598 -2.2973 -2.2973 -1.3985 -1.3985 -1.3636 -1.3636 -1.2863 -1.2863 -1.2203 -1.2203 0.6898 0.6898 0.7363 0.7363 0.7605 0.7605 0.8224 0.8224 0.8657 0.8657 0.9126 0.9126 3.7282 3.7282 3.8516 3.8516 6.0883 6.0883 6.1625 6.1625 7.1370 7.1370 7.3914 7.3914 7.6415 7.6415 7.6822 7.6822 8.2134 8.2134 8.6065 8.6065 8.8526 8.8526 9.0978 9.0978 9.3197 9.3197 9.4122 9.4122 9.7127 9.7127 9.8875 9.8875 9.9108 9.9108 9.9657 9.9657 10.1226 10.1226 10.2514 10.2514 10.5929 10.5929 11.1210 11.1210 11.2039 11.2039 12.6694 12.6694 12.9767 12.9767 14.1120 14.1120 14.7405 14.7405 15.0805 15.0805 16.1186 16.1186 k = 0.6383-0.1543-0.1079 ( 4111 PWs) bands (ev): -2.3567 -2.3567 -2.2968 -2.2968 -1.3976 -1.3976 -1.3635 -1.3635 -1.2881 -1.2881 -1.2160 -1.2160 0.6903 0.6903 0.7386 0.7386 0.7593 0.7593 0.8239 0.8239 0.8646 0.8646 0.9148 0.9148 3.6913 3.6913 3.8428 3.8428 6.0420 6.0420 6.2109 6.2109 7.1443 7.1443 7.4347 7.4347 7.6533 7.6533 7.6754 7.6754 8.1812 8.1812 8.6060 8.6060 8.8567 8.8567 9.1112 9.1112 9.3173 9.3173 9.4094 9.4094 9.7114 9.7114 9.8814 9.8814 9.9098 9.9098 9.9683 9.9683 10.1241 10.1241 10.2495 10.2495 10.5641 10.5641 11.1146 11.1146 11.2037 11.2037 12.7303 12.7303 12.9917 12.9917 14.0739 14.0739 14.7457 14.7457 15.2090 15.2090 16.1389 16.1389 k = 0.6490-0.1426-0.0997 ( 4108 PWs) bands (ev): -2.3537 -2.3537 -2.2962 -2.2962 -1.3967 -1.3967 -1.3634 -1.3634 -1.2899 -1.2899 -1.2115 -1.2115 0.6908 0.6908 0.7409 0.7409 0.7581 0.7581 0.8254 0.8254 0.8635 0.8635 0.9170 0.9170 3.6480 3.6480 3.8421 3.8421 5.9970 5.9970 6.2631 6.2631 7.1394 7.1394 7.4768 7.4768 7.6528 7.6528 7.6862 7.6862 8.1492 8.1492 8.6071 8.6071 8.8608 8.8608 9.1233 9.1233 9.3151 9.3151 9.4059 9.4059 9.7102 9.7102 9.8753 9.8753 9.9093 9.9093 9.9715 9.9715 10.1258 10.1258 10.2450 10.2450 10.5398 10.5398 11.1072 11.1072 11.2085 11.2085 12.7910 12.7910 13.0090 13.0090 14.0271 14.0271 14.7581 14.7581 15.3388 15.3388 16.1569 16.1569 k = 0.6596-0.1309-0.0916 ( 4112 PWs) bands (ev): -2.3509 -2.3509 -2.2953 -2.2953 -1.3958 -1.3958 -1.3632 -1.3632 -1.2918 -1.2918 -1.2069 -1.2069 0.6912 0.6912 0.7433 0.7433 0.7569 0.7569 0.8267 0.8267 0.8626 0.8626 0.9194 0.9194 3.6020 3.6020 3.8464 3.8464 5.9534 5.9534 6.3182 6.3182 7.1231 7.1231 7.5176 7.5176 7.6453 7.6453 7.7082 7.7082 8.1180 8.1180 8.6097 8.6097 8.8650 8.8650 9.1339 9.1339 9.3129 9.3129 9.4014 9.4014 9.7093 9.7093 9.8694 9.8694 9.9090 9.9090 9.9754 9.9754 10.1276 10.1276 10.2378 10.2378 10.5201 10.5201 11.0987 11.0987 11.2182 11.2182 12.8510 12.8510 13.0284 