Program PWSCF v.5.1.1 starts on 1Nov2015 at 7:11:58 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./NbTl3Se4.save/ file Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized file Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 68 49 13 2494 1507 224 Max 69 50 14 2500 1539 229 Sum 3301 2383 661 119879 73093 10889 bravais-lattice index = 14 lattice parameter (alat) = 12.8355 a.u. unit-cell volume = 1627.8454 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 76.00 number of Kohn-Sham states= 92 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 267.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.835467 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.333333 celldm(5)= -0.333333 celldm(6)= -0.333333 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.333333 0.942809 0.000000 ) a(3) = ( -0.333333 -0.471405 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.353553 0.612372 ) b(2) = ( 0.000000 1.060660 0.612372 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Tl read from file: /home/autes/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. # 2 for Se read from file: /home/autes/Pseudo/Se_MT_PBE.UPF MD5 check sum: 8b5aa0a73ac3f20b8f2ba32420215307 Pseudo is Norm-conserving, Zval = 6.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1211 points, 3 beta functions with: l(1) = 0 l(2) = 1 l(3) = 1 PseudoPot. # 3 for Nb read from file: /home/autes/Pseudo/Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: c1e153ab096482f446ae869583c6ae55 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 1227 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 Tl 13.00 204.38330 Tl( 1.00) Se 6.00 78.96000 Se( 1.00) Nb 13.00 92.90640 Nb( 1.00) 2 Sym. Ops. (no 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 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -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_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 s 2 -E -1 -s -2 Cartesian axes number of k points= 196 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051020 k( 2) = ( 0.0121951 -0.0086233 0.0149359), wk = 0.0051020 k( 3) = ( 0.0243902 -0.0172465 0.0298718), wk = 0.0051020 k( 4) = ( 0.0365854 -0.0258698 0.0448077), wk = 0.0051020 k( 5) = ( 0.0487805 -0.0344930 0.0597437), wk = 0.0051020 k( 6) = ( 0.0609756 -0.0431163 0.0746796), wk = 0.0051020 k( 7) = ( 0.0731707 -0.0517395 0.0896155), wk = 0.0051020 k( 8) = ( 0.0853658 -0.0603628 0.1045514), wk = 0.0051020 k( 9) = ( 0.0975610 -0.0689860 0.1194873), wk = 0.0051020 k( 10) = ( 0.1097561 -0.0776093 0.1344232), wk = 0.0051020 k( 11) = ( 0.1219512 -0.0862325 0.1493591), wk = 0.0051020 k( 12) = ( 0.1341463 -0.0948558 0.1642950), wk = 0.0051020 k( 13) = ( 0.1463415 -0.1034790 0.1792310), wk = 0.0051020 k( 14) = ( 0.1585366 -0.1121023 0.1941669), wk = 0.0051020 k( 15) = ( 0.1707317 -0.1207255 0.2091028), wk = 0.0051020 k( 16) = ( 0.1829268 -0.1293488 0.2240387), wk = 0.0051020 k( 17) = ( 0.1951219 -0.1379721 0.2389746), wk = 0.0051020 k( 18) = ( 0.2073171 -0.1465953 0.2539105), wk = 0.0051020 k( 19) = ( 0.2195122 -0.1552186 0.2688464), wk = 0.0051020 k( 20) = ( 0.2317073 -0.1638418 0.2837824), wk = 0.0051020 k( 21) = ( 0.2439024 -0.1724651 0.2987183), wk = 0.0051020 k( 22) = ( 0.2560976 -0.1810883 0.3136542), wk = 0.0051020 k( 23) = ( 0.2682927 -0.1897116 0.3285901), wk = 0.0051020 k( 24) = ( 0.2804878 -0.1983348 0.3435260), wk = 0.0051020 k( 25) = ( 0.2926829 -0.2069581 0.3584619), wk = 0.0051020 k( 26) = ( 0.3048781 -0.2155813 0.3733978), wk = 0.0051020 k( 27) = ( 0.3170732 -0.2242046 0.3883337), wk = 0.0051020 k( 28) = ( 0.3292683 -0.2328278 0.4032696), wk = 0.0051020 k( 29) = ( 0.3414634 -0.2414511 0.4182056), wk = 0.0051020 k( 30) = ( 0.3536585 -0.2500744 0.4331415), wk = 0.0051020 k( 31) = ( 0.3658537 -0.2586976 0.4480774), wk = 0.0051020 k( 32) = ( 0.3780488 -0.2673209 0.4630133), wk = 0.0051020 k( 33) = ( 0.3902439 -0.2759441 0.4779492), wk = 0.0051020 k( 34) = ( 0.4024390 -0.2845674 0.4928851), wk = 0.0051020 k( 35) = ( 0.4146341 -0.2931906 0.5078210), wk = 0.0051020 k( 36) = ( 0.4268293 -0.3018139 0.5227570), wk = 0.0051020 k( 37) = ( 0.4390244 -0.3104371 0.5376929), wk = 0.0051020 k( 38) = ( 0.4512195 -0.3190604 0.5526288), wk = 0.0051020 k( 39) = ( 0.4634146 -0.3276836 0.5675647), wk = 0.0051020 k( 40) = ( 0.4756098 -0.3363069 0.5825006), wk = 0.0051020 k( 41) = ( 0.4878049 -0.3449301 0.5974365), wk = 0.0051020 k( 42) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0051020 k( 43) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0051020 k( 44) = ( 0.4827586 -0.3413619 0.6123724), wk = 0.0051020 k( 45) = ( 0.4655172 -0.3291704 0.6123724), wk = 0.0051020 k( 46) = ( 0.4482759 -0.3169789 0.6123724), wk = 0.0051020 k( 47) = ( 0.4310345 -0.3047874 0.6123724), wk = 0.0051020 k( 48) = ( 0.4137931 -0.2925959 0.6123724), wk = 0.0051020 k( 49) = ( 0.3965517 -0.2804044 0.6123724), wk = 0.0051020 k( 50) = ( 0.3793103 -0.2682129 0.6123724), wk = 0.0051020 k( 51) = ( 0.3620690 -0.2560214 0.6123724), wk = 0.0051020 k( 52) = ( 0.3448276 -0.2438299 0.6123724), wk = 0.0051020 k( 53) = ( 0.3275862 -0.2316384 0.6123724), wk = 0.0051020 k( 54) = ( 0.3103448 -0.2194469 0.6123724), wk = 0.0051020 k( 55) = ( 0.2931034 -0.2072554 0.6123724), wk = 0.0051020 k( 56) = ( 0.2758621 -0.1950639 0.6123724), wk = 0.0051020 k( 57) = ( 0.2586207 -0.1828724 0.6123724), wk = 0.0051020 k( 58) = ( 0.2413793 -0.1706809 0.6123724), wk = 0.0051020 k( 59) = ( 0.2241379 -0.1584895 0.6123724), wk = 0.0051020 k( 60) = ( 0.2068966 -0.1462980 0.6123724), wk = 0.0051020 k( 61) = ( 0.1896552 -0.1341065 0.6123724), wk = 0.0051020 k( 62) = ( 0.1724138 -0.1219150 0.6123724), wk = 0.0051020 k( 63) = ( 0.1551724 -0.1097235 0.6123724), wk = 0.0051020 k( 64) = ( 0.1379310 -0.0975320 0.6123724), wk = 0.0051020 k( 65) = ( 0.1206897 -0.0853405 0.6123724), wk = 0.0051020 k( 66) = ( 0.1034483 -0.0731490 0.6123724), wk = 0.0051020 k( 67) = ( 0.0862069 -0.0609575 0.6123724), wk = 0.0051020 k( 68) = ( 0.0689655 -0.0487660 0.6123724), wk = 0.0051020 k( 69) = ( 0.0517241 -0.0365745 0.6123724), wk = 0.0051020 k( 70) = ( 0.0344828 -0.0243830 0.6123724), wk = 0.0051020 k( 71) = ( 0.0172414 -0.0121915 0.6123724), wk = 0.0051020 k( 72) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0051020 k( 73) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0051020 k( 74) = ( 0.0000000 0.0000000 0.5912561), wk = 0.0051020 k( 75) = ( 0.0000000 0.0000000 0.5701399), wk = 0.0051020 k( 76) = ( 0.0000000 0.0000000 0.5490236), wk = 0.0051020 k( 77) = ( 0.0000000 0.0000000 0.5279073), wk = 0.0051020 k( 78) = ( 0.0000000 0.0000000 0.5067910), wk = 0.0051020 k( 79) = ( 0.0000000 0.0000000 0.4856747), wk = 0.0051020 k( 80) = ( 0.0000000 0.0000000 0.4645584), wk = 0.0051020 k( 81) = ( 0.0000000 0.0000000 0.4434421), wk = 0.0051020 k( 82) = ( 0.0000000 0.0000000 0.4223258), wk = 0.0051020 k( 83) = ( 0.0000000 0.0000000 0.4012095), wk = 0.0051020 k( 84) = ( 0.0000000 0.0000000 0.3800932), wk = 0.0051020 k( 85) = ( 0.0000000 0.0000000 0.3589769), wk = 0.0051020 k( 86) = ( 0.0000000 0.0000000 0.3378607), wk = 0.0051020 k( 87) = ( 0.0000000 0.0000000 0.3167444), wk = 0.0051020 k( 88) = ( 0.0000000 0.0000000 0.2956281), wk = 0.0051020 k( 89) = ( 0.0000000 0.0000000 0.2745118), wk = 0.0051020 k( 90) = ( 0.0000000 0.0000000 0.2533955), wk = 0.0051020 k( 91) = ( 0.0000000 0.0000000 0.2322792), wk = 0.0051020 k( 92) = ( 0.0000000 0.0000000 0.2111629), wk = 0.0051020 k( 93) = ( 0.0000000 0.0000000 0.1900466), wk = 0.0051020 k( 94) = ( 0.0000000 0.0000000 0.1689303), wk = 0.0051020 k( 95) = ( 0.0000000 0.0000000 0.1478140), wk = 0.0051020 k( 96) = ( 0.0000000 0.0000000 0.1266978), wk = 0.0051020 k( 97) = ( 0.0000000 0.0000000 0.1055815), wk = 0.0051020 k( 98) = ( 0.0000000 0.0000000 0.0844652), wk = 0.0051020 k( 99) = ( 0.0000000 0.0000000 0.0633489), wk = 0.0051020 k( 100) = ( 0.0000000 0.0000000 0.0422326), wk = 0.0051020 k( 101) = ( 0.0000000 0.0000000 0.0211163), wk = 0.0051020 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051020 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051020 k( 104) = ( 0.0071429 0.0101015 0.0174964), wk = 0.0051020 k( 105) = ( 0.0142857 0.0202030 0.0349927), wk = 0.0051020 k( 106) = ( 0.0214286 0.0303046 0.0524891), wk = 0.0051020 k( 107) = ( 0.0285714 0.0404061 0.0699854), wk = 0.0051020 k( 108) = ( 0.0357143 0.0505076 0.0874818), wk = 0.0051020 k( 109) = ( 0.0428571 0.0606091 0.1049781), wk = 0.0051020 k( 110) = ( 0.0500000 0.0707107 0.1224745), wk = 0.0051020 k( 111) = ( 0.0571429 0.0808122 0.1399708), wk = 0.0051020 k( 112) = ( 0.0642857 0.0909137 0.1574672), wk = 0.0051020 k( 113) = ( 0.0714286 0.1010153 0.1749635), wk = 0.0051020 k( 114) = ( 0.0785714 0.1111168 0.1924599), wk = 0.0051020 k( 115) = ( 0.0857143 0.1212183 0.2099563), wk = 0.0051020 k( 116) = ( 0.0928571 0.1313198 0.2274526), wk = 0.0051020 k( 117) = ( 0.1000000 0.1414214 0.2449490), wk = 0.0051020 k( 118) = ( 0.1071429 0.1515229 0.2624453), wk = 0.0051020 k( 119) = ( 0.1142857 0.1616244 0.2799417), wk = 0.0051020 k( 120) = ( 0.1214286 0.1717259 0.2974380), wk = 0.0051020 k( 121) = ( 0.1285714 0.1818275 0.3149344), wk = 0.0051020 k( 122) = ( 0.1357143 0.1919290 0.3324308), wk = 0.0051020 k( 123) = ( 0.1428571 0.2020305 0.3499271), wk = 0.0051020 k( 124) = ( 0.1500000 0.2121320 0.3674235), wk = 0.0051020 k( 125) = ( 0.1571429 0.2222336 0.3849198), wk = 0.0051020 k( 126) = ( 0.1642857 0.2323351 0.4024162), wk = 0.0051020 k( 127) = ( 0.1714286 0.2424366 0.4199125), wk = 0.0051020 k( 128) = ( 0.1785714 0.2525381 0.4374089), wk = 0.0051020 k( 129) = ( 0.1857143 0.2626397 0.4549052), wk = 0.0051020 k( 130) = ( 0.1928571 0.2727412 0.4724016), wk = 0.0051020 k( 131) = ( 0.2000000 0.2828427 0.4898979), wk = 0.0051020 k( 132) = ( 0.2071429 0.2929442 0.5073943), wk = 0.0051020 k( 133) = ( 0.2142857 0.3030458 0.5248906), wk = 0.0051020 k( 134) = ( 0.2214286 0.3131473 0.5423870), wk = 0.0051020 k( 135) = ( 0.2285714 0.3232488 0.5598834), wk = 0.0051020 k( 136) = ( 0.2357143 0.3333503 0.5773797), wk = 0.0051020 k( 137) = ( 0.2428571 0.3434519 0.5948761), wk = 0.0051020 k( 138) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0051020 k( 139) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0051020 k( 140) = ( 0.2571429 0.3333503 0.6123724), wk = 0.0051020 k( 141) = ( 0.2642857 0.3131473 0.6123724), wk = 0.0051020 k( 142) = ( 0.2714286 0.2929442 0.6123724), wk = 0.0051020 k( 143) = ( 0.2785714 0.2727412 0.6123724), wk = 0.0051020 k( 144) = ( 0.2857143 0.2525381 0.6123724), wk = 0.0051020 k( 145) = ( 0.2928571 0.2323351 0.6123724), wk = 0.0051020 k( 146) = ( 0.3000000 0.2121320 0.6123724), wk = 0.0051020 k( 147) = ( 0.3071429 0.1919290 0.6123724), wk = 0.0051020 k( 148) = ( 0.3142857 0.1717259 0.6123724), wk = 0.0051020 k( 149) = ( 0.3214286 0.1515229 0.6123724), wk = 0.0051020 k( 150) = ( 0.3285714 0.1313198 0.6123724), wk = 0.0051020 k( 151) = ( 0.3357143 0.1111168 0.6123724), wk = 0.0051020 k( 152) = ( 0.3428571 0.0909137 0.6123724), wk = 0.0051020 k( 153) = ( 0.3500000 0.0707107 0.6123724), wk = 0.0051020 k( 154) = ( 0.3571429 0.0505076 0.6123724), wk = 0.0051020 k( 155) = ( 0.3642857 0.0303046 0.6123724), wk = 0.0051020 k( 156) = ( 0.3714286 0.0101015 0.6123724), wk = 0.0051020 k( 157) = ( 0.3785714 -0.0101015 0.6123724), wk = 0.0051020 k( 158) = ( 0.3857143 -0.0303046 0.6123724), wk = 0.0051020 k( 159) = ( 0.3928571 -0.0505076 0.6123724), wk = 0.0051020 k( 160) = ( 0.4000000 -0.0707107 0.6123724), wk = 0.0051020 k( 161) = ( 0.4071429 -0.0909137 0.6123724), wk = 0.0051020 k( 162) = ( 0.4142857 -0.1111168 0.6123724), wk = 0.0051020 k( 163) = ( 0.4214286 -0.1313198 0.6123724), wk = 0.0051020 k( 164) = ( 0.4285714 -0.1515229 0.6123724), wk = 0.0051020 k( 165) = ( 0.4357143 -0.1717259 0.6123724), wk = 0.0051020 k( 166) = ( 0.4428571 -0.1919290 0.6123724), wk = 0.0051020 k( 167) = ( 0.4500000 -0.2121320 0.6123724), wk = 0.0051020 k( 168) = ( 0.4571429 -0.2323351 0.6123724), wk = 0.0051020 k( 169) = ( 0.4642857 -0.2525381 0.6123724), wk = 0.0051020 k( 170) = ( 0.4714286 -0.2727412 0.6123724), wk = 0.0051020 k( 171) = ( 0.4785714 -0.2929442 0.6123724), wk = 0.0051020 k( 172) = ( 0.4857143 -0.3131473 0.6123724), wk = 0.0051020 k( 173) = ( 0.4928571 -0.3333503 0.6123724), wk = 0.0051020 k( 174) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0051020 k( 175) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0051020 k( 176) = ( 0.2380952 0.3367175 0.6123724), wk = 0.0051020 k( 177) = ( 0.2261905 0.3198816 0.6123724), wk = 0.0051020 k( 178) = ( 0.2142857 0.3030458 0.6123724), wk = 0.0051020 k( 179) = ( 0.2023810 0.2862099 0.6123724), wk = 0.0051020 k( 180) = ( 0.1904762 0.2693740 0.6123724), wk = 0.0051020 k( 181) = ( 0.1785714 0.2525381 0.6123724), wk = 0.0051020 k( 182) = ( 0.1666667 0.2357023 0.6123724), wk = 0.0051020 k( 183) = ( 0.1547619 0.2188664 0.6123724), wk = 0.0051020 k( 184) = ( 0.1428571 0.2020305 0.6123724), wk = 0.0051020 k( 185) = ( 0.1309524 0.1851946 0.6123724), wk = 0.0051020 k( 186) = ( 0.1190476 0.1683588 0.6123724), wk = 0.0051020 k( 187) = ( 0.1071429 0.1515229 0.6123724), wk = 0.0051020 k( 188) = ( 0.0952381 0.1346870 0.6123724), wk = 0.0051020 k( 189) = ( 0.0833333 0.1178511 0.6123724), wk = 0.0051020 k( 190) = ( 0.0714286 0.1010153 0.6123724), wk = 0.0051020 k( 191) = ( 0.0595238 0.0841794 0.6123724), wk = 0.0051020 k( 192) = ( 0.0476191 0.0673435 0.6123724), wk = 0.0051020 k( 193) = ( 0.0357143 0.0505076 0.6123724), wk = 0.0051020 k( 194) = ( 0.0238095 0.0336717 0.6123724), wk = 0.0051020 k( 195) = ( 0.0119048 0.0168359 0.6123724), wk = 0.0051020 k( 196) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0051020 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051020 k( 2) = ( 0.0121951 -0.0121951 0.0121951), wk = 0.0051020 k( 3) = ( 0.0243902 -0.0243902 0.0243902), wk = 0.0051020 k( 4) = ( 0.0365854 -0.0365854 0.0365854), wk = 0.0051020 k( 5) = ( 0.0487805 -0.0487805 0.0487805), wk = 0.0051020 k( 6) = ( 0.0609756 -0.0609756 0.0609756), wk = 0.0051020 k( 7) = ( 0.0731707 -0.0731707 0.0731707), wk = 0.0051020 k( 8) = ( 0.0853658 -0.0853658 0.0853658), wk = 0.0051020 k( 9) = ( 0.0975610 -0.0975610 0.0975610), wk = 0.0051020 k( 10) = ( 0.1097561 -0.1097561 0.1097561), wk = 0.0051020 k( 11) = ( 0.1219512 -0.1219512 0.1219512), wk = 0.0051020 k( 12) = ( 0.1341463 -0.1341463 0.1341463), wk = 0.0051020 k( 13) = ( 0.1463415 -0.1463415 0.1463415), wk = 0.0051020 k( 14) = ( 0.1585366 -0.1585366 0.1585366), wk = 0.0051020 k( 15) = ( 0.1707317 -0.1707317 0.1707317), wk = 0.0051020 k( 16) = ( 0.1829268 -0.1829268 0.1829268), wk = 0.0051020 k( 17) = ( 0.1951219 -0.1951219 0.1951219), wk = 0.0051020 k( 18) = ( 0.2073171 -0.2073171 0.2073171), wk = 0.0051020 k( 19) = ( 0.2195122 -0.2195122 0.2195122), wk = 0.0051020 k( 20) = ( 0.2317073 -0.2317073 0.2317073), wk = 0.0051020 k( 21) = ( 0.2439024 -0.2439024 0.2439024), wk = 0.0051020 k( 22) = ( 0.2560976 -0.2560976 0.2560976), wk = 0.0051020 k( 23) = ( 0.2682927 -0.2682927 0.2682927), wk = 0.0051020 k( 24) = ( 0.2804878 -0.2804878 0.2804878), wk = 0.0051020 k( 25) = ( 0.2926829 -0.2926829 0.2926829), wk = 0.0051020 k( 26) = ( 0.3048781 -0.3048781 0.3048781), wk = 0.0051020 k( 27) = ( 0.3170732 -0.3170732 0.3170732), wk = 0.0051020 k( 28) = ( 0.3292683 -0.3292683 0.3292683), wk = 0.0051020 k( 29) = ( 0.3414634 -0.3414634 0.3414634), wk = 0.0051020 k( 30) = ( 0.3536585 -0.3536585 0.3536585), wk = 0.0051020 k( 31) = ( 0.3658537 -0.3658537 0.3658537), wk = 0.0051020 k( 32) = ( 0.3780488 -0.3780488 0.3780488), wk = 0.0051020 k( 33) = ( 0.3902439 -0.3902439 0.3902439), wk = 0.0051020 k( 34) = ( 0.4024390 -0.4024390 0.4024390), wk = 0.0051020 k( 35) = ( 0.4146341 -0.4146341 0.4146342), wk = 0.0051020 k( 36) = ( 0.4268293 -0.4268293 0.4268293), wk = 0.0051020 k( 37) = ( 0.4390244 -0.4390244 0.4390244), wk = 0.0051020 k( 38) = ( 0.4512195 -0.4512195 0.4512195), wk = 0.0051020 k( 39) = ( 0.4634146 -0.4634146 0.4634146), wk = 0.0051020 k( 40) = ( 0.4756098 -0.4756098 0.4756098), wk = 0.0051020 k( 41) = ( 0.4878049 -0.4878049 0.4878049), wk = 0.0051020 k( 42) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0051020 k( 43) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0051020 k( 44) = ( 0.4827586 -0.4827586 0.5000000), wk = 0.0051020 k( 45) = ( 0.4655172 -0.4655172 0.5000000), wk = 0.0051020 k( 46) = ( 0.4482759 -0.4482759 0.5000000), wk = 0.0051020 k( 47) = ( 0.4310345 -0.4310345 0.5000000), wk = 0.0051020 k( 48) = ( 0.4137931 -0.4137931 0.5000000), wk = 0.0051020 k( 49) = ( 0.3965517 -0.3965517 0.5000000), wk = 0.0051020 k( 50) = ( 0.3793103 -0.3793103 0.5000000), wk = 0.0051020 k( 51) = ( 0.3620690 -0.3620690 0.5000000), wk = 0.0051020 k( 52) = ( 0.3448276 -0.3448276 0.5000000), wk = 0.0051020 k( 53) = ( 0.3275862 -0.3275862 0.5000000), wk = 0.0051020 k( 54) = ( 0.3103448 -0.3103448 0.5000000), wk = 0.0051020 k( 55) = ( 0.2931034 -0.2931034 0.5000000), wk = 0.0051020 k( 56) = ( 0.2758621 -0.2758621 0.5000000), wk = 0.0051020 k( 57) = ( 0.2586207 -0.2586207 0.5000000), wk = 0.0051020 k( 58) = ( 0.2413793 -0.2413793 0.5000000), wk = 0.0051020 k( 59) = ( 0.2241379 -0.2241379 0.5000000), wk = 0.0051020 k( 60) = ( 0.2068966 -0.2068965 0.5000000), wk = 0.0051020 k( 61) = ( 0.1896552 -0.1896552 0.5000000), wk = 0.0051020 k( 62) = ( 0.1724138 -0.1724138 0.5000000), wk = 0.0051020 k( 63) = ( 0.1551724 -0.1551724 0.5000000), wk = 0.0051020 k( 64) = ( 0.1379310 -0.1379310 0.5000000), wk = 0.0051020 k( 65) = ( 0.1206897 -0.1206897 0.5000000), wk = 0.0051020 k( 66) = ( 0.1034483 -0.1034483 0.5000000), wk = 0.0051020 k( 67) = ( 0.0862069 -0.0862069 0.5000000), wk = 0.0051020 k( 68) = ( 0.0689655 -0.0689655 0.5000000), wk = 0.0051020 k( 69) = ( 0.0517241 -0.0517241 0.5000000), wk = 0.0051020 k( 70) = ( 0.0344828 -0.0344828 0.5000000), wk = 0.0051020 k( 71) = ( 0.0172414 -0.0172414 0.5000000), wk = 0.0051020 k( 72) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0051020 k( 73) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0051020 k( 74) = ( 0.0000000 0.0000000 0.4827586), wk = 0.0051020 k( 75) = ( 0.0000000 0.0000000 0.4655172), wk = 0.0051020 k( 76) = ( 0.0000000 0.0000000 0.4482759), wk = 0.0051020 k( 77) = ( 0.0000000 0.0000000 0.4310345), wk = 0.0051020 k( 78) = ( 0.0000000 0.0000000 0.4137931), wk = 0.0051020 k( 79) = ( 0.0000000 0.0000000 0.3965517), wk = 0.0051020 k( 80) = ( 0.0000000 0.0000000 0.3793103), wk = 0.0051020 k( 81) = ( 0.0000000 0.0000000 0.3620690), wk = 0.0051020 k( 82) = ( 0.0000000 0.0000000 0.3448276), wk = 0.0051020 k( 83) = ( 0.0000000 0.0000000 0.3275862), wk = 0.0051020 k( 84) = ( 0.0000000 0.0000000 0.3103448), wk = 0.0051020 k( 85) = ( 0.0000000 0.0000000 0.2931034), wk = 0.0051020 k( 86) = ( 0.0000000 0.0000000 0.2758621), wk = 0.0051020 k( 87) = ( 0.0000000 0.0000000 0.2586207), wk = 0.0051020 k( 88) = ( 0.0000000 0.0000000 0.2413793), wk = 0.0051020 k( 89) = ( 0.0000000 0.0000000 0.2241379), wk = 0.0051020 k( 90) = ( 0.0000000 0.0000000 0.2068966), wk = 0.0051020 k( 91) = ( 0.0000000 0.0000000 0.1896552), wk = 0.0051020 k( 92) = ( 0.0000000 0.0000000 0.1724138), wk = 0.0051020 k( 93) = ( 0.0000000 0.0000000 0.1551724), wk = 0.0051020 k( 94) = ( 0.0000000 0.0000000 0.1379310), wk = 0.0051020 k( 95) = ( 0.0000000 0.0000000 0.1206897), wk = 0.0051020 k( 96) = ( 0.0000000 0.0000000 0.1034483), wk = 0.0051020 k( 97) = ( 0.0000000 0.0000000 0.0862069), wk = 0.0051020 k( 98) = ( 0.0000000 0.0000000 0.0689655), wk = 0.0051020 k( 99) = ( 0.0000000 0.0000000 0.0517241), wk = 0.0051020 k( 100) = ( 0.0000000 0.0000000 0.0344828), wk = 0.0051020 k( 101) = ( 0.0000000 0.0000000 0.0172414), wk = 0.0051020 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051020 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051020 k( 104) = ( 0.0071429 0.0071429 0.0071429), wk = 0.0051020 k( 105) = ( 0.0142857 0.0142857 0.0142857), wk = 0.0051020 k( 106) = ( 0.0214286 0.0214286 0.0214286), wk = 0.0051020 k( 107) = ( 0.0285714 0.0285714 0.0285714), wk = 0.0051020 k( 108) = ( 0.0357143 0.0357143 0.0357143), wk = 0.0051020 k( 109) = ( 0.0428571 0.0428571 0.0428571), wk = 0.0051020 k( 110) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0051020 k( 111) = ( 0.0571429 0.0571429 0.0571429), wk = 0.0051020 k( 112) = ( 0.0642857 0.0642857 0.0642857), wk = 0.0051020 k( 113) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0051020 k( 114) = ( 0.0785714 0.0785714 0.0785714), wk = 0.0051020 k( 115) = ( 0.0857143 0.0857143 0.0857143), wk = 0.0051020 k( 116) = ( 0.0928571 0.0928571 0.0928571), wk = 0.0051020 k( 117) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0051020 k( 118) = ( 0.1071429 0.1071429 0.1071429), wk = 0.0051020 k( 119) = ( 0.1142857 0.1142857 0.1142857), wk = 0.0051020 k( 120) = ( 0.1214286 0.1214286 0.1214286), wk = 0.0051020 k( 121) = ( 0.1285714 0.1285714 0.1285714), wk = 0.0051020 k( 122) = ( 0.1357143 0.1357143 0.1357143), wk = 0.0051020 k( 123) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0051020 k( 124) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0051020 k( 125) = ( 0.1571429 0.1571429 0.1571429), wk = 0.0051020 k( 126) = ( 0.1642857 0.1642857 0.1642857), wk = 0.0051020 k( 127) = ( 0.1714286 0.1714286 0.1714286), wk = 0.0051020 k( 128) = ( 0.1785714 0.1785714 0.1785714), wk = 0.0051020 k( 129) = ( 0.1857143 0.1857143 0.1857143), wk = 0.0051020 k( 130) = ( 0.1928571 0.1928571 0.1928571), wk = 0.0051020 k( 131) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0051020 k( 132) = ( 0.2071429 0.2071429 0.2071429), wk = 0.0051020 k( 133) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0051020 k( 134) = ( 0.2214286 0.2214286 0.2214286), wk = 0.0051020 k( 135) = ( 0.2285714 0.2285714 0.2285714), wk = 0.0051020 k( 136) = ( 0.2357143 0.2357143 0.2357143), wk = 0.0051020 k( 137) = ( 0.2428571 0.2428571 0.2428571), wk = 0.0051020 k( 138) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0051020 k( 139) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0051020 k( 140) = ( 0.2571429 0.2285714 0.2571429), wk = 0.0051020 k( 141) = ( 0.2642857 0.2071429 0.2642857), wk = 0.0051020 k( 142) = ( 0.2714286 0.1857143 0.2714286), wk = 0.0051020 k( 143) = ( 0.2785714 0.1642857 0.2785714), wk = 0.0051020 k( 144) = ( 0.2857143 0.1428571 0.2857143), wk = 0.0051020 k( 145) = ( 0.2928571 0.1214286 0.2928571), wk = 0.0051020 k( 146) = ( 0.3000000 0.1000000 0.3000000), wk = 0.0051020 k( 147) = ( 0.3071429 0.0785714 0.3071429), wk = 0.0051020 k( 148) = ( 0.3142857 0.0571429 0.3142857), wk = 0.0051020 k( 149) = ( 0.3214286 0.0357143 0.3214286), wk = 0.0051020 k( 150) = ( 0.3285714 0.0142857 0.3285714), wk = 0.0051020 k( 151) = ( 0.3357143 -0.0071429 0.3357143), wk = 0.0051020 k( 152) = ( 0.3428571 -0.0285714 0.3428571), wk = 0.0051020 k( 153) = ( 0.3500000 -0.0500000 0.3500000), wk = 0.0051020 k( 154) = ( 0.3571429 -0.0714286 0.3571429), wk = 0.0051020 k( 155) = ( 0.3642857 -0.0928571 0.3642857), wk = 0.0051020 k( 156) = ( 0.3714286 -0.1142857 0.3714286), wk = 0.0051020 k( 157) = ( 0.3785714 -0.1357143 0.3785714), wk = 0.0051020 k( 158) = ( 0.3857143 -0.1571429 0.3857143), wk = 0.0051020 k( 159) = ( 0.3928571 -0.1785714 0.3928571), wk = 0.0051020 k( 160) = ( 0.4000000 -0.2000000 0.4000000), wk = 0.0051020 k( 161) = ( 0.4071429 -0.2214286 0.4071429), wk = 0.0051020 k( 162) = ( 0.4142857 -0.2428571 0.4142857), wk = 0.0051020 k( 163) = ( 0.4214286 -0.2642857 0.4214286), wk = 0.0051020 k( 164) = ( 0.4285714 -0.2857143 0.4285714), wk = 0.0051020 k( 165) = ( 0.4357143 -0.3071429 0.4357143), wk = 0.0051020 k( 166) = ( 0.4428571 -0.3285714 0.4428571), wk = 0.0051020 k( 167) = ( 0.4500000 -0.3500000 0.4500000), wk = 0.0051020 k( 168) = ( 0.4571429 -0.3714286 0.4571429), wk = 0.0051020 k( 169) = ( 0.4642857 -0.3928571 0.4642857), wk = 0.0051020 k( 170) = ( 0.4714286 -0.4142857 0.4714286), wk = 0.0051020 k( 171) = ( 0.4785714 -0.4357143 0.4785714), wk = 0.0051020 k( 172) = ( 0.4857143 -0.4571429 0.4857143), wk = 0.0051020 k( 173) = ( 0.4928571 -0.4785714 0.4928571), wk = 0.0051020 k( 174) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0051020 k( 175) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0051020 k( 176) = ( 0.2380952 0.2380952 0.2619048), wk = 0.0051020 k( 177) = ( 0.2261905 0.2261905 0.2738095), wk = 0.0051020 k( 178) = ( 0.2142857 0.2142857 0.2857143), wk = 0.0051020 k( 179) = ( 0.2023810 0.2023810 0.2976190), wk = 0.0051020 k( 180) = ( 0.1904762 0.1904762 0.3095238), wk = 0.0051020 k( 181) = ( 0.1785714 0.1785714 0.3214286), wk = 0.0051020 k( 182) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0051020 k( 183) = ( 0.1547619 0.1547619 0.3452381), wk = 0.0051020 k( 184) = ( 0.1428571 0.1428571 0.3571429), wk = 0.0051020 k( 185) = ( 0.1309524 0.1309524 0.3690476), wk = 0.0051020 k( 186) = ( 0.1190476 0.1190476 0.3809524), wk = 0.0051020 k( 187) = ( 0.1071429 0.1071429 0.3928571), wk = 0.0051020 k( 188) = ( 0.0952381 0.0952381 0.4047619), wk = 0.0051020 k( 189) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0051020 k( 190) = ( 0.0714286 0.0714286 0.4285714), wk = 0.0051020 k( 191) = ( 0.0595238 0.0595238 0.4404762), wk = 0.0051020 k( 192) = ( 0.0476191 0.0476190 0.4523810), wk = 0.0051020 k( 193) = ( 0.0357143 0.0357143 0.4642857), wk = 0.0051020 k( 194) = ( 0.0238095 0.0238095 0.4761905), wk = 0.0051020 k( 195) = ( 0.0119048 0.0119048 0.4880952), wk = 0.0051020 k( 196) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0051020 Dense grid: 119879 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 73093 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.55 Mb ( 394, 92) NL pseudopotentials 0.49 Mb ( 197, 164) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2500) G-vector shells 0.00 Mb ( 508) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.21 Mb ( 394, 368) Each subspace H/S matrix 2.07 Mb ( 368, 368) Each matrix 0.46 Mb ( 164, 2, 92) The potential is recalculated from file : ./NbTl3Se4.save/charge-density.dat Starting wfc are 112 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 46.7 secs Computing kpt #: 2 total cpu time spent up to now is 52.2 secs Computing kpt #: 3 total cpu time spent up to now is 58.3 secs Computing kpt #: 4 total cpu time spent up to now is 64.5 secs Computing kpt #: 5 total cpu time spent up to now is 70.5 secs Computing kpt #: 6 total cpu time spent up to now is 76.6 secs Computing kpt #: 7 total cpu time spent up to now is 82.2 secs Computing kpt #: 8 total cpu time spent up to now is 87.9 secs Computing kpt #: 9 total cpu time spent up to now is 93.5 secs Computing kpt #: 10 total cpu time spent up to now is 99.7 secs Computing kpt #: 11 total cpu time spent up to now is 105.8 secs Computing kpt #: 12 total cpu time spent up to now is 112.0 secs Computing kpt #: 13 total cpu time spent up to now is 118.1 secs Computing kpt #: 14 total cpu time spent up to now is 124.4 secs Computing kpt #: 15 total cpu time spent up to now is 132.8 secs Computing kpt #: 16 total cpu time spent up to now is 139.2 secs Computing kpt #: 17 total cpu time spent up to now is 145.5 secs Computing kpt #: 18 total cpu time spent up to now is 151.5 secs Computing kpt #: 19 total cpu time spent up to now is 157.6 secs Computing kpt #: 20 total cpu time spent up to now is 163.7 secs Computing kpt #: 21 total cpu time spent up to now is 169.7 secs Computing kpt #: 22 total cpu time spent up to now is 175.9 secs Computing kpt #: 23 total cpu time spent up to now is 182.2 secs Computing kpt #: 24 total cpu time spent up to now is 188.3 secs Computing kpt #: 25 total cpu time spent up to now is 193.8 secs Computing kpt #: 26 total cpu time spent up to now is 199.4 secs Computing kpt #: 27 total cpu time spent up to now is 204.9 secs Computing kpt #: 28 total cpu time spent up to now is 210.5 secs Computing kpt #: 29 total cpu time spent up to now is 216.4 secs Computing kpt #: 30 total cpu time spent up to now is 222.1 secs Computing kpt #: 31 total cpu time spent up to now is 227.8 secs Computing kpt #: 32 total cpu time spent up to now is 233.5 secs Computing kpt #: 33 total cpu time spent up to now is 239.2 secs Computing kpt #: 34 total cpu time spent up to now is 244.8 secs Computing kpt #: 35 total cpu time spent up to now is 250.6 secs Computing kpt #: 36 total cpu time spent up to now is 256.3 secs Computing kpt #: 37 total cpu time spent up