13.0284 13.9739 13.9739 14.7760 14.7760 15.4668 15.4668 16.1725 16.1725 k = 0.6703-0.1193-0.0834 ( 4108 PWs) bands (ev): -2.3484 -2.3484 -2.2942 -2.2942 -1.3950 -1.3950 -1.3630 -1.3630 -1.2938 -1.2938 -1.2023 -1.2023 0.6916 0.6916 0.7456 0.7456 0.7557 0.7557 0.8278 0.8278 0.8618 0.8618 0.9218 0.9218 3.5554 3.5554 3.8542 3.8542 5.9114 5.9114 6.3753 6.3753 7.0974 7.0974 7.5569 7.5569 7.6374 7.6374 7.7331 7.7331 8.0886 8.0886 8.6134 8.6134 8.8691 8.8691 9.1429 9.1429 9.3110 9.3110 9.3962 9.3962 9.7086 9.7086 9.8643 9.8643 9.9090 9.9090 9.9798 9.9798 10.1297 10.1297 10.2284 10.2284 10.5049 10.5049 11.0890 11.0890 11.2326 11.2326 12.9097 12.9097 13.0504 13.0504 13.9169 13.9169 14.7978 14.7978 15.5900 15.5900 16.1854 16.1854 k = 0.6809-0.1076-0.0752 ( 4104 PWs) bands (ev): -2.3464 -2.3464 -2.2929 -2.2929 -1.3942 -1.3942 -1.3628 -1.3628 -1.2960 -1.2960 -1.1975 -1.1975 0.6919 0.6919 0.7476 0.7476 0.7548 0.7548 0.8287 0.8287 0.8611 0.8611 0.9243 0.9243 3.5096 3.5096 3.8648 3.8648 5.8712 5.8712 6.4330 6.4330 7.0647 7.0647 7.5938 7.5938 7.6306 7.6306 7.7584 7.7584 8.0614 8.0614 8.6180 8.6180 8.8732 8.8732 9.1503 9.1503 9.3093 9.3093 9.3902 9.3902 9.7080 9.7080 9.8601 9.8601 9.9091 9.9091 9.9846 9.9846 10.1319 10.1319 10.2178 10.2178 10.4933 10.4933 11.0782 11.0782 11.2510 11.2510 12.9656 12.9656 13.0753 13.0753 13.8582 13.8582 14.8220 14.8220 15.7046 15.7046 16.1956 16.1956 k = 0.6915-0.0959-0.0671 ( 4106 PWs) bands (ev): -2.3448 -2.3448 -2.2912 -2.2912 -1.3935 -1.3935 -1.3626 -1.3626 -1.2983 -1.2983 -1.1926 -1.1926 0.6921 0.6921 0.7491 0.7491 0.7545 0.7545 0.8294 0.8294 0.8605 0.8605 0.9270 0.9270 3.4653 3.4653 3.8779 3.8779 5.8329 5.8329 6.4893 6.4893 7.0282 7.0282 7.6137 7.6137 7.6392 7.6392 7.7826 7.7826 8.0372 8.0372 8.6233 8.6233 8.8772 8.8772 9.1560 9.1560 9.3079 9.3079 9.3836 9.3836 9.7075 9.7075 9.8571 9.8571 9.9094 9.9094 9.9899 9.9899 10.1340 10.1340 10.2065 10.2065 10.4848 10.4848 11.0662 11.0662 11.2731 11.2731 13.0160 13.0160 13.1045 13.1045 13.8003 13.8003 14.8472 14.8472 15.8065 15.8065 16.2029 16.2029 k = 0.7022-0.0842-0.0589 ( 4110 PWs) bands (ev): -2.3438 -2.3438 -2.2893 -2.2893 -1.3928 -1.3928 -1.3623 -1.3623 -1.3007 -1.3007 -1.1877 -1.1877 0.6921 0.6921 0.7494 0.7494 0.7553 0.7553 0.8297 0.8297 0.8600 0.8600 0.9298 0.9298 3.4230 3.4230 3.8935 3.8935 5.7965 5.7965 6.5409 6.5409 6.9920 6.9920 7.6074 7.6074 7.6721 7.6721 7.8045 7.8045 8.0165 8.0165 8.6292 8.6292 8.8812 8.8812 9.1600 9.1600 9.3066 9.3066 9.3763 9.3763 9.7069 9.7069 9.8555 9.8555 