to now is 262.1 secs Computing kpt #: 38 total cpu time spent up to now is 268.3 secs Computing kpt #: 39 total cpu time spent up to now is 274.5 secs Computing kpt #: 40 total cpu time spent up to now is 280.7 secs Computing kpt #: 41 total cpu time spent up to now is 286.9 secs Computing kpt #: 42 total cpu time spent up to now is 292.9 secs Computing kpt #: 43 total cpu time spent up to now is 299.0 secs Computing kpt #: 44 total cpu time spent up to now is 305.2 secs Computing kpt #: 45 total cpu time spent up to now is 311.5 secs Computing kpt #: 46 total cpu time spent up to now is 317.7 secs Computing kpt #: 47 total cpu time spent up to now is 323.4 secs Computing kpt #: 48 total cpu time spent up to now is 329.1 secs Computing kpt #: 49 total cpu time spent up to now is 334.8 secs Computing kpt #: 50 total cpu time spent up to now is 340.5 secs Computing kpt #: 51 total cpu time spent up to now is 346.4 secs Computing kpt #: 52 total cpu time spent up to now is 352.1 secs Computing kpt #: 53 total cpu time spent up to now is 357.8 secs Computing kpt #: 54 total cpu time spent up to now is 363.5 secs Computing kpt #: 55 total cpu time spent up to now is 369.2 secs Computing kpt #: 56 total cpu time spent up to now is 374.8 secs Computing kpt #: 57 total cpu time spent up to now is 380.4 secs Computing kpt #: 58 total cpu time spent up to now is 386.0 secs Computing kpt #: 59 total cpu time spent up to now is 391.8 secs Computing kpt #: 60 total cpu time spent up to now is 397.5 secs Computing kpt #: 61 total cpu time spent up to now is 403.2 secs Computing kpt #: 62 total cpu time spent up to now is 408.9 secs Computing kpt #: 63 total cpu time spent up to now is 414.8 secs Computing kpt #: 64 total cpu time spent up to now is 420.4 secs Computing kpt #: 65 total cpu time spent up to now is 426.6 secs Computing kpt #: 66 total cpu time spent up to now is 435.3 secs Computing kpt #: 67 total cpu time spent up to now is 441.6 secs Computing kpt #: 68 total cpu time spent up to now is 447.9 secs Computing kpt #: 69 total cpu time spent up to now is 454.2 secs Computing kpt #: 70 total cpu time spent up to now is 460.4 secs Computing kpt #: 71 total cpu time spent up to now is 466.7 secs Computing kpt #: 72 total cpu time spent up to now is 472.9 secs Computing kpt #: 73 total cpu time spent up to now is 479.2 secs Computing kpt #: 74 total cpu time spent up to now is 485.5 secs Computing kpt #: 75 total cpu time spent up to now is 491.8 secs Computing kpt #: 76 total cpu time spent up to now is 498.2 secs Computing kpt #: 77 total cpu time spent up to now is 504.4 secs Computing kpt #: 78 total cpu time spent up to now is 510.6 secs Computing kpt #: 79 total cpu time spent up to now is 517.0 secs Computing kpt #: 80 total cpu time spent up to now is 523.6 secs Computing kpt #: 81 total cpu time spent up to now is 530.2 secs Computing kpt #: 82 total cpu time spent up to now is 536.9 secs Computing kpt #: 83 total cpu time spent up to now is 543.3 secs Computing kpt #: 84 total cpu time spent up to now is 549.7 secs Computing kpt #: 85 total cpu time spent up to now is 556.0 secs Computing kpt #: 86 total cpu time spent up to now is 562.3 secs Computing kpt #: 87 total cpu time spent up to now is 568.7 secs Computing kpt #: 88 total cpu time spent up to now is 575.0 secs Computing kpt #: 89 total cpu time spent up to now is 581.3 secs Computing kpt #: 90 total cpu time spent up to now is 587.6 secs Computing kpt #: 91 total cpu time spent up to now is 593.8 secs Computing kpt #: 92 total cpu time spent up to now is 599.4 secs Computing kpt #: 93 total cpu time spent up to now is 605.5 secs Computing kpt #: 94 total cpu time spent up to now is 611.2 secs Computing kpt #: 95 total cpu time spent up to now is 616.9 secs Computing kpt #: 96 total cpu time spent up to now is 622.7 secs Computing kpt #: 97 total cpu time spent up to now is 628.9 secs Computing kpt #: 98 total cpu time spent up to now is 635.0 secs Computing kpt #: 99 total cpu time spent up to now is 641.1 secs Computing kpt #: 100 total cpu time spent up to now is 647.2 secs Computing kpt #: 101 total cpu time spent up to now is 653.3 secs Computing kpt #: 102 total cpu time spent up to now is 659.3 secs Computing kpt #: 103 total cpu time spent up to now is 664.8 secs Computing kpt #: 104 total cpu time spent up to now is 670.4 secs Computing kpt #: 105 total cpu time spent up to now is 676.4 secs Computing kpt #: 106 total cpu time spent up to now is 682.5 secs Computing kpt #: 107 total cpu time spent up to now is 688.6 secs Computing kpt #: 108 total cpu time spent up to now is 694.8 secs Computing kpt #: 109 total cpu time spent up to now is 701.0 secs Computing kpt #: 110 total cpu time spent up to now is 707.3 secs Computing kpt #: 111 total cpu time spent up to now is 713.5 secs Computing kpt #: 112 total cpu time spent up to now is 719.1 secs Computing kpt #: 113 total cpu time spent up to now is 725.3 secs Computing kpt #: 114 total cpu time spent up to now is 733.0 secs Computing kpt #: 115 total cpu time spent up to now is 739.4 secs Computing kpt #: 116 total cpu time spent up to now is 745.5 secs Computing kpt #: 117 total cpu time spent up to now is 751.7 secs Computing kpt #: 118 total cpu time spent up to now is 757.9 secs Computing kpt #: 119 total cpu time spent up to now is 764.2 secs Computing kpt #: 120 total cpu time spent up to now is 770.5 secs Computing kpt #: 121 total cpu time spent up to now is 776.7 secs Computing kpt #: 122 total cpu time spent up to now is 783.1 secs Computing kpt #: 123 total cpu time spent up to now is 789.5 secs Computing kpt #: 124 total cpu time spent up to now is 795.9 secs Computing kpt #: 125 total cpu time spent up to now is 802.3 secs Computing kpt #: 126 total cpu time spent up to now is 809.0 secs Computing kpt #: 127 total cpu time spent up to now is 815.3 secs Computing kpt #: 128 total cpu time spent up to now is 821.6 secs Computing kpt #: 129 total cpu time spent up to now is 827.9 secs Computing kpt #: 130 total cpu time spent up to now is 834.2 secs Computing kpt #: 131 total cpu time spent up to now is 840.5 secs Computing kpt #: 132 total cpu time spent up to now is 846.8 secs Computing kpt #: 133 total cpu time spent up to now is 853.1 secs Computing kpt #: 134 total cpu time spent up to now is 859.3 secs Computing kpt #: 135 total cpu time spent up to now is 865.5 secs Computing kpt #: 136 total cpu time spent up to now is 871.6 secs Computing kpt #: 137 total cpu time spent up to now is 877.7 secs Computing kpt #: 138 total cpu time spent up to now is 883.8 secs Computing kpt #: 139 total cpu time spent up to now is 889.9 secs Computing kpt #: 140 total cpu time spent up to now is 896.0 secs Computing kpt #: 141 total cpu time spent up to now is 902.2 secs Computing kpt #: 142 total cpu time spent up to now is 908.3 secs Computing kpt #: 143 total cpu time spent up to now is 914.7 secs Computing kpt #: 144 total cpu time spent up to now is 920.9 secs Computing kpt #: 145 total cpu time spent up to now is 927.1 secs Computing kpt #: 146 total cpu time spent up to now is 933.5 secs Computing kpt #: 147 total cpu time spent up to now is 939.7 secs Computing kpt #: 148 total cpu time spent up to now is 946.0 secs Computing kpt #: 149 total cpu time spent up to now is 952.1 secs Computing kpt #: 150 total cpu time spent up to now is 958.3 secs Computing kpt #: 151 total cpu time spent up to now is 964.6 secs Computing kpt #: 152 total cpu time spent up to now is 970.8 secs Computing kpt #: 153 total cpu time spent up to now is 977.1 secs Computing kpt #: 154 total cpu time spent up to now is 983.4 secs Computing kpt #: 155 total cpu time spent up to now is 989.1 secs Computing kpt #: 156 total cpu time spent up to now is 994.8 secs Computing kpt #: 157 total cpu time spent up to now is 1000.4 secs Computing kpt #: 158 total cpu time spent up to now is 1006.1 secs Computing kpt #: 159 total cpu time spent up to now is 1011.8 secs Computing kpt #: 160 total cpu time spent up to now is 1017.4 secs Computing kpt #: 161 total cpu time spent up to now is 1023.1 secs Computing kpt #: 162 total cpu time spent up to now is 1029.3 secs Computing kpt #: 163 total cpu time spent up to now is 1036.7 secs Computing kpt #: 164 total cpu time spent up to now is 1042.4 secs Computing kpt #: 165 total cpu time spent up to now is 1048.1 secs Computing kpt #: 166 total cpu time spent up to now is 1053.8 secs Computing kpt #: 167 total cpu time spent up to now is 1059.6 secs Computing kpt #: 168 total cpu time spent up to now is 1065.3 secs Computing kpt #: 169 total cpu time spent up to now is 1071.0 secs Computing kpt #: 170 total cpu time spent up to now is 1076.8 secs Computing kpt #: 171 total cpu time spent up to now is 1082.5 secs Computing kpt #: 172 total cpu time spent up to now is 1088.7 secs Computing kpt #: 173 total cpu time spent up to now is 1094.9 secs Computing kpt #: 174 total cpu time spent up to now is 1101.0 secs Computing kpt #: 175 total cpu time spent up to now is 1107.1 secs Computing kpt #: 176 total cpu time spent up to now is 1113.2 secs Computing kpt #: 177 total cpu time spent up to now is 1119.4 secs Computing kpt #: 178 total cpu time spent up to now is 1125.5 secs Computing kpt #: 179 total cpu time spent up to now is 1131.7 secs Computing kpt #: 180 total cpu time spent up to now is 1137.9 secs Computing kpt #: 181 total cpu time spent up to now is 1144.1 secs Computing kpt #: 182 total cpu time spent up to now is 1150.4 secs Computing kpt #: 183 total cpu time spent up to now is 1156.6 secs Computing kpt #: 184 total cpu time spent up to now is 1162.9 secs Computing kpt #: 185 total cpu time spent up to now is 1169.2 secs Computing kpt #: 186 total cpu time spent up to now is 1175.4 secs Computing kpt #: 187 total cpu time spent up to now is 1181.6 secs Computing kpt #: 188 total cpu time spent up to now is 1187.9 secs Computing kpt #: 189 total cpu time spent up to now is 1194.2 secs Computing kpt #: 190 total cpu time spent up to now is 1200.5 secs Computing kpt #: 191 total cpu time spent up to now is 1206.9 secs Computing kpt #: 192 total cpu time spent up to now is 1213.3 secs Computing kpt #: 193 total cpu time spent up to now is 1219.5 secs Computing kpt #: 194 total cpu time spent up to now is 1225.7 secs Computing kpt #: 195 total cpu time spent up to now is 1231.9 secs Computing kpt #: 196 total cpu time spent up to now is 1238.1 secs ethr = 1.32E-11, avg # of iterations = 21.2 total cpu time spent up to now is 1238.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 9189 PWs) bands (ev): -48.7678 -48.7678 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.1781 -6.1781 -5.7521 -5.7521 -5.6989 -5.6989 -5.6989 -5.6989 -5.4601 -5.4601 -5.4601 -5.4601 -5.3928 -5.3928 -5.1735 -5.1735 -5.1735 -5.1735 -5.1471 -5.1471 -3.3184 -3.3184 -3.3184 -3.3184 -3.2477 -3.2477 -3.2201 -3.2201 -3.2201 -3.2201 -3.1969 -3.1969 -3.1740 -3.1740 -3.1740 -3.1740 -3.1355 -3.1355 1.3802 1.3802 1.5332 1.5332 1.5332 1.5332 3.5231 3.5231 3.5271 3.5271 3.5271 3.5271 3.7486 3.7486 3.7486 3.7486 3.7552 3.7552 4.0974 4.0974 4.1089 4.1089 4.2989 4.2989 4.2989 4.2989 5.1905 5.1905 5.1905 5.1905 8.2431 8.2431 8.4279 8.4279 8.4279 8.4279 8.5273 8.5273 8.5273 8.5273 9.8486 9.8486 9.8486 9.8486 10.4427 10.4427 k = 0.0122-0.0086 0.0149 ( 9189 PWs) bands (ev): -48.7678 -48.7678 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.1776 -6.1776 -5.7520 -5.7520 -5.7035 -5.7035 -5.6941 -5.6941 -5.4601 -5.4601 -5.4600 -5.4600 -5.3929 -5.3929 -5.1810 -5.1810 -5.1666 -5.1666 -5.1472 -5.1472 -3.3185 -3.3185 -3.3182 -3.3182 -3.2477 -3.2477 -3.2214 -3.2214 -3.2191 -3.2191 -3.1970 -3.1970 -3.1759 -3.1759 -3.1721 -3.1721 -3.1355 -3.1355 1.3778 1.3778 1.5288 1.5288 1.5342 1.5342 3.5194 3.5194 3.5215 3.5215 3.5277 3.5277 3.7512 3.7512 3.7581 3.7581 3.7608 3.7608 4.0923 4.0923 4.1144 4.1144 4.2992 4.2992 4.3005 4.3005 5.1879 5.1879 5.1945 5.1945 8.2432 8.2432 8.4165 8.4165 8.4356 8.4356 8.5216 8.5216 8.5376 8.5376 9.8248 9.8248 9.8673 9.8673 10.4385 10.4385 k = 0.0244-0.0172 0.0299 ( 9161 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1759 -6.1759 -5.7518 -5.7518 -5.7080 -5.7080 -5.6892 -5.6892 -5.4600 -5.4600 -5.4599 -5.4599 -5.3929 -5.3929 -5.1888 -5.1888 -5.1602 -5.1602 -5.1477 -5.1477 -3.3185 -3.3185 -3.3179 -3.3179 -3.2477 -3.2477 -3.2230 -3.2230 -3.2183 -3.2183 -3.1972 -3.1972 -3.1776 -3.1776 -3.1702 -3.1702 -3.1357 -3.1357 1.3706 1.3706 1.5165 1.5165 1.5368 1.5368 3.5068 3.5068 3.5087 3.5087 3.5298 3.5298 3.7652 3.7652 3.7746 3.7746 3.7804 3.7804 4.0844 4.0844 4.1236 4.1236 4.3012 4.3012 4.3041 4.3041 5.1867 5.1867 5.1998 5.1998 8.2434 8.2434 8.4033 8.4033 8.4384 8.4384 8.5201 8.5201 8.5521 8.5521 9.7949 9.7949 9.8817 9.8817 10.4263 10.4263 k = 0.0366-0.0259 0.0448 ( 9121 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1732 -6.1732 -5.7513 -5.7513 -5.7123 -5.7123 -5.6842 -5.6842 -5.4600 -5.4600 -5.4597 -5.4597 -5.3930 -5.3930 -5.1970 -5.1970 -5.1550 -5.1550 -5.1479 -5.1479 -3.3186 -3.3186 -3.3174 -3.3174 -3.2477 -3.2477 -3.2249 -3.2249 -3.2178 -3.2178 -3.1975 -3.1975 -3.1793 -3.1793 -3.1683 -3.1683 -3.1360 -3.1359 1.3584 1.3584 1.4965 1.4965 1.5412 1.5412 3.4888 3.4888 3.4904 3.4904 3.5337 3.5337 3.7876 3.7876 3.7973 3.7973 3.8108 3.8108 4.0770 4.0770 4.1338 4.1338 4.3048 4.3048 4.3098 4.3098 5.1867 5.1867 5.2067 5.2067 8.2428 8.2428 8.3907 8.3907 8.4363 8.4363 8.5224 8.5224 8.5699 8.5699 9.7585 9.7585 9.8924 9.8924 10.4074 10.4074 k = 0.0488-0.0345 0.0597 ( 9125 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1694 -6.1694 -5.7507 -5.7507 -5.7165 -5.7165 -5.6792 -5.6792 -5.4599 -5.4599 -5.4595 -5.4595 -5.3931 -5.3931 -5.2055 -5.2055 -5.1532 -5.1532 -5.1457 -5.1457 -3.3186 -3.3186 -3.3168 -3.3168 -3.2477 -3.2477 -3.2271 -3.2271 -3.2175 -3.2175 -3.1980 -3.1980 -3.1808 -3.1808 -3.1665 -3.1665 -3.1363 -3.1363 1.3414 1.3414 1.4693 1.4693 1.5477 1.5477 3.4682 3.4682 3.4691 3.4691 3.5388 3.5388 3.8145 3.8145 3.8257 3.8257 3.8491 3.8491 4.0712 4.0712 4.1449 4.1449 4.3100 4.3100 4.3176 4.3176 5.1879 5.1879 5.2153 5.2153 8.2402 8.2402 8.3807 8.3807 8.4301 8.4301 8.5279 8.5279 8.5898 8.5898 9.7154 9.7154 9.8988 9.8988 10.3840 10.3840 k = 0.0610-0.0431 0.0747 ( 9133 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1646 -6.1646 -5.7499 -5.7499 -5.7206 -5.7206 -5.6740 -5.6740 -5.4597 -5.4597 -5.4592 -5.4592 -5.3934 -5.3934 -5.2143 -5.2143 -5.1544 -5.1544 -5.1413 -5.1413 -3.3187 -3.3187 -3.3159 -3.3159 -3.2477 -3.2477 -3.2295 -3.2295 -3.2174 -3.2174 -3.1986 -3.1986 -3.1821 -3.1821 -3.1649 -3.1648 -3.1366 -3.1366 1.3196 1.3196 1.4359 1.4359 1.5566 1.5566 3.4465 3.4465 3.4470 3.4470 3.5447 3.5447 3.8416 3.8416 3.8584 3.8584 3.8951 3.8951 4.0685 4.0685 4.1571 4.1571 4.3168 4.3168 4.3278 4.3278 5.1905 5.1905 5.2259 5.2259 8.2342 8.2342 8.3750 8.3750 8.4209 8.4209 8.5358 8.5358 8.6108 8.6108 9.6660 9.6660 9.8999 9.8999 10.3592 10.3592 k = 0.0732-0.0517 0.0896 ( 9125 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1588 -6.1588 -5.7489 -5.7489 -5.7244 -5.7244 -5.6689 -5.6689 -5.4596 -5.4596 -5.4588 -5.4588 -5.3936 -5.3936 -5.2233 -5.2233 -5.1568 -5.1568 -5.1369 -5.1369 -3.3187 -3.3187 -3.3149 -3.3149 -3.2478 -3.2478 -3.2321 -3.2321 -3.2174 -3.2174 -3.1993 -3.1993 -3.1834 -3.1834 -3.1634 -3.1634 -3.1369 -3.1369 1.2934 1.2934 1.3971 1.3971 1.5678 1.5678 3.4241 3.4241 3.4257 3.4257 3.5507 3.5507 3.8655 3.8655 3.8935 3.8935 3.9482 3.9482 4.0709 4.0709 4.1709 4.1709 4.3253 4.3253 4.3404 4.3404 5.1944 5.1944 5.2386 5.2386 8.2239 8.2239 8.3738 8.3738 8.4107 8.4107 8.5459 8.5459 8.6321 8.6321 9.6110 9.6110 9.8933 9.8933 10.3366 10.3366 k = 0.0854-0.0604 0.1046 ( 9129 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1519 -6.1519 -5.7478 -5.7478 -5.7281 -5.7281 -5.6637 -5.6637 -5.4594 -5.4594 -5.4584 -5.4584 -5.3939 -5.3939 -5.2324 -5.2324 -5.1597 -5.1597 -5.1328 -5.1328 -3.3188 -3.3188 -3.3138 -3.3138 -3.2479 -3.2479 -3.2349 -3.2349 -3.2176 -3.2176 -3.2001 -3.2001 -3.1847 -3.1847 -3.1623 -3.1623 -3.1372 -3.1372 1.2633 1.2633 1.3537 1.3537 1.5813 1.5813 3.4022 3.4022 3.4053 3.4053 3.5561 3.5561 3.8836 3.8836 3.9293 3.9293 4.0074 4.0074 4.0806 4.0806 4.1866 4.1866 4.3356 4.3356 4.3560 4.3560 5.1995 5.1995 5.2538 5.2538 8.2096 8.2096 8.3729 8.3729 8.4041 8.4041 8.5574 8.5574 8.6532 8.6532 9.5515 9.5515 9.8767 9.8767 10.3199 10.3199 k = 0.0976-0.0690 0.1195 ( 9109 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1441 -6.1441 -5.7465 -5.7465 -5.7316 -5.7316 -5.6585 -5.6585 -5.4591 -5.4591 -5.4579 -5.4579 -5.3943 -5.3943 -5.2417 -5.2417 -5.1631 -5.1631 -5.1291 -5.1291 -3.3189 -3.3189 -3.3125 -3.3125 -3.2482 -3.2482 -3.2376 -3.2376 -3.2178 -3.2178 -3.2010 -3.2010 -3.1859 -3.1859 -3.1614 -3.1614 -3.1374 -3.1374 1.2296 1.2296 1.3067 1.3067 1.5971 1.5971 3.3812 3.3812 3.3859 3.3859 3.5602 3.5602 3.8941 3.8941 3.9645 3.9645 4.0700 4.0700 4.0999 4.0999 4.2050 4.2050 4.3480 4.3480 4.3750 4.3750 5.2058 5.2058 5.2717 5.2717 8.1923 8.1923 8.3643 8.3643 8.4088 8.4088 8.5700 8.5700 8.6736 8.6736 9.4885 9.4885 9.8483 9.8483 10.3119 10.3119 k = 0.1098-0.0776 0.1344 ( 9133 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1354 -6.1354 -5.7450 -5.7450 -5.7349 -5.7349 -5.6533 -5.6533 -5.4589 -5.4589 -5.4573 -5.4573 -5.3949 -5.3949 -5.2511 -5.2511 -5.1669 -5.1669 -5.1261 -5.1260 -3.3190 -3.3190 -3.3110 -3.3110 -3.2487 -3.2487 -3.2402 -3.2402 -3.2180 -3.2180 -3.2021 -3.2021 -3.1871 -3.1871 -3.1608 -3.1608 -3.1374 -3.1374 1.1929 1.1929 1.2569 1.2569 1.6151 1.6151 3.3612 3.3612 3.3679 3.3679 3.5624 3.5624 3.8975 3.8975 3.9981 3.9981 4.1173 4.1173 4.1440 4.1440 4.2277 4.2277 4.3631 4.3631 4.3980 4.3980 5.2133 5.2133 5.2922 5.2922 8.1730 8.1730 8.3496 8.3496 8.4227 8.4227 8.5830 8.5830 8.6930 8.6930 9.4235 9.4235 9.8080 9.8080 10.3132 10.3132 k = 0.1220-0.0862 0.1494 ( 9133 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1258 -6.1258 -5.7434 -5.7434 -5.7379 -5.7379 -5.6482 -5.6482 -5.4585 -5.4585 -5.4567 -5.4567 -5.3955 -5.3955 -5.2605 -5.2605 -5.1711 -5.1711 -5.1235 -5.1235 -3.3192 -3.3192 -3.3094 -3.3094 -3.2499 -3.2499 -3.2423 -3.2423 -3.2183 -3.2183 -3.2033 -3.2033 -3.1885 -3.1885 -3.1604 -3.1604 -3.1373 -3.1373 1.1536 1.1536 1.2050 1.2050 1.6352 1.6352 3.3426 3.3426 3.3514 3.3514 3.5622 3.5622 3.8956 3.8956 4.0295 4.0295 4.1479 4.1479 4.2045 4.2045 4.2604 4.2604 4.3818 4.3818 4.4258 4.4258 5.2220 5.2220 5.3155 5.3155 8.1528 8.1528 8.3325 8.3325 8.4414 8.4414 8.5955 8.5955 8.7112 8.7112 9.3579 9.3579 9.7574 9.7574 10.3227 10.3227 k = 0.1341-0.0949 0.1643 ( 9133 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.1154 -6.1154 -5.7416 -5.7416 -5.7407 -5.7407 -5.6431 -5.6431 -5.4581 -5.4581 -5.4561 -5.4561 -5.3962 -5.3962 -5.2698 -5.2698 -5.1756 -5.1756 -5.1215 -5.1215 -3.3194 -3.3194 -3.3078 -3.3077 -3.2518 -3.2518 -3.2437 -3.2437 -3.2186 -3.2186 -3.2046 -3.2046 -3.1900 -3.1900 -3.1603 -3.1603 -3.1372 -3.1372 1.1121 1.1121 1.1516 1.1517 1.6573 1.6573 3.3253 3.3253 3.3364 3.3364 3.5591 3.5591 3.8901 3.8901 4.0583 4.0583 4.1781 4.1781 4.2477 4.2477 4.3160 4.3160 4.4053 4.4053 4.4591 4.4591 5.2318 5.2318 5.3413 5.3413 8.1322 8.1322 8.3146 8.3146 8.4633 8.4633 8.6062 8.6062 8.7282 8.7282 9.2934 9.2934 9.6988 9.6988 10.3383 10.3383 k = 0.1463-0.1035 0.1792 ( 9137 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.1042 -6.1042 -5.7434 -5.7434 -5.7396 -5.7396 -5.6383 -5.6383 -5.4577 -5.4577 -5.4554 -5.4554 -5.3971 -5.3971 -5.2790 -5.2790 -5.1805 -5.1805 -5.1201 -5.1201 -3.3196 -3.3196 -3.3060 -3.3060 -3.2543 -3.2543 -3.2444 -3.2444 -3.2189 -3.2189 -3.2061 -3.2061 -3.1916 -3.1916 -3.1604 -3.1604 -3.1369 -3.1369 1.0690 1.0690 1.0974 1.0974 1.6813 1.6813 3.3094 3.3094 3.3229 3.3229 3.5533 3.5533 3.8820 3.8820 4.0846 4.0846 4.2075 4.2075 4.2772 4.2772 4.3872 4.3872 4.4348 4.4348 4.4985 4.4985 5.2427 5.2427 5.3695 5.3695 8.1118 8.1118 8.2967 8.2967 8.4872 8.4872 8.6134 8.6134 8.7442 8.7442 9.2320 9.2320 9.6345 9.6345 10.3571 10.3571 k = 0.1585-0.1121 0.1942 ( 9153 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0922 -6.0922 -5.7458 -5.7458 -5.7376 -5.7376 -5.6335 -5.6335 -5.4572 -5.4572 -5.4547 -5.4547 -5.3982 -5.3982 -5.2880 -5.2880 -5.1856 -5.1856 -5.1192 -5.1192 -3.3199 -3.3199 -3.3041 -3.3041 -3.2572 -3.2572 -3.2448 -3.2448 -3.2191 -3.2191 -3.2076 -3.2076 -3.1934 -3.1934 -3.1605 -3.1605 -3.1366 -3.1366 1.0246 1.0246 1.0428 1.0428 1.7071 1.7071 3.2949 3.2949 3.3110 3.3110 3.5447 3.5447 3.8720 3.8720 4.1087 4.1087 4.2354 4.2354 4.3025 4.3025 4.4596 4.4596 4.4728 4.4728 4.5449 4.5449 5.2547 5.2547 5.3994 5.3994 8.0921 8.0921 8.2792 8.2792 8.5125 8.5125 8.6148 8.6148 8.7596 8.7596 9.1761 9.1761 9.5665 9.5665 10.3754 10.3754 k = 0.1707-0.1207 0.2091 ( 9169 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0797 -6.0797 -5.7480 -5.7480 -5.7354 -5.7354 -5.6291 -5.6291 -5.4566 -5.4566 -5.4540 -5.4540 -5.3995 -5.3995 -5.2967 -5.2967 -5.1910 -5.1910 -5.1189 -5.1189 -3.3202 -3.3202 -3.3022 -3.3022 -3.2601 -3.2601 -3.2449 -3.2449 -3.2193 -3.2193 -3.2093 -3.2093 -3.1954 -3.1954 -3.1607 -3.1607 -3.1364 -3.1364 0.9791 0.9791 0.9883 0.9883 1.7345 1.7345 3.2818 3.2818 3.3006 3.3006 3.5337 3.5337 3.8600 3.8600 4.1313 4.1313 4.2618 4.2618 4.3258 4.3258 4.5103 4.5103 4.5367 4.5367 4.5999 4.5999 5.2679 5.2679 5.4305 5.4305 8.0735 8.0735 8.2624 8.2624 8.5378 8.5378 8.6082 8.6082 8.7750 8.7750 9.1282 9.1282 9.4966 9.4966 10.3872 10.3872 k = 0.1829-0.1293 0.2240 ( 9152 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0665 -6.0665 -5.7498 -5.7498 -5.7330 -5.7330 -5.6249 -5.6249 -5.4559 -5.4559 -5.4532 -5.4532 -5.4010 -5.4010 -5.3050 -5.3050 -5.1966 -5.1966 -5.1192 -5.1192 -3.3206 -3.3206 -3.3002 -3.3002 -3.2630 -3.2630 -3.2450 -3.2450 -3.2194 -3.2194 -3.2111 -3.2111 -3.1975 -3.1975 -3.1610 -3.1610 -3.1362 -3.1362 0.9324 0.9324 0.9348 0.9348 1.7634 1.7634 3.2700 3.2700 3.2917 3.2917 3.5210 3.5210 3.8462 3.8462 4.1529 4.1529 4.2868 4.2868 4.3480 4.3480 4.5579 4.5579 4.6035 4.6035 4.6644 4.6644 5.2823 5.2823 5.4623 5.4623 8.0564 8.0564 8.2468 8.2468 8.5586 8.5586 8.5957 8.5957 8.7905 8.7905 9.0906 9.0906 9.4261 9.4261 10.3811 10.3811 k = 0.1951-0.1380 0.2390 ( 9160 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0528 -6.0528 -5.7515 -5.7515 -5.7305 -5.7305 -5.6211 -5.6211 -5.4552 -5.4552 -5.4524 -5.4524 -5.4027 -5.4027 -5.3128 -5.3128 -5.2024 -5.2024 -5.1200 -5.1200 -3.3211 -3.3211 -3.2982 -3.2982 -3.2658 -3.2658 -3.2451 -3.2451 -3.2196 -3.2196 -3.2130 -3.2130 -3.1996 -3.1996 -3.1612 -3.1612 -3.1360 -3.1360 0.8802 0.8802 0.8872 0.8872 1.7936 1.7936 3.2595 3.2595 3.2843 3.2843 3.5070 3.5070 3.8302 3.8302 4.1740 4.1740 4.3109 4.3109 4.3697 4.3697 4.6092 4.6092 4.6663 4.6663 4.7359 4.7359 5.2981 5.2981 5.4939 5.4939 8.0411 8.0411 8.2323 8.2323 8.5480 8.5480 8.6025 8.6025 8.8060 8.8060 9.0644 9.0644 9.3568 9.3568 10.3419 10.3419 k = 0.2073-0.1466 0.2539 ( 9160 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0388 -6.0388 -5.7528 -5.7528 -5.7280 -5.7280 -5.6177 -5.6177 -5.4543 -5.4543 -5.4515 -5.4515 -5.4046 -5.4046 -5.3201 -5.3201 -5.2083 -5.2083 -5.1214 -5.1214 -3.3217 -3.3217 -3.2963 -3.2963 -3.2684 -3.2684 -3.2451 -3.2451 -3.2197 -3.2197 -3.2149 -3.2149 -3.2017 -3.2017 -3.1614 -3.1614 -3.1360 -3.1360 0.8278 0.8278 0.8408 0.8408 1.8250 1.8250 3.2503 3.2503 3.2784 3.2784 3.4925 3.4925 3.8122 3.8122 4.1950 4.1950 4.3343 4.3343 4.3914 4.3914 4.6634 4.6634 4.7277 4.7277 4.8099 4.8099 5.3154 5.3154 5.5247 5.5247 8.0280 8.0280 8.2193 8.2193 8.5100 8.5100 8.6254 8.6254 8.8208 8.8208 9.0490 9.0490 9.2901 9.2901 10.2687 10.2687 k = 0.2195-0.1552 0.2688 ( 9156 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0244 -6.0244 -5.7539 -5.7539 -5.7253 -5.7253 -5.6148 -5.6148 -5.4534 -5.4534 -5.4505 -5.4505 -5.4067 -5.4067 -5.3268 -5.3268 -5.2143 -5.2143 -5.1234 -5.1234 -3.3224 -3.3224 -3.2943 -3.2943 -3.2709 -3.2709 -3.2451 -3.2451 -3.2200 -3.2200 -3.2169 -3.2169 -3.2038 -3.2038 -3.1616 -3.1616 -3.1361 -3.1361 0.7765 0.7765 0.7946 0.7946 1.8573 1.8573 3.2423 3.2423 3.2737 3.2737 3.4781 3.4781 3.7921 3.7921 4.2162 4.2162 4.3571 4.3571 4.4135 4.4135 4.7198 4.7198 4.7893 4.7893 4.8833 4.8833 5.3343 5.3343 5.5539 5.5539 8.0174 8.0174 8.2073 8.2073 8.4619 8.4619 8.6489 8.6489 8.8336 8.8336 9.0427 9.0427 9.2283 9.2283 10.1741 10.1741 k = 0.2317-0.1638 0.2838 ( 9132 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0097 -6.0097 -5.7546 -5.7546 -5.7225 -5.7225 -5.6125 -5.6125 -5.4524 -5.4524 -5.4494 -5.4494 -5.4089 -5.4089 -5.3329 -5.3329 -5.2203 -5.2203 -5.1259 -5.1259 -3.3232 -3.3232 -3.2924 -3.2924 -3.2730 -3.2730 -3.2452 -3.2452 -3.2209 -3.2209 -3.2185 -3.2185 -3.2056 -3.2056 -3.1618 -3.1618 -3.1362 -3.1362 0.7266 0.7266 0.7488 0.7488 1.8902 1.8902 3.2355 3.2355 3.2703 3.2703 3.4644 3.4644 3.7700 3.7700 4.2377 4.2377 4.3794 4.3794 4.4363 4.4363 4.7775 4.7775 4.8513 4.8513 4.9544 4.9544 5.3551 5.3551 5.5808 5.5808 8.0094 8.0094 8.1958 8.1958 8.4093 8.4093 8.6695 8.6695 8.8431 8.8431 9.0431 9.0431 9.1744 9.1744 10.0683 10.0683 k = 0.2439-0.1725 0.2987 ( 9140 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9949 -5.9949 -5.7550 -5.7550 -5.7197 -5.7197 -5.6109 -5.6109 -5.4515 -5.4515 -5.4480 -5.4480 -5.4113 -5.4113 -5.3383 -5.3383 -5.2263 -5.2263 -5.1290 -5.1290 -3.3241 -3.3241 -3.2906 -3.2906 -3.2749 -3.2749 -3.2454 -3.2454 -3.2226 -3.2226 -3.2194 -3.2194 -3.2071 -3.2071 -3.1620 -3.1620 -3.1365 -3.1365 0.6783 0.6783 0.7037 0.7037 1.9237 1.9237 3.2298 3.2298 3.2681 3.2681 3.4520 3.4520 3.7462 3.7462 4.2596 4.2596 4.4014 4.4014 4.4597 4.4597 4.8360 4.8360 4.9137 4.9137 5.0221 5.0221 5.3779 5.3779 5.6048 5.6048 8.0040 8.0040 8.1830 8.1830 8.3568 8.3568 8.6845 8.6845 8.8480 8.8480 9.0480 9.0480 9.1321 9.1321 9.9572 9.9572 k = 0.2561-0.1811 0.3137 ( 9132 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9801 -5.9801 -5.7551 -5.7551 -5.7168 -5.7168 -5.6100 -5.6100 -5.4505 -5.4505 -5.4465 -5.4465 -5.4136 -5.4136 -5.3431 -5.3431 -5.2323 -5.2323 -5.1325 -5.1325 -3.3251 -3.3251 -3.2890 -3.2890 -3.2765 -3.2765 -3.2457 -3.2457 -3.2248 -3.2248 -3.2200 -3.2200 -3.2082 -3.2082 -3.1623 -3.1623 -3.1369 -3.1369 0.6316 0.6316 0.6594 0.6594 1.9573 1.9573 3.2251 3.2251 3.2670 3.2670 3.4415 3.4415 3.7209 3.7209 4.2819 4.2819 4.4231 4.4231 4.4837 4.4837 4.8947 4.8947 4.9759 4.9759 5.0855 5.0855 5.4030 5.4030 5.6254 5.6254 8.0014 8.0014 8.1648 8.1648 8.3107 8.3107 8.6897 8.6897 8.8492 8.8492 9.0548 9.0548 9.1055 9.1055 9.8442 9.8442 k = 0.2683-0.1897 0.3286 ( 9152 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9654 -5.9654 -5.7548 -5.7548 -5.7138 -5.7138 -5.6099 -5.6099 -5.4497 -5.4497 -5.4446 -5.4446 -5.4158 -5.4158 -5.3474 -5.3474 -5.2382 -5.2382 -5.1367 -5.1367 -3.3263 -3.3263 -3.2874 -3.2874 -3.2777 -3.2777 -3.2462 -3.2462 -3.2270 -3.2270 -3.2208 -3.2208 -3.2088 -3.2088 -3.1626 -3.1626 -3.1374 -3.1374 0.5868 0.5868 0.6161 0.6161 1.9908 1.9908 3.2213 3.2213 3.2669 3.2669 3.4332 3.4332 3.6944 3.6944 4.3045 4.3045 4.4445 4.4445 4.5081 4.5081 4.9531 4.9531 5.0374 5.0374 5.1443 5.1443 5.4305 5.4305 5.6422 5.6422 8.0012 8.0012 8.1354 8.1354 8.2784 8.2784 8.6803 8.6803 8.8507 8.8507 9.0609 9.0609 9.0965 9.0965 9.7321 9.7321 k = 0.2805-0.1983 0.3435 ( 9140 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9508 -5.9508 -5.7542 -5.7542 -5.7109 -5.7109 -5.6107 -5.6107 -5.4489 -5.4489 -5.4425 -5.4425 -5.4177 -5.4177 -5.3510 -5.3510 -5.2439 -5.2439 -5.1413 -5.1413 -3.3276 -3.3276 -3.2861 -3.2861 -3.2786 -3.2786 -3.2469 -3.2469 -3.2291 -3.2291 -3.2217 -3.2217 -3.2089 -3.2089 -3.1629 -3.1629 -3.1380 -3.1380 0.5439 0.5439 0.5739 0.5739 2.0239 2.0239 3.2183 3.2183 3.2677 3.2677 3.4278 3.4278 3.6669 3.6669 4.3275 4.3275 4.4655 4.4655 4.5325 4.5325 5.0107 5.0107 5.0973 5.0973 5.1986 5.1986 5.4601 5.4601 5.6550 5.6550 8.0032 8.0032 8.0934 8.0934 8.2628 8.2628 8.6552 8.6552 8.8563 8.8563 9.0663 9.0663 9.1009 9.1009 9.6229 9.6229 k = 0.2927-0.2070 0.3585 ( 9156 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9365 -5.9365 -5.7531 -5.7531 -5.7080 -5.7080 -5.6123 -5.6123 -5.4481 -5.4481 -5.4402 -5.4402 -5.4191 -5.4191 -5.3542 -5.3542 -5.2495 -5.2495 -5.1464 -5.1464 -3.3289 -3.3289 -3.2850 -3.2850 -3.2791 -3.2791 -3.2480 -3.2480 -3.2308 -3.2308 -3.2228 -3.2228 -3.2087 -3.2087 -3.1632 -3.1632 -3.1387 -3.1387 0.5031 0.5031 0.5331 0.5331 2.0563 2.0563 3.2161 3.2161 3.2694 3.2694 3.4253 3.4253 3.6389 3.6389 4.3507 4.3507 4.4862 4.4862 