9.9098 9.9098 9.9953 9.9953 10.1359 10.1359 10.1957 10.1957 10.4785 10.4785 11.0532 11.0532 11.2983 11.2983 13.0570 13.0570 13.1398 13.1398 13.7456 13.7456 14.8728 14.8728 15.8906 15.8906 16.2076 16.2076 k = 0.7128-0.0726-0.0507 ( 4112 PWs) bands (ev): -2.3434 -2.3434 -2.2870 -2.2870 -1.3923 -1.3923 -1.3620 -1.3620 -1.3033 -1.3033 -1.1828 -1.1828 0.6921 0.6921 0.7487 0.7487 0.7570 0.7570 0.8297 0.8297 0.8596 0.8596 0.9328 0.9328 3.3832 3.3832 3.9115 3.9115 5.7622 5.7622 6.5819 6.5819 6.9626 6.9626 7.5978 7.5978 7.7066 7.7066 7.8231 7.8231 8.0001 8.0001 8.6353 8.6353 8.8849 8.8849 9.1625 9.1625 9.3053 9.3053 9.3687 9.3687 9.7062 9.7062 9.8554 9.8554 9.9103 9.9103 10.0009 10.0009 10.1368 10.1368 10.1865 10.1865 10.4739 10.4739 11.0392 11.0392 11.3261 11.3261 13.0860 13.0860 13.1804 13.1804 13.6976 13.6976 14.8982 14.8982 15.9522 15.9522 16.2097 16.2097 k = 0.7235-0.0609-0.0426 ( 4114 PWs) bands (ev): -2.3438 -2.3438 -2.2843 -2.2843 -1.3918 -1.3918 -1.3617 -1.3617 -1.3061 -1.3061 -1.1778 -1.1778 0.6918 0.6918 0.7477 0.7477 0.7589 0.7589 0.8294 0.8294 0.8593 0.8593 0.9359 0.9359 3.3463 3.3463 3.9318 3.9318 5.7300 5.7300 6.6035 6.6035 6.9489 6.9489 7.5873 7.5873 7.7403 7.7403 7.8374 7.8374 7.9886 7.9886 8.6418 8.6418 8.8886 8.8886 9.1635 9.1635 9.3037 9.3037 9.3609 9.3609 9.7054 9.7054 9.8566 9.8566 9.9110 9.9110 10.0067 10.0067 10.1359 10.1359 10.1803 10.1803 10.4707 10.4707 11.0244 11.0244 11.3560 11.3560 13.1030 13.1030 13.2218 13.2218 13.6610 13.6610 14.9230 14.9230 15.9890 15.9890 16.2078 16.2078 k = 0.7341-0.0492-0.0344 ( 4116 PWs) bands (ev): -2.3451 -2.3451 -2.2813 -2.2813 -1.3914 -1.3914 -1.3614 -1.3614 -1.3090 -1.3090 -1.1728 -1.1728 0.6914 0.6914 0.7466 0.7466 0.7609 0.7609 0.8289 0.8289 0.8590 0.8590 0.9392 0.9392 3.3125 3.3125 3.9546 3.9546 5.7000 5.7000 6.5985 6.5985 6.9582 6.9582 7.5765 7.5765 7.7730 7.7730 7.8470 7.8470 7.9826 7.9826 8.6483 8.6483 8.8920 8.8920 9.1633 9.1633 9.3018 9.3018 9.3531 9.3531 9.7044 9.7044 9.8589 9.8589 9.9118 9.9118 10.0125 10.0125 10.1325 10.1325 10.1780 10.1780 10.4688 10.4688 11.0088 11.0088 11.3874 11.3874 13.1069 13.1069 13.2591 13.2591 13.6411 13.6411 14.9471 14.9471 16.0029 16.0029 16.1991 16.1991 k = 0.7448-0.0375-0.0262 ( 4119 PWs) bands (ev): -2.3473 -2.3473 -2.2777 -2.2777 -1.3911 -1.3911 -1.3611 -1.3611 -1.3120 -1.3120 -1.1679 -1.1679 0.6909 0.6909 0.7454 0.7454 0.7628 0.7628 0.8282 0.8282 0.8586 0.8586 0.9426 0.9426 3.2821 3.2821 3.9798 3.9798 5.6724 5.6724 6.5688 6.5688 6.9882 6.9882 7.5660 7.5660 