4.5568 4.5568 5.0670 5.0670 5.1547 5.1547 5.2493 5.2493 5.4915 5.4915 5.6637 5.6637 8.0051 8.0051 8.0458 8.0458 8.2592 8.2592 8.6186 8.6186 8.8654 8.8654 9.0735 9.0735 9.1112 9.1112 9.5188 9.5188 k = 0.3049-0.2156 0.3734 ( 9164 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9226 -5.9226 -5.7517 -5.7517 -5.7051 -5.7051 -5.6147 -5.6147 -5.4474 -5.4474 -5.4379 -5.4379 -5.4199 -5.4199 -5.3569 -5.3568 -5.2548 -5.2548 -5.1519 -5.1519 -3.3304 -3.3304 -3.2842 -3.2842 -3.2791 -3.2791 -3.2494 -3.2494 -3.2322 -3.2322 -3.2240 -3.2240 -3.2081 -3.2081 -3.1637 -3.1637 -3.1394 -3.1394 0.4643 0.4643 0.4937 0.4937 2.0877 2.0877 3.2146 3.2146 3.2717 3.2717 3.4263 3.4263 3.6107 3.6107 4.3740 4.3740 4.5065 4.5065 4.5804 4.5804 5.1213 5.1213 5.2082 5.2082 5.2977 5.2977 5.5238 5.5238 5.6684 5.6684 7.9831 7.9831 8.0214 8.0214 8.2628 8.2628 8.5759 8.5759 8.8752 8.8752 9.0822 9.0822 9.1232 9.1232 9.4222 9.4222 k = 0.3171-0.2242 0.3883 ( 9172 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9092 -5.9092 -5.7498 -5.7498 -5.7023 -5.7023 -5.6179 -5.6179 -5.4468 -5.4468 -5.4360 -5.4360 -5.4197 -5.4197 -5.3591 -5.3591 -5.2599 -5.2599 -5.1580 -5.1580 -3.3319 -3.3319 -3.2836 -3.2836 -3.2788 -3.2788 -3.2512 -3.2512 -3.2332 -3.2332 -3.2253 -3.2252 -3.2072 -3.2072 -3.1642 -3.1642 -3.1402 -3.1402 0.4276 0.4276 0.4559 0.4559 2.1178 2.1178 3.2136 3.2136 3.2747 3.2747 3.4305 3.4305 3.5828 3.5828 4.3974 4.3974 4.5262 4.5262 4.6029 4.6029 5.1732 5.1732 5.2568 5.2568 5.3454 5.3454 5.5562 5.5562 5.6693 5.6693 7.9338 7.9338 8.0260 8.0260 8.2706 8.2706 8.5314 8.5314 8.8822 8.8822 9.0907 9.0907 9.1351 9.1351 9.3366 9.3366 k = 0.3293-0.2328 0.4033 ( 9176 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8965 -5.8965 -5.7475 -5.7475 -5.6997 -5.6997 -5.6217 -5.6217 -5.4462 -5.4462 -5.4348 -5.4348 -5.4180 -5.4180 -5.3609 -5.3609 -5.2647 -5.2647 -5.1644 -5.1644 -3.3335 -3.3335 -3.2832 -3.2832 -3.2782 -3.2782 -3.2533 -3.2533 -3.2339 -3.2339 -3.2265 -3.2265 -3.2062 -3.2062 -3.1647 -3.1647 -3.1411 -3.1411 0.3932 0.3932 0.4199 0.4199 2.1463 2.1463 3.2130 3.2130 3.2782 3.2782 3.4380 3.4380 3.5559 3.5559 4.4207 4.4207 4.5454 4.5454 4.6240 4.6240 5.2219 5.2219 5.3000 5.3000 5.3936 5.3936 5.5876 5.5876 5.6669 5.6669 7.8842 7.8842 8.0338 8.0338 8.2805 8.2805 8.4882 8.4882 8.8820 8.8820 9.0968 9.0968 9.1462 9.1462 9.2669 9.2669 k = 0.3415-0.2415 0.4182 ( 9168 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8843 -5.8843 -5.7448 -5.7448 -5.6972 -5.6972 -5.6261 -5.6261 -5.4457 -5.4457 -5.4344 -5.4344 -5.4150 -5.4150 -5.3622 -5.3622 -5.2692 -5.2692 -5.1713 -5.1713 -3.3351 -3.3351 -3.2828 -3.2828 -3.2775 -3.2775 -3.2555 -3.2555 -3.2344 -3.2344 -3.2277 -3.2277 -3.2049 -3.2049 -3.1653 -3.1653 -3.1420 -3.1420 0.3610 0.3610 0.3857 0.3857 2.1731 2.1731 3.2128 3.2128 3.2820 3.2820 3.4475 3.4475 3.5313 3.5313 4.4438 4.4438 4.5638 4.5638 4.6431 4.6431 5.2666 5.2666 5.3388 5.3388 5.4419 5.4419 5.6172 5.6172 5.6617 5.6617 7.8372 7.8372 8.0424 8.0424 8.2897 8.2897 8.4494 8.4494 8.8698 8.8698 9.0983 9.0983 9.1560 9.1560 9.2190 9.2190 k = 0.3537-0.2501 0.4331 ( 9164 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8730 -5.8730 -5.7416 -5.7416 -5.6949 -5.6949 -5.6310 -5.6310 -5.4452 -5.4452 -5.4346 -5.4346 -5.4111 -5.4111 -5.3630 -5.3630 -5.2733 -5.2733 -5.1786 -5.1786 -3.3367 -3.3367 -3.2824 -3.2824 -3.2768 -3.2768 -3.2577 -3.2577 -3.2348 -3.2348 -3.2289 -3.2289 -3.2035 -3.2035 -3.1660 -3.1660 -3.1428 -3.1428 0.3311 0.3311 0.3535 0.3535 2.1980 2.1980 3.2127 3.2127 3.2862 3.2862 3.4550 3.4550 3.5134 3.5134 4.4665 4.4665 4.5813 4.5813 4.6598 4.6598 5.3067 5.3067 5.3747 5.3747 5.4892 5.4892 5.6442 5.6442 5.6550 5.6550 7.7938 7.7938 8.0509 8.0509 8.2940 8.2940 8.4196 8.4196 8.8425 8.8425 9.0964 9.0964 9.1643 9.1643 9.1944 9.1944 k = 0.3659-0.2587 0.4481 ( 9164 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8625 -5.8625 -5.7381 -5.7381 -5.6929 -5.6929 -5.6362 -5.6362 -5.4447 -5.4447 -5.4351 -5.4351 -5.4065 -5.4065 -5.3632 -5.3632 -5.2771 -5.2771 -5.1862 -5.1862 -3.3382 -3.3382 -3.2820 -3.2820 -3.2760 -3.2760 -3.2600 -3.2600 -3.2350 -3.2350 -3.2300 -3.2300 -3.2020 -3.2020 -3.1668 -3.1668 -3.1437 -3.1437 0.3035 0.3035 0.3234 0.3234 2.2208 2.2208 3.2126 3.2126 3.2905 3.2905 3.4505 3.4505 3.5122 3.5122 4.4888 4.4888 4.5978 4.5978 4.6736 4.6736 5.3418 5.3418 5.4086 5.4086 5.5344 5.5344 5.6453 5.6453 5.6702 5.6702 7.7543 7.7543 8.0588 8.0588 8.2870 8.2870 8.4049 8.4049 8.8027 8.8027 9.0957 9.0957 9.1712 9.1712 9.1853 9.1853 k = 0.3780-0.2673 0.4630 ( 9168 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8528 -5.8528 -5.7341 -5.7341 -5.6912 -5.6912 -5.6416 -5.6416 -5.4443 -5.4443 -5.4358 -5.4358 -5.4017 -5.4017 -5.3625 -5.3625 -5.2806 -5.2806 -5.1942 -5.1942 -3.3397 -3.3397 -3.2815 -3.2815 -3.2753 -3.2753 -3.2621 -3.2621 -3.2353 -3.2353 -3.2310 -3.2310 -3.2004 -3.2004 -3.1677 -3.1677 -3.1445 -3.1445 0.2782 0.2782 0.2956 0.2956 2.2415 2.2415 3.2125 3.2125 3.2949 3.2949 3.4341 3.4341 3.5276 3.5276 4.5105 4.5105 4.6129 4.6129 4.6842 4.6842 5.3723 5.3723 5.4408 5.4408 5.5757 5.5757 5.6371 5.6371 5.6923 5.6923 7.7191 7.7191 8.0656 8.0656 8.2675 8.2675 8.4064 8.4064 8.7570 8.7570 9.0986 9.0986 9.1764 9.1764 9.1826 9.1826 k = 0.3902-0.2759 0.4779 ( 9160 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8440 -5.8440 -5.7298 -5.7298 -5.6898 -5.6898 -5.6471 -5.6471 -5.4439 -5.4439 -5.4365 -5.4365 -5.3970 -5.3970 -5.3609 -5.3609 -5.2838 -5.2838 -5.2024 -5.2024 -3.3411 -3.3411 -3.2810 -3.2810 -3.2747 -3.2747 -3.2640 -3.2640 -3.2356 -3.2356 -3.2320 -3.2320 -3.1988 -3.1988 -3.1687 -3.1687 -3.1453 -3.1453 0.2553 0.2553 0.2700 0.2700 2.2601 2.2601 3.2121 3.2121 3.2992 3.2992 3.4146 3.4146 3.5504 3.5504 4.5313 4.5313 4.6267 4.6267 4.6914 4.6914 5.3989 5.3989 5.4704 5.4704 5.6068 5.6068 5.6356 5.6356 5.7119 5.7119 7.6882 7.6882 8.0711 8.0711 8.2419 8.2419 8.4174 8.4174 8.7109 8.7109 9.1040 9.1040 9.1797 9.1797 9.1817 9.1817 k = 0.4024-0.2846 0.4929 ( 9172 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8361 -5.8361 -5.7253 -5.7253 -5.6888 -5.6888 -5.6526 -5.6526 -5.4436 -5.4436 -5.4374 -5.4374 -5.3929 -5.3929 -5.3580 -5.3580 -5.2866 -5.2866 -5.2109 -5.2109 -3.3425 -3.3425 -3.2805 -3.2805 -3.2741 -3.2741 -3.2657 -3.2657 -3.2358 -3.2358 -3.2329 -3.2329 -3.1970 -3.1970 -3.1698 -3.1698 -3.1460 -3.1460 0.2348 0.2348 0.2468 0.2468 2.2766 2.2766 3.2113 3.2113 3.3034 3.3034 3.3956 3.3956 3.5768 3.5768 4.5512 4.5512 4.6387 4.6387 4.6951 4.6951 5.4225 5.4225 5.4968 5.4968 5.6096 5.6096 5.6591 5.6591 5.7291 5.7291 7.6616 7.6616 8.0751 8.0751 8.2152 8.2152 8.4323 8.4323 8.6683 8.6683 9.1103 9.1103 9.1805 9.1805 9.1816 9.1816 k = 0.4146-0.2932 0.5078 ( 9180 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8291 -5.8291 -5.7206 -5.7206 -5.6883 -5.6883 -5.6579 -5.6579 -5.4433 -5.4433 -5.4383 -5.4383 -5.3895 -5.3895 -5.3537 -5.3537 -5.2891 -5.2891 -5.2196 -5.2196 -3.3437 -3.3437 -3.2800 -3.2800 -3.2737 -3.2737 -3.2670 -3.2670 -3.2361 -3.2361 -3.2338 -3.2338 -3.1952 -3.1952 -3.1709 -3.1709 -3.1467 -3.1467 0.2166 0.2166 0.2262 0.2262 2.2909 2.2909 3.2102 3.2102 3.3073 3.3073 3.3783 3.3783 3.6048 3.6048 4.5698 4.5698 4.6489 4.6489 4.6955 4.6955 5.4438 5.4438 5.5191 5.5191 5.6034 5.6034 5.6886 5.6886 5.7440 5.7440 7.6393 7.6393 8.0775 8.0775 8.1898 8.1898 8.4484 8.4484 8.6308 8.6308 9.1166 9.1166 9.1789 9.1789 9.1813 9.1813 k = 0.4268-0.3018 0.5228 ( 9172 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8230 -5.8230 -5.7159 -5.7159 -5.6881 -5.6881 -5.6630 -5.6630 -5.4430 -5.4430 -5.4391 -5.4391 -5.3870 -5.3870 -5.3481 -5.3481 -5.2913 -5.2913 -5.2284 -5.2284 -3.3448 -3.3448 -3.2795 -3.2795 -3.2736 -3.2736 -3.2679 -3.2679 -3.2364 -3.2364 -3.2346 -3.2346 -3.1933 -3.1933 -3.1722 -3.1722 -3.1472 -3.1472 0.2009 0.2009 0.2081 0.2081 2.3032 2.3032 3.2085 3.2085 3.3109 3.3109 3.3633 3.3633 3.6331 3.6331 4.5869 4.5869 4.6569 4.6569 4.6934 4.6934 5.4629 5.4629 5.5366 5.5366 5.5978 5.5978 5.7152 5.7152 5.7569 5.7569 7.6208 7.6208 8.0786 8.0786 8.1670 8.1670 8.4640 8.4640 8.5993 8.5993 9.1223 9.1223 9.1764 9.1764 9.1796 9.1796 k = 0.4390-0.3104 0.5377 ( 9172 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8177 -5.8177 -5.7111 -5.7111 -5.6883 -5.6883 -5.6679 -5.6679 -5.4428 -5.4428 -5.4399 -5.4399 -5.3851 -5.3851 -5.3414 -5.3414 -5.2933 -5.2933 -5.2373 -5.2373 -3.3457 -3.3457 -3.2791 -3.2791 -3.2738 -3.2738 -3.2683 -3.2683 -3.2367 -3.2367 -3.2354 -3.2354 -3.1914 -3.1914 -3.1736 -3.1736 -3.1477 -3.1477 0.1875 0.1875 0.1927 0.1927 2.3135 2.3135 3.2065 3.2065 3.3141 3.3141 3.3507 3.3507 3.6604 3.6604 4.6021 4.6021 4.6625 4.6625 4.6899 4.6899 5.4803 5.4803 5.5485 5.5485 5.5944 5.5944 5.7378 5.7378 5.7678 5.7678 7.6060 7.6060 8.0787 8.0787 8.1469 8.1469 8.4784 8.4784 8.5739 8.5739 9.1272 9.1272 9.1733 9.1733 9.1767 9.1767 k = 0.4512-0.3191 0.5526 ( 9156 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8133 -5.8133 -5.7063 -5.7063 -5.6888 -5.6888 -5.6724 -5.6724 -5.4426 -5.4426 -5.4406 -5.4406 -5.3838 -5.3838 -5.3340 -5.3340 -5.2951 -5.2951 -5.2459 -5.2459 -3.3465 -3.3465 -3.2786 -3.2786 -3.2744 -3.2744 -3.2682 -3.2682 -3.2369 -3.2369 -3.2361 -3.2361 -3.1895 -3.1895 -3.1751 -3.1751 -3.1481 -3.1481 0.1766 0.1766 0.1800 0.1800 2.3219 2.3219 3.2043 3.2043 3.3169 3.3169 3.3407 3.3407 3.6853 3.6853 4.6149 4.6149 4.6654 4.6654 4.6863 4.6863 5.4959 5.4959 5.5544 5.5544 5.5940 5.5940 5.7562 5.7562 5.7768 5.7768 7.5944 7.5944 8.0786 8.0786 8.1298 8.1298 8.4909 8.4909 8.5541 8.5541 9.1314 9.1314 9.1698 9.1698 9.1732 9.1732 k = 0.4634-0.3277 0.5676 ( 9116 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8098 -5.8098 -5.7017 -5.7017 -5.6895 -5.6895 -5.6766 -5.6766 -5.4425 -5.4425 -5.4412 -5.4412 -5.3829 -5.3829 -5.3262 -5.3262 -5.2968 -5.2968 -5.2541 -5.2541 -3.3472 -3.3472 -3.2782 -3.2782 -3.2750 -3.2750 -3.2680 -3.2680 -3.2371 -3.2371 -3.2366 -3.2366 -3.1875 -3.1875 -3.1767 -3.1767 -3.1484 -3.1484 0.1681 0.1681 0.1701 0.1701 2.3284 2.3284 3.2021 3.2021 3.3191 3.3191 3.3332 3.3332 3.7066 3.7066 4.6244 4.6244 4.6664 4.6664 4.6836 4.6836 5.5098 5.5098 5.5550 5.5550 5.5958 5.5958 5.7704 5.7704 5.7838 5.7838 7.5858 7.5858 8.0788 8.0788 8.1154 8.1154 8.5011 8.5011 8.5396 8.5396 9.1350 9.1350 9.1663 9.1663 9.1695 9.1695 k = 0.4756-0.3363 0.5825 ( 9112 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8073 -5.8073 -5.6973 -5.6973 -5.6901 -5.6901 -5.6807 -5.6807 -5.4424 -5.4424 -5.4417 -5.4417 -5.3823 -5.3823 -5.3186 -5.3186 -5.2988 -5.2988 -5.2613 -5.2613 -3.3476 -3.3476 -3.2778 -3.2778 -3.2757 -3.2757 -3.2677 -3.2677 -3.2373 -3.2373 -3.2370 -3.2370 -3.1856 -3.1856 -3.1783 -3.1783 -3.1486 -3.1486 0.1621 0.1621 0.1629 0.1629 2.3330 2.3330 3.2003 3.2003 3.3208 3.3208 3.3280 3.3280 3.7229 3.7229 4.6299 4.6299 4.6678 4.6678 4.6813 4.6813 5.5219 5.5219 5.5523 5.5523 5.5980 5.5980 5.7808 5.7808 5.7886 5.7886 7.5799 7.5799 8.0800 8.0800 8.1037 8.1037 8.5089 8.5089 8.5294 8.5294 9.1379 9.1379 9.1634 9.1634 9.1660 9.1660 k = 0.4878-0.3449 0.5974 ( 9112 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8057 -5.8057 -5.6932 -5.6932 -5.6905 -5.6905 -5.6847 -5.6847 -5.4423 -5.4423 -5.4420 -5.4420 -5.3820 -5.3820 -5.3115 -5.3115 -5.3015 -5.3015 -5.2665 -5.2665 -3.3479 -3.3479 -3.2774 -3.2774 -3.2763 -3.2763 -3.2675 -3.2675 -3.2374 -3.2374 -3.2373 -3.2373 -3.1837 -3.1837 -3.1801 -3.1801 -3.1487 -3.1487 0.1584 0.1584 0.1586 0.1586 2.3358 2.3358 3.1990 3.1990 3.3220 3.3220 3.3248 3.3248 3.7332 3.7332 4.6319 4.6319 4.6710 4.6710 4.6785 4.6785 5.5322 5.5322 5.5474 5.5474 5.5996 5.5996 5.7875 5.7875 5.7910 5.7910 7.5764 7.5764 8.0828 8.0828 8.0945 8.0945 8.5144 8.5144 8.5228 8.5228 9.1400 9.1400 9.1618 9.1618 9.1632 9.1632 k = 0.5000-0.3536 0.6124 ( 9136 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8052 -5.8052 -5.6913 -5.6913 -5.6885 -5.6885 -5.6885 -5.6885 -5.4422 -5.4422 -5.4422 -5.4422 -5.3818 -5.3818 -5.3056 -5.3056 -5.3056 -5.3056 -5.2685 -5.2685 -3.3480 -3.3480 -3.2769 -3.2769 -3.2769 -3.2769 -3.2675 -3.2675 -3.2374 -3.2374 -3.2374 -3.2374 -3.1819 -3.1819 -3.1819 -3.1819 -3.1488 -3.1488 0.1572 0.1572 0.1572 0.1572 2.3367 2.3367 3.1986 3.1986 3.3230 3.3230 3.3230 3.3230 3.7367 3.7367 4.6322 4.6322 4.6749 4.6749 4.6749 4.6749 5.5407 5.5407 5.5407 5.5407 5.6002 5.6002 5.7908 5.7908 5.7908 5.7908 7.5753 7.5753 8.0876 8.0876 8.0876 8.0876 8.5184 8.5184 8.5184 8.5184 9.1408 9.1408 9.1617 9.1617 9.1617 9.1617 k = 0.5000-0.3536 0.6124 ( 9136 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8052 -5.8052 -5.6913 -5.6913 -5.6885 -5.6885 -5.6885 -5.6885 -5.4422 -5.4422 -5.4422 -5.4422 -5.3818 -5.3818 -5.3056 -5.3056 -5.3056 -5.3056 -5.2685 -5.2685 -3.3480 -3.3480 -3.2769 -3.2769 -3.2769 -3.2769 -3.2675 -3.2675 -3.2374 -3.2374 -3.2374 -3.2374 -3.1819 -3.1819 -3.1819 -3.1819 -3.1488 -3.1488 0.1572 0.1572 0.1572 0.1572 2.3367 2.3367 3.1986 3.1986 3.3230 3.3230 3.3230 3.3230 3.7367 3.7367 4.6322 4.6322 4.6749 4.6749 4.6749 4.6749 5.5407 5.5407 5.5407 5.5407 5.6002 5.6002 5.7908 5.7908 5.7908 5.7908 7.5753 7.5753 8.0876 8.0876 8.0876 8.0876 8.5184 8.5184 8.5184 8.5184 9.1408 9.1408 9.1617 9.1617 9.1617 9.1617 k = 0.4828-0.3414 0.6124 ( 9116 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8057 -5.8057 -5.6938 -5.6923 -5.6917 -5.6886 -5.6866 -5.6836 -5.4423 -5.4422 -5.4421 -5.4420 -5.3820 -5.3819 -5.3126 -5.3089 -5.3055 -5.2988 -5.2667 -5.2665 -3.3479 -3.3479 -3.2775 -3.2771 -3.2767 -3.2761 -3.2675 -3.2675 -3.2374 -3.2374 -3.2373 -3.2373 -3.1844 -3.1826 -3.1812 -3.1794 -3.1487 -3.1487 0.1585 0.1585 0.1586 0.1586 2.3358 2.3358 3.1990 3.1991 3.3213 3.3233 3.3239 3.3249 3.7332 3.7333 4.6317 4.6322 4.6682 4.6747 4.6770 4.6790 5.5295 5.5370 5.5425 5.5502 5.5996 5.5997 5.7867 5.7888 5.7900 5.7915 7.5764 7.5764 8.0801 8.0872 8.0915 8.0959 8.5133 8.5172 8.5197 8.5241 9.1398 9.1401 9.1615 9.1621 9.1625 9.1640 k = 0.4655-0.3292 0.6124 ( 9116 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8073 -5.8072 -5.6992 -5.6947 -5.6921 -5.6870 -5.6844 -5.6790 -5.4424 -5.4421 -5.4420 -5.4416 -5.3824 -5.3822 -5.3197 -5.3140 -5.3084 -5.2920 -5.2620 -5.2611 -3.3476 -3.3476 -3.2780 -3.2772 -3.2766 -3.2752 -3.2678 -3.2677 -3.2375 -3.2374 -3.2369 -3.2368 -3.1869 -3.1833 -3.1807 -3.1770 -3.1486 -3.1486 0.1623 0.1623 0.1627 0.1627 2.3330 2.3330 3.2002 3.2004 3.3195 3.3248 3.3251 3.3278 3.7229 3.7233 4.6284 4.6322 4.6588 4.6782 4.6794 4.6811 5.5164 5.5309 5.5421 5.5580 5.5984 5.5984 5.7792 5.7843 5.7865 5.7894 7.5797 7.5799 8.0734 8.0901 8.0984 8.1054 8.5075 8.5172 8.5207 8.5308 9.1363 9.1380 9.1610 9.1646 9.1660 9.1691 k = 0.4483-0.3170 0.6124 ( 9136 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8098 -5.8096 -5.7049 -5.6972 -5.6923 -5.6847 -5.6821 -5.6746 -5.4425 -5.4419 -5.4419 -5.4411 -5.3833 -5.3826 -5.3271 -5.3195 -5.3129 -5.2851 -5.2559 -5.2538 -3.3472 -3.3472 -3.2785 -3.2772 -3.2766 -3.2741 -3.2682 -3.2679 -3.2376 -3.2375 -3.2364 -3.2361 -3.1895 -3.1842 -3.1802 -3.1746 -3.1485 -3.1483 0.1686 0.1686 0.1695 0.1696 2.3282 2.3283 3.2018 3.2026 3.3173 3.3251 3.3288 3.3321 3.7068 3.7082 4.6212 4.6313 4.6469 4.6785 4.6851 4.6863 5.5013 5.5215 5.5381 5.5638 5.5972 5.5973 5.7682 5.7776 5.7806 5.7852 7.5851 7.5859 8.0678 8.0958 8.1051 8.1192 8.4998 8.5200 8.5215 8.5384 9.1301 9.1347 9.1598 9.1676 9.1736 9.1775 k = 0.4310-0.3048 0.6124 ( 9154 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8132 -5.8128 -5.7108 -5.6998 -5.6924 -5.6821 -5.6800 -5.6705 -5.4425 -5.4419 -5.4417 -5.4403 -5.3848 -5.3831 -5.3342 -5.3246 -5.3181 -5.2783 -5.2491 -5.2458 -3.3466 -3.3465 -3.2788 -3.2771 -3.2769 -3.2729 -3.2687 -3.2680 -3.2377 -3.2376 -3.2358 -3.2351 -3.1920 -3.1850 -3.1798 -3.1723 -3.1483 -3.1480 0.1774 0.1775 0.1790 0.1791 2.3214 2.3215 3.2034 3.2052 3.3145 3.3242 3.3345 3.3378 3.6864 3.6898 4.6100 4.6281 4.6324 4.6747 4.6915 4.6980 5.4838 5.5081 5.5289 5.5671 5.5964 5.5978 5.7541 5.7696 5.7725 5.7794 7.5927 7.5941 8.0628 8.1044 8.1092 8.1391 8.4895 8.5221 8.5262 8.5472 9.1216 9.1299 9.1584 9.1705 9.1848 9.1891 k = 0.4138-0.2926 0.6124 ( 9156 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8174 -5.8166 -5.7168 -5.7025 -5.6925 -5.6791 -5.6780 -5.6667 -5.4424 -5.4418 -5.4413 -5.4394 -5.3871 -5.3837 -5.3407 -5.3292 -5.3234 -5.2714 -5.2418 -5.2376 -3.3458 -3.3457 -3.2791 -3.2772 -3.2769 -3.2716 -3.2694 -3.2680 -3.2378 -3.2377 -3.2352 -3.2338 -3.1945 -3.1860 -3.1794 -3.1701 -3.1481 -3.1474 0.1887 0.1888 0.1911 0.1912 2.3124 2.3126 3.2044 3.2079 3.3110 3.3217 3.3423 3.3449 3.6637 3.6704 4.5952 4.6158 4.6213 4.6685 4.7000 4.7119 5.4637 5.4902 5.5136 5.5672 5.5962 5.5999 5.7376 5.7614 5.7629 5.7732 7.6025 7.6043 8.0578 8.1102 8.1164 8.1650 8.4764 8.5219 8.5364 8.5574 9.1114 9.1235 9.1572 9.1730 9.1991 9.2035 k = 0.3966-0.2804 0.6124 ( 9168 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8222 -5.8210 -5.7229 -5.7052 -5.6926 -5.6763 -5.6759 -5.6631 -5.4424 -5.4419 -5.4409 -5.4383 -5.3904 -5.3844 -5.3461 -5.3332 -5.3286 -5.2645 -5.2344 -5.2295 -3.3448 -3.3446 -3.2793 -3.2778 -3.2765 -3.2702 -3.2701 -3.2677 -3.2379 -3.2379 -3.2346 -3.2324 -3.1970 -3.1869 -3.1792 -3.1680 -3.1479 -3.1468 0.2025 0.2026 0.2057 0.2059 2.3008 2.3012 3.2041 3.2099 3.3065 3.3173 3.3525 3.3535 3.6409 3.6524 4.5769 4.5974 4.6104 4.6599 4.7103 4.7268 5.4406 5.4680 5.4919 5.5636 5.5958 5.6027 5.7198 5.7519 5.7542 5.7675 7.6143 7.6161 8.0519 8.1079 8.1327 8.1968 8.4604 8.5204 8.5504 8.5695 9.0999 9.1158 9.1566 9.1746 9.2160 9.2201 k = 0.3793-0.2682 0.6124 ( 9168 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8276 -5.8258 -5.7290 -5.7079 -5.6930 -5.6749 -5.6727 -5.6598 -5.4423 -5.4419 -5.4405 -5.4370 -5.3946 -5.3851 -5.3503 -5.3365 -5.3336 -5.2576 -5.2269 -5.2217 -3.3437 -3.3434 -3.2794 -3.2784 -3.2759 -3.2709 -3.2690 -3.2670 -3.2381 -3.2380 -3.2341 -3.2308 -3.1994 -3.1879 -3.1790 -3.1661 -3.1477 -3.1461 0.2187 0.2189 0.2228 0.2230 2.2865 2.2871 3.2015 3.2099 3.3012 3.3112 3.3637 3.3649 3.6201 3.6381 4.5550 4.5778 4.5953 4.6493 4.7216 4.7419 5.4144 5.4421 5.4642 5.5551 5.5943 5.6050 5.7017 5.7401 5.7497 5.7635 7.6282 7.6286 8.0447 8.1023 8.1541 8.2342 8.4416 8.5165 8.5683 8.5839 9.0875 9.1073 9.1565 9.1750 9.2352 9.2386 k = 0.3621-0.2560 0.6124 ( 9164 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8333 -5.8310 -5.7351 -5.7106 -5.6938 -5.6737 -5.6694 -5.6569 -5.4421 -5.4421 -5.4400 -5.4354 -5.3996 -5.3858 -5.3533 -5.3390 -5.3384 -5.2508 -5.2195 -5.2144 -3.3425 -3.3421 -3.2795 -3.2790 -3.2753 -3.2716 -3.2683 -3.2657 -3.2383 -3.2381 -3.2337 -3.2290 -3.2017 -3.1888 -3.1788 -3.1643 -3.1476 -3.1453 0.2372 0.2375 0.2421 0.2424 2.2691 2.2701 3.1955 3.2061 3.2956 3.3046 3.3756 3.3798 3.6034 3.6292 4.5295 4.5573 4.5760 4.6367 4.7332 4.7566 5.3847 5.4133 5.4308 5.5408 5.5907 5.6058 5.6844 5.7276 5.7491 5.7623 7.6412 7.6436 8.0357 8.0936 8.1810 8.2766 8.4200 8.5096 8.5897 8.6010 9.0749 9.0990 9.1567 9.1739 9.2561 9.2583 k = 0.3448-0.2438 0.6124 ( 9166 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8394 -5.8364 -5.7412 -5.7132 -5.6949 -5.6729 -5.6662 -5.6543 -5.4424 -5.4420 -5.4395 -5.4337 -5.4050 -5.3865 -5.3554 -5.3428 -5.3407 -5.2441 -5.2122 -5.2075 -3.3411 -3.3406 -3.2796 -3.2794 -3.2747 -3.2721 -3.2679 -3.2640 -3.2386 -3.2382 -3.2335 -3.2272 -3.2040 -3.1897 -3.1788 -3.1626 -3.1474 -3.1444 0.2582 0.2585 0.2637 0.2640 2.2483 2.2497 3.1852 3.1969 3.2906 3.2995 3.3893 3.3968 3.5919 3.6265 4.5005 4.5359 4.5526 4.6224 4.7447 4.7706 5.3513 5.3828 5.3923 5.5207 5.5844 5.6045 5.6679 5.7145 5.7529 5.7647 7.6532 7.6604 8.0250 8.0822 8.2135 8.3234 8.3960 8.4988 8.6145 8.6212 9.0627 9.0922 9.1567 9.1712 9.2782 9.2789 k = 0.3276-0.2316 0.6124 ( 9158 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8457 -5.8421 -5.7471 -5.7157 -5.6965 -5.6724 -5.6631 -5.6522 -5.4428 -5.4418 -5.4390 -5.4319 -5.4103 -5.3871 -5.3569 -5.3469 -5.3415 -5.2375 -5.2051 -5.2013 -3.3396 -3.3389 -3.2800 -3.2793 -3.2745 -3.2721 -3.2676 -3.2621 -3.2389 -3.2384 -3.2334 -3.2253 -3.2062 -3.1906 -3.1788 -3.1611 -3.1473 -3.1435 0.2814 0.2818 0.2872 0.2875 2.2238 2.2257 3.1705 3.1817 3.2868 3.2971 3.4048 3.4159 3.5863 3.6300 4.4683 4.5137 4.5252 4.6064 4.7557 4.7837 5.3138 5.3492 5.3520 5.4960 5.5751 5.6012 5.6521 5.7009 5.7609 5.7706 7.6642 7.6778 8.0126 8.0684 8.2509 8.3699 8.3736 8.4841 8.6426 8.6449 9.0517 9.0878 9.1564 9.1669 9.3000 9.3010 k = 0.3103-0.2194 0.6124 ( 9162 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8521 -5.8479 -5.7529 -5.7180 -5.6986 -5.6722 -5.6601 -5.6506 -5.4434 -5.4416 -5.4385 -5.4300 -5.4152 -5.3877 -5.3580 -5.3507 -5.3412 -5.2311 -5.1983 -5.1957 -3.3380 -3.3372 -3.2803 -3.2790 -3.2750 -3.2713 -3.2673 -3.2601 -3.2392 -3.2385 -3.2335 -3.2234 -3.2082 -3.1915 -3.1788 -3.1598 -3.1473 -3.1426 0.3069 0.3073 0.3125 0.3130 2.1953 2.1978 3.1524 3.1622 3.2845 3.2974 3.4223 3.4368 3.5864 3.6390 4.4333 4.4906 4.4939 4.5890 4.7661 4.7957 5.2723 5.3021 5.3219 5.4682 5.5630 5.5957 5.6363 5.6869 5.7724 5.7800 7.6738 7.6952 7.9990 8.0528 8.2916 8.3419 8.4258 8.4658 8.6723 8.6742 9.0425 9.0868 9.1555 9.1612 9.3212 9.3242 k = 0.2931-0.2073 0.6124 ( 9162 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8585 -5.8538 -5.7584 -5.7202 -5.7013 -5.6721 -5.6574 -5.6495 -5.4441 -5.4415 -5.4381 -5.4282 -5.4195 -5.3881 -5.3589 -5.3543 -5.3399 -5.2248 -5.1918 -5.1908 -3.3363 -3.3354 -3.2805 -3.2787 -3.2756 -3.2702 -3.2671 -3.2580 -3.2395 -3.2386 -3.2337 -3.2215 -3.2102 -3.1922 -3.1789 -3.1587 -3.1473 -3.1417 0.3345 0.3350 0.3394 0.3400 2.1627 2.1658 3.1323 3.1404 3.2833 3.2995 3.4417 3.4592 3.5919 3.6527 4.3958 4.4591 4.4668 4.5703 4.7759 4.8068 5.2272 5.2516 5.2932 5.4389 5.5485 5.5882 5.6202 5.6723 5.7865 5.7920 7.6820 7.7120 7.9842 8.0356 8.3126 8.3324 8.4456 8.4782 8.7040 8.7100 9.0360 9.0896 9.1546 9.1548 9.3422 9.3473 k = 0.2759-0.1951 0.6124 ( 9160 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8650 -5.8597 -5.7636 -5.7221 -5.7045 -5.6722 -5.6549 -5.6490 -5.4451 -5.4414 -5.4376 -5.4264 -5.4228 -5.3884 -5.3597 -5.3575 -5.3375 -5.2188 -5.1866 -5.1856 -3.3345 -3.3335 -3.2804 -3.2785 -3.2761 -3.2689 -3.2670 -3.2560 -3.2399 -3.2387 -3.2341 -3.2198 -3.2119 -3.1928 -3.1790 -3.1577 -3.1474 -3.1409 0.3643 0.3647 0.3677 0.3686 2.1259 2.1296 3.1121 3.1186 3.2829 3.3025 3.4630 3.4828 3.6021 3.6704 4.3562 4.4211 4.4422 4.5503 4.7850 4.8170 5.1791 5.1985 5.2665 5.4093 5.5320 5.5785 5.6036 5.6574 5.8024 5.8062 7.6886 7.7275 7.9687 8.0173 8.2822 8.3624 8.4335 8.5287 8.7402 8.7505 9.0325 9.0958 9.1489 9.1547 9.3628 9.3702 k = 0.2586-0.1829 0.6124 ( 9156 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8713 -5.8656 -5.7684 -5.7238 -5.7083 -5.6724 -5.6527 -5.6490 -5.4462 -5.4413 -5.4372 -5.4262 -5.4239 -5.3884 -5.3606 -5.3604 -5.3343 -5.2130 -5.1831 -5.1798 -3.3326 -3.3315 -3.2801 -3.2784 -3.2763 -3.2675 -3.2669 -3.2541 -3.2403 -3.2388 -3.2346 -3.2184 -3.2132 -3.1932 -3.1792 -3.1570 -3.1475 -3.1402 0.3960 0.3960 0.3972 0.3987 2.0850 2.0894 3.0929 3.0981 3.2828 3.3057 3.4860 3.5073 3.6167 3.6914 4.3148 4.3804 4.4170 4.5292 4.7934 4.8263 5.1290 5.1432 5.2420 5.3805 5.5136 5.5661 5.5871 5.6423 5.8195 5.8218 7.6937 7.7408 7.9526 7.9982 8.2513 8.3571 8.4533 8.5756 8.7805 8.7959 9.0323 9.1041 9.1451 9.1582 9.3827 9.3926 k = 0.2414-0.1707 0.6124 ( 9152 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8775 -5.8715 -5.7729 -5.7252 -5.7126 -5.6728 -5.6508 -5.6494 -5.4474 -5.4413 -5.4369 -5.4279 -5.4224 -5.3882 -5.3634 -5.3609 -5.3301 -5.2074 -5.1803 -5.1745 -3.3307 -3.3296 -3.2796 -3.2788 -3.2759 -3.2669 -3.2660 -3.2523 -3.2407 -3.2389 -3.2351 -3.2181 -3.2134 -3.1934 -3.1795 -3.1564 -3.1476 -3.1396 0.4272 0.4274 0.4298 0.4317 2.0402 2.0452 3.0757 3.0799 3.2829 3.3088 3.5105 3.5323 3.6351 3.7151 4.2723 4.3377 4.3914 4.5071 4.8009 4.8349 5.0777 5.0866 5.2199 5.3530 5.4937 5.5499 5.5719 5.6270 5.8373 5.8384 7.6973 7.7514 7.9362 7.9787 8.2202 8.3290 8.4922 8.6183 8.8235 8.8442 9.0356 9.1121 9.1457 9.1684 9.4017 9.4145 k = 0.2241-0.1585 0.6124 ( 9140 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8834 -5.8773 -5.7769 -5.7263 -5.7173 -5.6735 -5.6503 -5.6491 -5.4485 -5.4415 -5.4365 -5.4291 -5.4208 -5.3878 -5.3661 -5.3614 -5.3251 -5.2022 -5.1782 -5.1695 -3.3287 -3.3277 -3.2794 -3.2789 -3.2752 -3.2670 -3.2645 -3.2506 -3.2411 -3.2391 -3.2357 -3.2190 -3.2123 -3.1933 -3.1798 -3.1561 -3.1478 -3.1392 0.4582 0.4583 0.4654 0.4672 1.9919 1.9975 3.0611 3.0644 3.2830 3.3114 3.5366 3.5575 3.6570 3.7409 4.2292 4.2936 4.3653 4.4840 4.8070 4.8425 5.0266 5.0295 5.2003 5.3273 5.4724 5.5294 5.5588 5.6117 5.8555 5.8555 7.6995 7.7588 7.9197 7.9590 8.1896 8.2946 8.5342 8.6571 8.8666 8.8902 9.0447 9.1199 9.1532 9.1870 9.4198 9.4361 k = 0.2069-0.1463 0.6124 ( 9146 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8891 -5.8829 -5.7805 -5.7271 -5.7224 -5.6744 -5.6513 -5.6478 -5.4495 -5.4417 -5.4362 -5.4300 -5.4192 -5.3872 -5.3687 -5.3618 -5.3194 -5.1974 -5.1767 -5.1651 -3.3267 -3.3258 -3.2800 -3.2780 -3.2744 -3.2671 -3.2630 -3.2492 -3.2415 -3.2393 -3.2362 -3.2204 -3.2106 -3.1930 -3.1802 -3.1560 -3.1479 -3.1390 0.4891 0.4893 0.5027 0.5047 1.9406 1.9468 3.0492 3.0518 3.2829 3.3135 3.5639 3.5828 3.6819 3.7685 4.1862 4.2489 4.3390 4.4602 4.8103 4.8483 4.9734 4.9776 5.1831 5.3035 5.4499 5.5056 5.5470 5.5967 5.8729 5.8736 7.7003 7.7626 7.9035 7.9395 8.1599 8.2580 8.5763 8.6936 8.9051 8.9240 9.0658 9.1317 9.1689 9.2129 9.4367 9.4574 k = 0.1897-0.1341 0.6124 ( 9142 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8945 -5.8883 -5.7836 -5.7278 -5.7276 -5.6757 -5.6524 -5.6467 -5.4502 -5.4421 -5.4359 -5.4306 -5.4176 -5.3863 -5.3712 -5.3622 -5.3130 -5.1933 -5.1755 -5.1611 -3.3247 -3.3240 -3.2806 -3.2770 -3.2733 -3.2673 -3.2615 -3.2480 -3.2418 -3.2397 -3.2366 -3.2219 -3.2089 -3.1923 -3.1806 -3.1560 -3.1481 -3.1389 0.5198 0.5201 0.5416 0.5438 1.8868 1.8935 3.0400 3.0420 3.2825 3.3148 3.5923 3.6082 3.7094 3.7974 4.1441 4.2042 4.3126 4.4358 4.8072 4.8486 4.9228 4.9353 5.1683 5.2817 5.4265 5.4796 5.5361 5.5821 5.8901 5.8914 7.6999 7.7628 7.8876 7.9203 8.1316 8.2207 8.6180 8.7292 8.9343 8.9386 9.1035 9.1518 9.1929 9.2439 9.4524 9.4789 k = 0.1724-0.1219 0.6124 ( 9128 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8996 -5.8936 -5.7861 -5.7334 -5.7277 -5.6774 -5.6533 -5.6459 -5.4508 -5.4425 -5.4355 -5.4309 -5.4161 -5.3852 -5.3735 -5.3626 -5.3060 -5.1901 -5.1744 -5.1576 -3.3228 -3.3223 -3.2811 -3.2759 -3.2722 -3.2676 -3.2601 -3.2472 -3.2421 -3.2403 -3.2367 -3.2234 -3.2070 -3.1914 -3.1811 -3.1563 -3.1483 -3.1390 0.5499 0.5502 0.5820 0.5844 1.8312 1.8382 3.0333 3.0347 3.2819 3.3152 3.6216 3.6336 3.7388 3.8271 4.1035 4.1604 4.2864 4.4108 4.7904 4.8271 4.8945 4.9072 5.1559 5.2621 5.4024 5.4520 5.5259 5.5680 5.9070 5.9086 7.6983 7.7596 7.8723 7.9016 8.1051 8.1841 8.6591 8.7653 8.9388 8.9522 9.1510 9.1814 9.2241 9.2784 9.4668 9.5010 k = 0.1552-0.1097 0.6124 ( 9120 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9042 -5.8985 -5.7882 -5.7390 -5.7275 -5.6797 -5.6540 -5.6454 -5.4511 -5.4431 -5.4351 -5.4311 -5.4145 -5.3840 -5.3758 -5.3631 -5.2985 -5.1885 -5.1729 -5.1546 -3.3209 -3.3207 -3.2815 -3.2748 -3.2711 -3.2679 -3.2587 -3.2467 -3.2423 -3.2410 -3.2367 -3.2248 -3.2051 -3.1902 -3.1817 -3.1569 -3.1484 -3.1393 0.5791 0.5794 0.6235 0.6262 1.7745 1.7818 3.0288 3.0298 3.2810 3.3147 3.6515 3.6590 3.7697 3.8571 4.0653 4.1182 4.2607 4.3854 4.7569 4.7806 4.8923 4.8970 5.1455 5.2444 5.3779 5.4232 5.5164 5.5546 5.9231 5.9250 7.6957 7.7535 7.8578 7.8835 8.0808 8.1489 8.6993 8.8025 8.9322 8.9614 9.1991 9.2165 9.2612 9.3150 9.4800 9.5243 k = 0.1379-0.0975 0.6124 ( 9124 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9084 -5.9031 -5.7897 -5.7446 -5.7269 -5.6824 -5.6543 -5.6452 -5.4512 -5.4437 -5.4348 -5.4312 -5.4129 -5.3828 -5.3780 -5.3635 -5.2907 -5.1886 -5.1706 -5.1522 -3.3192 -3.3191 -3.2819 -3.2738 -3.2699 -3.2681 -3.2574 -3.2466 -3.2423 -3.2417 -3.2366 -3.2262 -3.2032 -3.1888 -3.1823 -3.1576 -3.1485 -3.1398 0.6068 0.6070 0.6660 0.6690 1.7174 1.7248 3.0262 3.0267 3.2799 3.3132 3.6817 3.6847 3.8013 3.8867 4.0302 4.0782 4.2360 4.3600 4.7136 4.7280 4.8979 4.8984 5.1372 5.2287 5.3535 5.3938 5.5078 5.5420 5.9383 5.9404 7.6923 7.7452 7.8442 7.8662 8.0588 8.1160 8.7378 8.8404 8.9237 8.9667 9.2433 9.2513 9.3013 9.3522 9.4923 9.5495 k = 0.1207-0.0853 0.6124 ( 9142 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9122 -5.9073 -5.7906 -5.7502 -5.7260 -5.6855 -5.6543 -5.6452 -5.4512 -5.4443 -5.4344 -5.4313 -5.4112 -5.3821 -5.3796 -5.3641 -5.2827 -5.1903 -5.1677 -5.1502 -3.3178 -3.3174 -3.2820 -3.2732 -3.2686 -3.2680 -3.2563 -3.2468 -3.2424 -3.2424 -3.2364 -3.2275 -3.2012 -3.1871 -3.1829 -3.1586 -3.1486 -3.1404 0.6326 0.6328 0.7091 