7.8046 7.8046 7.8517 7.8517 7.9821 7.9821 8.6548 8.6548 8.8952 8.8952 9.1620 9.1620 9.2993 9.2993 9.3455 9.3455 9.7032 9.7032 9.8618 9.8618 9.9126 9.9126 10.0182 10.0182 10.1271 10.1271 10.1793 10.1793 10.4680 10.4680 10.9924 10.9924 11.4196 11.4196 13.0956 13.0956 13.2905 13.2905 13.6415 13.6415 14.9705 14.9705 15.9991 15.9991 16.1808 16.1808 k = 0.7554-0.0259-0.0181 ( 4127 PWs) bands (ev): -2.3505 -2.3505 -2.2737 -2.2737 -1.3909 -1.3909 -1.3608 -1.3608 -1.3151 -1.3151 -1.1630 -1.1630 0.6902 0.6902 0.7442 0.7442 0.7646 0.7646 0.8273 0.8273 0.8582 0.8582 0.9461 0.9461 3.2551 3.2551 4.0075 4.0075 5.6471 5.6471 6.5225 6.5225 7.0299 7.0299 7.5567 7.5567 7.8346 7.8346 7.8528 7.8528 7.9867 7.9867 8.6613 8.6613 8.8983 8.8983 9.1596 9.1596 9.2957 9.2957 9.3386 9.3386 9.7018 9.7018 9.8647 9.8647 9.9134 9.9134 10.0237 10.0237 10.1214 10.1214 10.1831 10.1831 10.4683 10.4683 10.9754 10.9754 11.4521 11.4521 13.0685 13.0685 13.3166 13.3166 13.6611 13.6611 14.9935 14.9935 15.9825 15.9825 16.1530 16.1530 Writing output data file Tl2Ni3S2.save init_run : 0.35s CPU 0.48s WALL ( 1 calls) electrons : 243.68s CPU 246.82s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 243.68s CPU 246.81s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.12s CPU 0.13s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.10s WALL ( 261 calls) cegterg : 221.92s CPU 224.43s WALL ( 268 calls) Called by sum_band: Called by *egterg: h_psi : 121.73s CPU 123.51s WALL ( 5057 calls) s_psi : 11.12s CPU 11.06s WALL ( 5057 calls) g_psi : 0.26s CPU 0.28s WALL ( 4528 calls) cdiaghg : 83.11s CPU 84.10s WALL ( 4789 calls) cegterg:over : 9.68s CPU 9.55s WALL ( 4528 calls) cegterg:upda : 7.51s CPU 7.59s WALL ( 4528 calls) cegterg:last : 4.15s CPU 4.16s WALL ( 790 calls) cdiaghg:chol : 4.94s CPU 4.96s WALL ( 4789 calls) cdiaghg:inve : 3.52s CPU 3.73s WALL ( 4789 calls) cdiaghg:para : 6.50s CPU 6.58s WALL ( 9578 calls) Called by h_psi: h_psi:vloc : 98.81s CPU 100.40s WALL ( 5057 calls) h_psi:vnl : 22.68s CPU 22.83s WALL ( 5057 calls) add_vuspsi : 12.81s CPU 12.98s WALL ( 5057 calls) General routines calbec : 9.84s CPU 9.83s WALL ( 5057 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 93.20s CPU 94.77s WALL ( 904552 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.15s CPU 0.25s WALL ( 522 calls) Parallel routines fft_scatter : 28.59s CPU 29.26s WALL ( 904575 calls) PWSCF : 4m23.54s CPU 4m40.95s WALL This run was terminated on: 20:39: 9 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=