0.7123 1.6606 1.6680 3.0250 3.0252 3.2786 3.3108 3.7104 3.7118 3.8329 3.9148 3.9989 4.0411 4.2133 4.3348 4.6670 4.6754 4.9050 4.9056 5.1309 5.2147 5.3297 5.3644 5.5002 5.5303 5.9524 5.9545 7.6885 7.7353 7.8317 7.8500 8.0393 8.0859 8.7729 8.8750 8.9195 8.9731 9.2812 9.2817 9.3406 9.3883 9.5047 9.5770 k = 0.1034-0.0731 0.6124 ( 9134 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9154 -5.9111 -5.7910 -5.7557 -5.7247 -5.6889 -5.6540 -5.6453 -5.4510 -5.4450 -5.4340 -5.4313 -5.4094 -5.3834 -5.3790 -5.3647 -5.2744 -5.1932 -5.1646 -5.1488 -3.3165 -3.3160 -3.2821 -3.2731 -3.2676 -3.2674 -3.2553 -3.2472 -3.2431 -3.2424 -3.2361 -3.2287 -3.1993 -3.1852 -3.1837 -3.1598 -3.1486 -3.1412 0.6561 0.6563 0.7521 0.7555 1.6051 1.6122 3.0248 3.0249 3.2775 3.3074 3.7362 3.7414 3.8634 3.9395 3.9725 4.0075 4.1940 4.3103 4.6204 4.6246 4.9141 4.9142 5.1264 5.2024 5.3069 5.3357 5.4937 5.5197 5.9651 5.9671 7.6845 7.7247 7.8204 7.8350 8.0225 8.0592 8.8021 8.8868 8.9401 8.9848 9.3034 9.3125 9.3757 9.4215 9.5189 9.6065 k = 0.0862-0.0610 0.6124 ( 9136 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9181 -5.9144 -5.7908 -5.7609 -5.7231 -5.6925 -5.6536 -5.6457 -5.4507 -5.4456 -5.4337 -5.4314 -5.4076 -5.3855 -5.3777 -5.3654 -5.2661 -5.1970 -5.1616 -5.1478 -3.3154 -3.3147 -3.2819 -3.2736 -3.2668 -3.2662 -3.2544 -3.2477 -3.2436 -3.2426 -3.2357 -3.2298 -3.1974 -3.1845 -3.1832 -3.1612 -3.1485 -3.1420 0.6769 0.6770 0.7945 0.7980 1.5519 1.5586 3.0252 3.0256 3.2765 3.3034 3.7618 3.7697 3.8914 3.9469 3.9631 3.9783 4.1802 4.2874 4.5755 4.5767 4.9231 4.9241 5.1238 5.1914 5.2857 5.3082 5.4883 5.5101 5.9762 5.9781 7.6808 7.7141 7.8105 7.8216 8.0083 8.0361 8.8230 8.8810 8.9799 9.0049 9.3166 9.3322 9.4058 9.4499 9.5368 9.6367 k = 0.0690-0.0488 0.6124 ( 9132 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9203 -5.9173 -5.7901 -5.7658 -5.7211 -5.6962 -5.6529 -5.6463 -5.4504 -5.4463 -5.4333 -5.4315 -5.4056 -5.3878 -5.3762 -5.3662 -5.2579 -5.2017 -5.1587 -5.1473 -3.3144 -3.3136 -3.2816 -3.2743 -3.2658 -3.2652 -3.2537 -3.2483 -3.2440 -3.2428 -3.2353 -3.2307 -3.1956 -3.1854 -3.1809 -3.1628 -3.1482 -3.1429 0.6945 0.6946 0.8349 0.8384 1.5024 1.5086 3.0260 3.0265 3.2760 3.2988 3.7871 3.7958 3.9133 3.9315 3.9559 3.9742 4.1743 4.2668 4.5328 4.5336 4.9319 4.9340 5.1233 5.1815 5.2669 5.2831 5.4842 5.5018 5.9856 5.9872 7.6776 7.7041 7.8020 7.8101 7.9969 8.0171 8.8357 8.8732 9.0231 9.0336 9.3206 9.3379 9.4320 9.4722 9.5593 9.6649 k = 0.0517-0.0366 0.6124 ( 9138 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9219 -5.9196 -5.7888 -5.7704 -5.7188 -5.6999 -5.6521 -5.6469 -5.4501 -5.4469 -5.4330 -5.4316 -5.4035 -5.3901 -5.3747 -5.3671 -5.2497 -5.2071 -5.1560 -5.1473 -3.3135 -3.3129 -3.2810 -3.2753 -3.2649 -3.2643 -3.2531 -3.2490 -3.2442 -3.2431 -3.2348 -3.2315 -3.1939 -3.1863 -3.1786 -3.1647 -3.1479 -3.1438 0.7086 0.7087 0.8717 0.8748 1.4588 1.4641 3.0271 3.0276 3.2761 3.2940 3.8114 3.8183 3.9167 3.9197 3.9514 3.9781 4.1775 4.2495 4.4945 4.4963 4.9401 4.9428 5.1249 5.1723 5.2511 5.2613 5.4815 5.4947 5.9932 5.9944 7.6755 7.6951 7.7953 7.8008 7.9882 8.0020 8.8425 8.8659 9.0656 9.0676 9.3161 9.3304 9.4547 9.4877 9.5854 9.6864 k = 0.0345-0.0244 0.6124 ( 9136 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9230 -5.9214 -5.7870 -5.7747 -5.7163 -5.7035 -5.6513 -5.6477 -5.4496 -5.4475 -5.4327 -5.4318 -5.4014 -5.3923 -5.3732 -5.3682 -5.2417 -5.2130 -5.1536 -5.1478 -3.3129 -3.3124 -3.2803 -3.2763 -3.2642 -3.2637 -3.2525 -3.2497 -3.2443 -3.2435 -3.2343 -3.2322 -3.1924 -3.1873 -3.1762 -3.1667 -3.1475 -3.1447 0.7189 0.7190 0.9023 0.9047 1.4239 1.4278 3.0280 3.0284 3.2770 3.2894 3.8335 3.8362 3.9049 3.9116 3.9608 3.9760 4.1880 4.2359 4.4639 4.4658 4.9470 4.9497 5.1290 5.1630 5.2391 5.2445 5.4801 5.4890 5.9987 5.9996 7.6746 7.6875 7.7904 7.7938 7.9823 7.9908 8.8462 8.8598 9.1024 9.1042 9.3052 9.3142 9.4731 9.4963 9.6135 9.6947 k = 0.0172-0.0122 0.6124 ( 9130 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9234 -5.9226 -5.7847 -5.7785 -5.7134 -5.7070 -5.6504 -5.6485 -5.4492 -5.4481 -5.4324 -5.4319 -5.3992 -5.3946 -5.3718 -5.3693 -5.2339 -5.2196 -5.1516 -5.1486 -3.3124 -3.3121 -3.2794 -3.2774 -3.2636 -3.2633 -3.2519 -3.2505 -3.2443 -3.2438 -3.2339 -3.2328 -3.1910 -3.1884 -3.1737 -3.1690 -3.1469 -3.1455 0.7252 0.7253 0.9232 0.9246 1.4010 1.4031 3.0287 3.0290 3.2788 3.2851 3.8487 3.8501 3.8960 3.9042 3.9674 3.9725 4.2014 4.2249 4.4437 4.4449 4.9521 4.9537 5.1354 5.1534 5.2316 5.2337 5.4802 5.4846 6.0022 6.0026 7.6752 7.6816 7.7877 7.7893 7.9795 7.9835 8.8488 8.8551 9.1314 9.1335 9.2925 9.2964 9.4867 9.4986 9.6417 9.6870 k = 0.0000 0.0000 0.6124 ( 9128 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9233 -5.9233 -5.7818 -5.7818 -5.7103 -5.7103 -5.6494 -5.6494 -5.4486 -5.4486 -5.4322 -5.4322 -5.3969 -5.3969 -5.3705 -5.3705 -5.2265 -5.2265 -5.1499 -5.1499 -3.3121 -3.3121 -3.2784 -3.2784 -3.2633 -3.2633 -3.2512 -3.2512 -3.2441 -3.2441 -3.2333 -3.2333 -3.1896 -3.1896 -3.1713 -3.1713 -3.1463 -3.1463 0.7273 0.7273 0.9312 0.9312 1.3937 1.3937 3.0291 3.0291 3.2815 3.2815 3.8550 3.8550 3.8968 3.8968 3.9703 3.9703 4.2141 4.2141 4.4370 4.4370 4.9545 4.9545 5.1439 5.1439 5.2295 5.2295 5.4817 5.4817 6.0035 6.0035 7.6775 7.6775 7.7873 7.7873 7.9798 7.9798 8.8515 8.8515 9.1444 9.1444 9.2871 9.2871 9.4953 9.4953 9.6675 9.6675 k = 0.0000 0.0000 0.6124 ( 9128 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9233 -5.9233 -5.7818 -5.7818 -5.7103 -5.7103 -5.6494 -5.6494 -5.4486 -5.4486 -5.4322 -5.4322 -5.3969 -5.3969 -5.3705 -5.3705 -5.2265 -5.2265 -5.1499 -5.1499 -3.3121 -3.3121 -3.2784 -3.2784 -3.2633 -3.2633 -3.2512 -3.2512 -3.2441 -3.2441 -3.2333 -3.2333 -3.1896 -3.1896 -3.1713 -3.1713 -3.1463 -3.1463 0.7273 0.7273 0.9312 0.9312 1.3937 1.3937 3.0291 3.0291 3.2815 3.2815 3.8550 3.8550 3.8968 3.8968 3.9703 3.9703 4.2141 4.2141 4.4370 4.4370 4.9545 4.9545 5.1439 5.1439 5.2295 5.2295 5.4817 5.4817 6.0035 6.0035 7.6775 7.6775 7.7873 7.7873 7.9798 7.9798 8.8515 8.8515 9.1444 9.1444 9.2871 9.2871 9.4953 9.4953 9.6675 9.6675 k = 0.0000 0.0000 0.5913 ( 9142 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9272 -5.9219 -5.7882 -5.7744 -5.7109 -5.7099 -5.6567 -5.6422 -5.4493 -5.4481 -5.4340 -5.4303 -5.3974 -5.3966 -5.3789 -5.3611 -5.2307 -5.2223 -5.1548 -5.1448 -3.3123 -3.3120 -3.2796 -3.2777 -3.2637 -3.2635 -3.2516 -3.2501 -3.2443 -3.2434 -3.2340 -3.2325 -3.1914 -3.1878 -3.1715 -3.1710 -3.1467 -3.1457 0.7287 0.7290 0.9322 0.9328 1.3934 1.3947 3.0297 3.0311 3.2807 3.2818 3.8516 3.8578 3.8911 3.8984 3.9634 3.9819 4.2125 4.2170 4.4358 4.4365 4.9514 4.9514 5.1020 5.1497 5.2159 5.2708 5.4775 5.4786 5.9917 6.0064 7.6634 7.6956 7.7861 7.7934 7.9773 7.9822 8.8476 8.8543 9.1136 9.1825 9.2770 9.3006 9.4920 9.5010 9.6505 9.6863 k = 0.0000 0.0000 0.5701 ( 9144 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9331 -5.9231 -5.7930 -5.7663 -5.7116 -5.7097 -5.6637 -5.6350 -5.4500 -5.4476 -5.4358 -5.4285 -5.3978 -5.3975 -5.3853 -5.3510 -5.2347 -5.2179 -5.1593 -5.1394 -3.3126 -3.3118 -3.2810 -3.2777 -3.2644 -3.2640 -3.2515 -3.2485 -3.2438 -3.2424 -3.2344 -3.2316 -3.1931 -3.1860 -3.1717 -3.1706 -3.1471 -3.1451 0.7330 0.7335 0.9357 0.9368 1.3939 1.3965 3.0329 3.0356 3.2792 3.2813 3.8447 3.8614 3.8872 3.8918 3.9641 3.9951 4.2123 4.2212 4.4328 4.4343 4.9415 4.9417 5.0538 5.1058 5.2449 5.3092 5.4673 5.4677 5.9712 6.0003 7.6546 7.7155 7.7888 7.8059 7.9751 7.9846 8.8429 8.8554 9.0909 9.2257 9.2697 9.3181 9.4942 9.5060 9.6341 9.7089 k = 0.0000 0.0000 0.5490 ( 9138 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9407 -5.9272 -5.7961 -5.7580 -5.7124 -5.7097 -5.6705 -5.6279 -5.4507 -5.4472 -5.4376 -5.4267 -5.4013 -5.3980 -5.3875 -5.3405 -5.2385 -5.2136 -5.1633 -5.1339 -3.3128 -3.3117 -3.2824 -3.2786 -3.2659 -3.2638 -3.2512 -3.2469 -3.2426 -3.2409 -3.2346 -3.2304 -3.1948 -3.1842 -3.1719 -3.1702 -3.1473 -3.1445 0.7403 0.7410 0.9416 0.9433 1.3951 1.3991 3.0386 3.0427 3.2772 3.2803 3.8329 3.8655 3.8792 3.8882 3.9703 4.0080 4.2136 4.2266 4.4280 4.4304 4.9228 4.9231 5.0056 5.0549 5.2766 5.3373 5.4491 5.4541 5.9425 5.9854 7.6523 7.7354 7.7946 7.8263 7.9737 7.9877 8.8379 8.8545 9.0759 9.2647 9.2687 9.3403 9.5052 9.5073 9.6180 9.7373 k = 0.0000 0.0000 0.5279 ( 9125 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9497 -5.9340 -5.7975 -5.7499 -5.7132 -5.7099 -5.6771 -5.6212 -5.4514 -5.4470 -5.4393 -5.4252 -5.4070 -5.3982 -5.3865 -5.3296 -5.2420 -5.2093 -5.1668 -5.1284 -3.3131 -3.3117 -3.2840 -3.2802 -3.2676 -3.2630 -3.2512 -3.2455 -3.2408 -3.2392 -3.2346 -3.2292 -3.1963 -3.1824 -3.1721 -3.1697 -3.1475 -3.1438 0.7505 0.7515 0.9500 0.9522 1.3971 1.4024 3.0469 3.0523 3.2748 3.2789 3.8175 3.8580 3.8762 3.8933 3.9787 4.0199 4.2163 4.2330 4.4214 4.4247 4.8910 4.8916 4.9637 5.0087 5.3035 5.3468 5.4229 5.4457 5.9064 5.9621 7.6570 7.7544 7.8033 7.8547 7.9739 7.9921 8.8320 8.8516 9.0685 9.2615 9.3042 9.3667 9.5028 9.5301 9.6033 9.7724 k = 0.0000 0.0000 0.5068 ( 9135 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9597 -5.9432 -5.7974 -5.7423 -5.7139 -5.7103 -5.6832 -5.6149 -5.4521 -5.4469 -5.4410 -5.4245 -5.4121 -5.3982 -5.3841 -5.3185 -5.2450 -5.2050 -5.1698 -5.1231 -3.3133 -3.3116 -3.2855 -3.2824 -3.2692 -3.2617 -3.2513 -3.2443 -3.2389 -3.2371 -3.2339 -3.2278 -3.1977 -3.1807 -3.1723 -3.1691 -3.1476 -3.1431 0.7636 0.7648 0.9608 0.9635 1.3999 1.4064 3.0576 3.0642 3.2723 3.2771 3.8001 3.8393 3.8840 3.9012 3.9874 4.0305 4.2204 4.2403 4.4127 4.4173 4.8438 4.8456 4.9306 4.9714 5.3238 5.3311 5.3904 5.4483 5.8637 5.9310 7.6692 7.7729 7.8144 7.8900 7.9766 7.9988 8.8245 8.8464 9.0687 9.2593 9.3276 9.3918 9.4919 9.5721 9.5931 9.8139 k = 0.0000 0.0000 0.4857 ( 9131 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9707 -5.9542 -5.7962 -5.7358 -5.7142 -5.7110 -5.6890 -5.6092 -5.4528 -5.4470 -5.4426 -5.4258 -5.4149 -5.3981 -5.3809 -5.3072 -5.2476 -5.2007 -5.1721 -5.1179 -3.3136 -3.3117 -3.2872 -3.2848 -3.2706 -3.2602 -3.2514 -3.2432 -3.2376 -3.2349 -3.2324 -3.2263 -3.1989 -3.1790 -3.1725 -3.1684 -3.1476 -3.1423 0.7795 0.7809 0.9739 0.9772 1.4033 1.4110 3.0706 3.0785 3.2699 3.2754 3.7817 3.8191 3.8940 3.9109 3.9954 4.0396 4.2255 4.2483 4.4020 4.4082 4.7879 4.7881 4.9008 4.9408 5.2966 5.3282 5.3607 5.4560 5.8155 5.8930 7.6886 7.7918 7.8279 7.9300 7.9831 8.0090 8.8141 8.8388 9.0762 9.2575 9.3373 9.4128 9.4751 9.5856 9.6333 9.8603 k = 0.0000 0.0000 0.4646 ( 9133 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9823 -5.9666 -5.7941 -5.7309 -5.7134 -5.7119 -5.6942 -5.6044 -5.4534 -5.4473 -5.4441 -5.4294 -5.4148 -5.3979 -5.3769 -5.2959 -5.2495 -5.1966 -5.1739 -5.1131 -3.3139 -3.3117 -3.2888 -3.2873 -3.2716 -3.2585 -3.2515 -3.2422 -3.2369 -3.2326 -3.2299 -3.2247 -3.2000 -3.1773 -3.1728 -3.1676 -3.1474 -3.1416 0.7982 0.7998 0.9893 0.9932 1.4074 1.4162 3.0859 3.0948 3.2679 3.2737 3.7628 3.7982 3.9054 3.9215 4.0024 4.0474 4.2316 4.2566 4.3891 4.3972 4.7244 4.7285 4.8701 4.9126 5.2511 5.2918 5.3593 5.4617 5.7630 5.8492 7.7147 7.8117 7.8441 7.9695 7.9979 8.0233 8.8003 8.8287 9.0908 9.2550 9.3311 9.4326 9.4538 9.5891 9.6974 9.8980 k = 0.0000 0.0000 0.4434 ( 9133 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9945 -5.9800 -5.7915 -5.7285 -5.7132 -5.7111 -5.6988 -5.6005 -5.4540 -5.4477 -5.4456 -5.4337 -5.4134 -5.3977 -5.3722 -5.2846 -5.2507 -5.1925 -5.1752 -5.1086 -3.3143 -3.3118 -3.2906 -3.2899 -3.2722 -3.2569 -3.2516 -3.2412 -3.2366 -3.2303 -3.2271 -3.2231 -3.2009 -3.1757 -3.1730 -3.1667 -3.1472 -3.1408 0.8196 0.8213 1.0069 1.0114 1.4121 1.4220 3.1032 3.1131 3.2663 3.2725 3.7438 3.7773 3.9179 3.9326 4.0082 4.0541 4.2380 4.2649 4.3740 4.3843 4.6579 4.6681 4.8366 4.8841 5.1982 5.2392 5.3625 5.4630 5.7074 5.8007 7.7462 7.8329 7.8631 7.9942 8.0342 8.0424 8.7828 8.8159 9.1112 9.2503 9.3099 9.4300 9.4532 9.6007 9.7553 9.9381 k = 0.0000 0.0000 0.4223 ( 9127 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0070 -5.9939 -5.7885 -5.7280 -5.7149 -5.7075 -5.7027 -5.5977 -5.4546 -5.4484 -5.4470 -5.4378 -5.4116 -5.3975 -5.3669 -5.2734 -5.2512 -5.1886 -5.1759 -5.1047 -3.3146 -3.3120 -3.2925 -3.2925 -3.2723 -3.2554 -3.2515 -3.2402 -3.2363 -3.2281 -3.2241 -3.2214 -3.2015 -3.1743 -3.1733 -3.1657 -3.1469 -3.1402 0.8435 0.8453 1.0266 1.0317 1.4174 1.4283 3.1225 3.1332 3.2656 3.2720 3.7251 3.7565 3.9310 3.9433 4.0126 4.0602 4.2446 4.2726 4.3568 4.3696 4.5904 4.6081 4.7999 4.8541 5.1400 5.1797 5.3621 5.4594 5.6503 5.7489 7.7815 7.8555 7.8854 8.0123 8.0669 8.0831 8.7620 8.8004 9.1362 9.2410 9.2773 9.4069 9.4739 9.6191 9.7998 10.0017 k = 0.0000 0.0000 0.4012 ( 9137 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0198 -6.0083 -5.7853 -5.7288 -5.7172 -5.7056 -5.7034 -5.5961 -5.4552 -5.4492 -5.4483 -5.4415 -5.4097 -5.3972 -5.3610 -5.2625 -5.2509 -5.1848 -5.1760 -5.1013 -3.3149 -3.3122 -3.2950 -3.2944 -3.2719 -3.2539 -3.2514 -3.2391 -3.2361 -3.2260 -3.2211 -3.2197 -3.2019 -3.1736 -3.1729 -3.1647 -3.1465 -3.1395 0.8698 0.8718 1.0483 1.0540 1.4232 1.4350 3.1434 3.1547 3.2659 3.2723 3.7067 3.7361 3.9444 3.9531 4.0155 4.0662 4.2506 4.2785 4.3382 4.3530 4.5232 4.5498 4.7597 4.8219 5.0774 5.1149 5.3576 5.4511 5.5931 5.6951 7.8187 7.8793 7.9116 8.0321 8.0968 8.1350 8.7384 8.7824 9.1637 9.2247 9.2367 9.3886 9.4939 9.6426 9.8344 10.0565 k = 0.0000 0.0000 0.3801 ( 9133 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.0327 -6.0227 -5.7819 -5.7301 -5.7200 -5.7078 -5.6996 -5.5956 -5.4557 -5.4501 -5.4495 -5.4446 -5.4077 -5.3968 -5.3543 -5.2518 -5.2498 -5.1812 -5.1757 -5.0984 -3.3153 -3.3125 -3.2974 -3.2964 -3.2711 -3.2526 -3.2512 -3.2380 -3.2358 -3.2241 -3.2183 -3.2179 -3.2021 -3.1739 -3.1717 -3.1636 -3.1461 -3.1390 0.8983 0.9004 1.0719 1.0782 1.4295 1.4421 3.1658 3.1775 3.2674 3.2737 3.6890 3.7164 3.9577 3.9612 4.0169 4.0725 4.2557 4.2790 4.3214 4.3348 4.4570 4.4939 4.7161 4.7874 5.0116 5.0458 5.3495 5.4389 5.5373 5.6409 7.8556 7.9043 7.9420 8.0545 8.1322 8.1877 8.7127 8.7622 9.1830 9.1903 9.2086 9.3784 9.5130 9.6696 9.8652 10.0998 k = 0.0000 0.0000 0.3590 ( 9145 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.0456 -6.0371 -5.7785 -5.7317 -5.7230 -5.7093 -5.6962 -5.5964 -5.4562 -5.4511 -5.4507 -5.4473 -5.4058 -5.3965 -5.3471 -5.2478 -5.2415 -5.1777 -5.1749 -5.0963 -3.3156 -3.3128 -3.2997 -3.2983 -3.2697 -3.2515 -3.2508 -3.2368 -3.2355 -3.2224 -3.2160 -3.2156 -3.2020 -3.1742 -3.1706 -3.1624 -3.1455 -3.1385 0.9289 0.9310 1.0973 1.1041 1.4362 1.4494 3.1894 3.2011 3.2704 3.2764 3.6721 3.6974 3.9671 3.9705 4.0165 4.0797 4.2589 4.2661 4.3139 4.3151 4.3925 4.4415 4.6693 4.7504 4.9432 4.9730 5.3384 5.4235 5.4844 5.5876 7.8908 7.9302 7.9764 8.0795 8.1727 8.2398 8.6854 8.7399 9.1399 9.1551 9.2311 9.3771 9.5315 9.6989 9.8954 10.1383 k = 0.0000 0.0000 0.3379 ( 9145 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.0584 -6.0512 -5.7750 -5.7334 -5.7261 -5.7104 -5.6932 -5.5984 -5.4567 -5.4521 -5.4518 -5.4495 -5.4040 -5.3962 -5.3392 -5.2452 -5.2317 -5.1744 -5.1738 -5.0949 -3.3159 -3.3131 -3.3019 -3.3003 -3.2679 -3.2506 -3.2505 -3.2355 -3.2352 -3.2209 -3.2142 -3.2131 -3.2015 -3.1746 -3.1697 -3.1612 -3.1449 -3.1382 0.9614 0.9634 1.1243 1.1317 1.4432 1.4570 3.2139 3.2252 3.2752 3.2806 3.6562 3.6794 3.9704 3.9821 4.0140 4.0877 4.2413 4.2585 4.2947 4.3147 4.3311 4.3929 4.6198 4.7109 4.8730 4.8975 5.3248 5.4058 5.4355 5.5365 7.9241 7.9570 8.0139 8.1065 8.2172 8.2900 8.6573 8.7161 9.0867 9.1120 9.2614 9.3841 9.5503 9.7296 9.9262 10.1716 k = 0.0000 0.0000 0.3167 ( 9149 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.0710 -6.0650 -5.7715 -5.7352 -5.7290 -5.7111 -5.6909 -5.6014 -5.4571 -5.4532 -5.4529 -5.4512 -5.4022 -5.3958 -5.3308 -5.2418 -5.2223 -5.1723 -5.1713 -5.0942 -3.3162 -3.3135 -3.3040 -3.3022 -3.2657 -3.2500 -3.2498 -3.2348 -3.2341 -3.2196 -3.2123 -3.2108 -3.2008 -3.1749 -3.1690 -3.1601 -3.1443 -3.1379 0.9953 0.9973 1.1528 1.1607 1.4504 1.4646 3.2390 3.2490 3.2821 3.2864 3.6415 3.6626 3.9708 3.9917 4.0089 4.0963 4.2118 4.2475 4.2678 4.2858 4.3173 4.3483 4.5683 4.6691 4.8019 4.8202 5.3094 5.3865 5.3918 5.4886 7.9558 7.9843 8.0529 8.1350 8.2641 8.3372 8.6289 8.6912 9.0319 9.0636 9.2915 9.3987 9.5700 9.7605 9.9578 10.1998 k = 0.0000 0.0000 0.2956 ( 9153 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.0832 -6.0783 -5.7679 -5.7370 -5.7318 -5.7117 -5.6891 -5.6054 -5.4575 -5.4543 -5.4538 -5.4526 -5.4007 -5.3955 -5.3219 -5.2379 -5.2135 -5.1705 -5.1685 -5.0943 -3.3166 -3.3139 -3.3059 -3.3040 -3.2632 -3.2496 -3.2492 -3.2344 -3.2327 -3.2185 -3.2104 -3.2088 -3.1998 -3.1753 -3.1684 -3.1589 -3.1436 -3.1378 1.0304 1.0323 1.1825 1.1910 1.4578 1.4723 3.2642 3.2710 3.2925 3.2941 3.6280 3.6470 3.9686 3.9969 4.0019 4.1045 4.1822 4.2061 4.2371 4.2747 4.3058 4.3206 4.5153 4.6251 4.7308 4.7427 5.2926 5.3538 5.3661 5.4446 7.9867 8.0121 8.0920 8.1646 8.3113 8.3800 8.6011 8.6657 8.9764 9.0124 9.3204 9.4201 9.5913 9.7909 9.9903 10.2236 k = 0.0000 0.0000 0.2745 ( 9141 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.0950 -6.0911 -5.7643 -5.7388 -5.7343 -5.7119 -5.6877 -5.6103 -5.4579 -5.4553 -5.4547 -5.4538 -5.3992 -5.3952 -5.3124 -5.2334 -5.2053 -5.1685 -5.1658 -5.0951 -3.3169 -3.3144 -3.3077 -3.3058 -3.2603 -3.2491 -3.2487 -3.2338 -3.2313 -3.2175 -3.2087 -3.2071 -3.1985 -3.1756 -3.1681 -3.1579 -3.1428 -3.1377 1.0663 1.0680 1.2134 1.2224 1.4653 1.4798 3.2889 3.2889 3.3040 3.3085 3.6159 3.6328 3.9639 3.9863 4.0020 4.1089 4.1560 4.1571 4.2126 4.2675 4.2678 4.3212 4.4616 4.5787 4.6613 4.6672 5.2749 5.3220 5.3454 5.4051 8.0171 8.0401 8.1305 8.1946 8.3560 8.4174 8.5750 8.6402 8.9212 8.9601 9.3490 9.4476 9.6146 9.8199 10.0239 10.2439 k = 0.0000 0.0000 0.2534 ( 9143 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.1063 -6.1032 -5.7606 -5.7405 -5.7366 -5.7120 -5.6869 -5.6158 -5.4583 -5.4562 -5.4555 -5.4548 -5.3980 -5.3949 -5.3025 -5.2286 -5.1978 -5.1664 -5.1634 -5.0968 -3.3172 -3.3148 -3.3094 -3.3074 -3.2572 -3.2486 -3.2484 -3.2331 -3.2298 -3.2167 -3.2069 -3.2056 -3.1970 -3.1759 -3.1679 -3.1571 -3.1420 -3.1378 1.1026 1.1041 1.2451 1.2546 1.4729 1.4873 3.3034 3.3108 3.3181 3.3287 3.6051 3.6200 3.9567 3.9680 3.9992 4.0886 4.1328 4.1356 4.1887 4.2307 4.2586 4.3205 4.4076 4.5286 4.5951 4.5979 5.2570 5.2959 5.3247 5.3703 8.0472 8.0681 8.1677 8.2246 8.3944 8.4482 8.5527 8.6154 8.8672 8.9078 9.3784 9.4798 9.6399 9.8468 10.0588 10.2617 k = 0.0000 0.0000 0.2323 ( 9143 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.1170 -6.1146 -5.7570 -5.7422 -5.7386 -5.7119 -5.6865 -5.6219 -5.4586 -5.4570 -5.4563 -5.4557 -5.3969 -5.3946 -5.2923 -5.2235 -5.1910 -5.1641 -5.1613 -5.0993 -3.3174 -3.3152 -3.3109 -3.3090 -3.2539 -3.2482 -3.2481 -3.2322 -3.2283 -3.2161 -3.2053 -3.2043 -3.1954 -3.1762 -3.1678 -3.1566 -3.1412 -3.1378 1.1388 1.1400 1.2775 1.2872 1.4803 1.4944 3.3179 3.3264 3.3396 3.3498 3.5955 3.6086 3.9444 3.9470 3.9907 4.0453 4.1208 4.1287 4.1696 4.1962 4.2440 4.3181 4.3538 4.4742 4.5345 4.5394 5.2398 5.2746 5.3045 5.3401 8.0770 8.0957 8.2030 8.2540 8.4211 8.4712 8.5384 8.5924 8.8153 8.8565 9.4102 9.5153 9.6669 9.8708 10.0953 10.2779 k = 0.0000 0.0000 0.2112 ( 9139 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.1270 -6.1252 -5.7534 -5.7438 -5.7401 -5.7115 -5.6865 -5.6285 -5.4589 -5.4576 -5.4570 -5.4564 -5.3960 -5.3943 -5.2817 -5.2182 -5.1849 -5.1618 -5.1593 -5.1026 -3.3177 -3.3157 -3.3123 -3.3105 -3.2507 -3.2479 -3.2475 -3.2312 -3.2269 -3.2156 -3.2039 -3.2031 -3.1938 -3.1764 -3.1679 -3.1564 -3.1404 -3.1378 1.1742 1.1753 1.3102 1.3201 1.4876 1.5012 3.3337 3.3420 3.3619 3.3701 3.5870 3.5985 3.9172 3.9344 3.9770 4.0024 4.1064 4.1165 4.1620 4.1663 4.2203 4.2979 4.3167 4.4204 4.4820 4.4921 5.2245 5.2570 5.2851 5.3143 8.1065 8.1227 8.2361 8.2825 8.4299 8.4851 8.5374 8.5728 8.7664 8.8073 9.4452 9.5529 9.6952 9.8914 10.1335 10.2932 k = 0.0000 0.0000 0.1900 ( 9125 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1362 -6.1350 -5.7504 -5.7452 -5.7407 -5.7109 -5.6868 -5.6353 -5.4591 -5.4581 -5.4576 -5.4571 -5.3953 -5.3940 -5.2709 -5.2128 -5.1796 -5.1595 -5.1576 -5.1066 -3.3179 -3.3161 -3.3136 -3.3118 -3.2487 -3.2478 -3.2457 -3.2301 -3.2255 -3.2153 -3.2025 -3.2020 -3.1922 -3.1766 -3.1682 -3.1566 -3.1396 -3.1377 1.2085 1.2093 1.3428 1.3528 1.4946 1.5076 3.3512 3.3593 3.3832 3.3893 3.5790 3.5894 3.8887 3.9176 3.9588 3.9637 4.0831 4.0977 4.1471 4.1614 4.1841 4.2466 4.3113 4.3765 4.4388 4.4527 5.2117 5.2421 5.2671 5.2921 8.1352 8.1485 8.2664 8.3097 8.4233 8.4882 8.5473 8.5588 8.7213 8.7607 9.4836 9.5919 9.7237 9.9081 10.1734 10.3084 k = 0.0000 0.0000 0.1689 ( 9127 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1447 -6.1438 -5.7488 -5.7466 -5.7396 -5.7102 -5.6874 -5.6424 -5.4593 -5.4585 -5.4581 -5.4578 -5.3946 -5.3938 -5.2599 -5.2075 -5.1753 -5.1573 -5.1559 -5.1114 -3.3181 -3.3165 -3.3147 -3.3130 -3.2481 -3.2477 -3.2424 -3.2289 -3.2243 -3.2150 -3.2013 -3.2010 -3.1905 -3.1767 -3.1686 -3.1572 -3.1389 -3.1376 1.2410 1.2415 1.3749 1.3847 1.5013 1.5134 3.3702 3.3784 3.4033 3.4075 3.5714 3.5809 3.8607 3.8954 3.9309 3.9369 4.0478 4.0788 4.1330 4.1382 4.1640 4.1988 4.3066 4.3464 4.4046 4.4190 5.2014 5.2295 5.2509 5.2731 8.1627 8.1726 8.2935 8.3351 8.4107 8.4813 8.5504 8.5592 8.6807 8.7175 9.5251 9.6312 9.7515 9.9206 10.2145 10.3240 k = 0.0000 0.0000 0.1478 ( 9121 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1523 -6.1517 -5.7487 -5.7479 -5.7365 -5.7092 -5.6883 -5.6497 -5.4595 -5.4589 -5.4586 -5.4583 -5.3941 -5.3936 -5.2488 -5.2022 -5.1719 -5.1551 -5.1544 -5.1170 -3.3182 -3.3168 -3.3156 -3.3142 -3.2479 -3.2477 -3.2389 -3.2276 -3.2231 -3.2150 -3.2003 -3.2001 -3.1888 -3.1767 -3.1691 -3.1583 -3.1381 -3.1373 1.2712 1.2715 1.4059 1.4153 1.5075 1.5186 3.3909 3.3991 3.4224 3.4249 3.5637 3.5727 3.8345 3.8689 3.9026 3.9118 4.0045 4.0547 4.0855 4.1327 4.1599 4.1625 4.3025 4.3277 4.3779 4.3902 5.1937 5.2188 5.2368 5.2566 8.1882 8.1942 8.3166 8.3587 8.3989 8.4694 8.5442 8.5680 8.6452 8.6781 9.5687 9.6700 9.7776 9.9287 10.2563 10.3404 k = 0.0000 0.0000 0.1267 ( 9129 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1590 -6.1586 -5.7493 -5.7490 -5.7323 -5.7081 -5.6894 -5.6570 -5.4597 -5.4592 -5.4590 -5.4588 -5.3937 -5.3934 -5.2376 -5.1972 -5.1695 -5.1532 -5.1529 -5.1232 -3.3184 -3.3172 -3.3165 -3.3152 -3.2478 -3.2477 -3.2354 -3.2262 -3.2221 -3.2151 -3.1994 -3.1993 -3.1871 -3.1766 -3.1697 -3.1598 -3.1375 -3.1370 1.2985 1.2987 1.4352 1.4439 1.5133 1.5231 3.4128 3.4212 3.4407 3.4421 3.5558 3.5643 3.8111 3.8419 3.8754 3.8841 3.9565 4.0030 4.0681 4.1198 4.1397 4.1590 4.2994 4.3163 4.3567 4.3658 5.1883 5.2099 5.2248 5.2423 8.2103 8.2125 8.3351 8.3801 8.3921 8.4572 8.5371 8.5723 8.6149 8.6429 9.6135 9.7073 9.8009 9.9321 10.2975 10.3579 k = 0.0000 0.0000 0.1056 ( 9129 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1648 -6.1645 -5.7500 -5.7499 -5.7275 -5.7068 -5.6908 -5.6643 -5.4598 -5.4594 -5.4593 -5.4592 -5.3934 -5.3932 -5.2265 -5.1923 -5.1681 -5.1514 -5.1514 -5.1302 -3.3185 -3.3175 -3.3171 -3.3160 -3.2477 -3.2477 -3.2321 -3.2249 -3.2212 -3.2154 -3.1986 -3.1986 -3.1853 -3.1765 -3.1703 -3.1617 -3.1369 -3.1366 1.3225 1.3226 1.4620 1.4697 1.5184 1.5269 3.4357 3.4443 3.4585 3.4592 3.5479 3.5558 3.7911 3.8171 3.8478 3.8550 3.9067 3.9437 4.0650 4.1021 4.1343 4.1530 4.2976 4.3092 4.3394 4.3455 5.1848 5.2028 5.2149 5.2298 8.2265 8.2272 8.3491 8.3929 8.3989 8.4476 8.5288 8.5718 8.5894 8.6122 9.6583 9.7421 9.8206 9.9308 10.3368 10.3762 k = 0.0000 0.0000 0.0845 ( 9119 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1695 -6.1694 -5.7507 -5.7507 -5.7224 -5.7054 -5.6922 -5.6715 -5.4599 -5.4597 -5.4596 -5.4595 -5.3932 -5.3931 -5.2155 -5.1878 -5.1677 -5.1500 -5.1499 -5.1377 -3.3186 -3.3178 -3.3177 -3.3168 -3.2477 -3.2477 -3.2291 -3.2236 -3.2205 -3.2159 -3.1980 -3.1980 -3.1833 -3.1762 -3.1710 -3.1639 -3.1364 -3.1363 1.3427 1.3428 1.4855 1.4921 1.5230 1.5299 3.4589 3.4677 3.4761 3.4766 3.5404 3.5474 3.7748 3.7957 3.8201 3.8255 3.8584 3.8871 4.0678 4.0910 4.1306 4.1448 4.2968 4.3050 4.3253 4.3289 5.1831 5.1973 5.2068 5.2190 8.2359 8.2377 8.3618 8.3997 8.4147 8.4420 8.5206 8.5669 8.5679 8.5863 9.7020 9.7734 9.8362 9.9245 10.3724 10.3948 k = 0.0000 0.0000 0.0633 ( 9127 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1732 -6.1732 -5.7513 -5.7513 -5.7169 -5.7038 -5.6938 -5.6786 -5.4600 -5.4598 -5.4598 -5.4597 -5.3930 -5.3930 -5.2046 -5.1836 -5.1682 -5.1490 -5.1487 -5.1457 -3.3186 -3.3180 -3.3180 -3.3174 -3.2477 -3.2477 -3.2263 -3.2225 -3.2200 -3.2166 -3.1975 -3.1975 -3.1812 -3.1758 -3.1718 -3.1663 -3.1360 -3.1359 1.3589 1.3589 1.5050 1.5102 1.5268 1.5321 3.4817 3.4903 3.4932 3.4937 3.5339 3.5396 3.7624 3.7781 3.7941 3.7973 3.8152 3.8364 4.0742 4.0869 4.1261 4.1352 4.2968 4.3025 4.3139 4.3160 5.1830 5.1934 5.2005 5.2098 8.2410 8.2423 8.3769 8.4085 8.4256 8.4406 8.5147 8.5499 8.5577 8.5659 9.7436 9.8002 9.8471 9.9131 10.4022 10.4126 k = 0.0000 0.0000 0.0422 ( 9153 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1759 -6.1759 -5.7518 -5.7518 -5.7112 -5.7022 -5.6954 -5.6855 -5.4601 -5.4600 -5.4599 -5.4599 -5.3929 -5.3929 -5.1939 -5.1798 -5.1694 -5.1547 -5.1478 -5.1478 -3.3186 -3.3183 -3.3182 -3.3178 -3.2477 -3.2477 -3.2239 -3.2215 -3.2198 -3.2175 -3.1972 -3.1972 -3.1790 -3.1753 -3.1726 -3.1688 -3.1357 -3.1357 1.3707 1.3707 1.5198 1.5233 1.5298 1.5334 3.5026 3.5082 3.5092 3.5103 3.5291 3.5330 3.7541 3.7643 3.7720 3.7724 3.7814 3.7940 4.0828 4.0881 4.1205 4.1248 4.2973 4.3009 4.3056 4.3067 5.1842 5.1910 5.1957 5.2020 8.2429 8.2434 8.3944 8.4166 8.4301 8.4414 8.5134 8.5360 8.5447 8.5516 9.7824 9.8218 9.8529 9.8966 10.4247 10.4280 k = 0.0000 0.0000 0.0211 ( 9189 PWs) bands (ev): -48.7678 -48.7678 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.1776 -6.1776 -5.7520 -5.7520 -5.7052 -5.7006 -5.6971 -5.6923 -5.4601 -5.4601 -5.4600 -5.4600 -5.3929 -5.3929 -5.1836 -5.1764 -5.1712 -5.1639 -5.1472 -5.1472 -3.3185 -3.3184 -3.3183 -3.3182 -3.2477 -3.2477 -3.2219 -3.2207 -3.2198 -3.2187 -3.1970 -3.1970 -3.1766 -3.1747 -3.1733 -3.1714 -3.1355 -3.1355 1.3778 1.3778 1.5293 1.5311 1.5320 1.5338 3.5189 3.5194 3.5201 3.5238 3.5266 3.5286 3.7496 3.7529 3.7537 3.7587 3.7614 3.7637 4.0918 4.0930 4.1137 4.1148 4.2981 4.2998 4.3005 4.3010 5.1867 5.1900 5.1924 5.1956 8.2432 8.2432 8.4123 8.4232 8.4303 8.4382 8.5180 8.5280 8.5334 8.5391 9.8175 9.8380 9.8535 9.8750 10.4383 10.4387 k = 0.0000 0.0000 0.0000 ( 9189 PWs) bands (ev): -48.7678 -48.7678 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.1781 -6.1781 -5.7521 -5.7521 -5.6989 -5.6989 -5.6989 -5.6989 -5.4601 -5.4601 -5.4601 -5.4601 -5.3928 -5.3928 -5.1735 -5.1735 -5.1735 -5.1735 -5.1471 -5.1471 -3.3184 -3.3184 -3.3184 -3.3184 -3.2477 -3.2477 -3.2201 -3.2201 -3.2201 -3.2201 -3.1969 -3.1969 -3.1740 -3.1740 -3.1740 -3.1740 -3.1355 -3.1355 1.3802 1.3802 1.5332 1.5332 1.5332 1.5332 3.5231 3.5231 3.5271 3.5271 3.5271 3.5271 3.7486 3.7486 3.7486 3.7486 3.7552 3.7552 4.0974 4.0974 4.1089 4.1089 4.2989 4.2989 4.2989 4.2989 5.1905 5.1905 5.1905 5.1905 8.2431 8.2431 8.4279 8.4279 8.4279 8.4279 8.5273 8.5273 8.5273 8.5273 9.8486 9.8486 9.8486 9.8486 10.4427 10.4427 k = 0.0000 0.0000 0.0000 ( 9189 PWs) bands (ev): -48.7678 -48.7678 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.1781 -6.1781 -5.7521 -5.7521 -5.6989 -5.6989 -5.6989 -5.6989 -5.4601 -5.4601 -5.4601 -5.4601 -5.3928 -5.3928 -5.1735 -5.1735 -5.1735 -5.1735 -5.1471 -5.1471 -3.3184 -3.3184 -3.3184 -3.3184 -3.2477 -3.2477 -3.2201 -3.2201 -3.2201 -3.2201 -3.1969 -3.1969 -3.1740 -3.1740 -3.1740 -3.1740 -3.1355 -3.1355 1.3802 1.3802 1.5332 1.5332 1.5332 1.5332 3.5231 3.5231 3.5271 3.5271 3.5271 3.5271 3.7486 3.7486 3.7486 3.7486 3.7552 3.7552 4.0974 4.0974 4.1089 4.1089 4.2989 4.2989 4.2989 4.2989 5.1905 5.1905 5.1905 5.1905 8.2431 8.2431 8.4279 8.4279 8.4279 8.4279 8.5273 8.5273 8.5273 8.5273 9.8486 9.8486 9.8486 9.8486 10.4427 10.4427 k = 0.0071 0.0101 0.0175 ( 9189 PWs) bands (ev): -48.7678 -48.7678 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.1775 -6.1775 -5.7520 -5.7520 -5.7055 -5.6989 -5.6989 -5.6920 -5.4601 -5.4600 -5.4600 -5.4600 -5.3929 -5.3929 -5.1841 -5.1738 -5.1738 -5.1634 -5.1473 -5.1473 -3.3185 -3.3184 -3.3184 -3.3182 -3.2477 -3.2477 -3.2219 -3.2203 -3.2203 -3.2186 -3.1970 -3.1970 -3.1767 -3.1740 -3.1740 -3.1713 -3.1355 -3.1355 1.3778 1.3778 1.5300 1.5315 1.5315 1.5330 3.5186 3.5196 3.5196 3.5236 3.5278 3.5278 3.7507 3.7507 3.7535 3.7615 3.7615 3.7633 4.0923 4.0923 4.1144 4.1144 4.2979 4.2997 4.3009 4.3009 5.1865 5.1913 5.1913 5.1958 8.2432 8.2432 8.4114 8.4270 8.4270 8.4385 8.5176 8.5310 8.5310 8.5393 9.8162 9.8456 9.8456 9.8764 10.4384 10.4384 k = 0.0143 0.0202 0.0350 ( 9156 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1759 -6.1759 -5.7517 -5.7517 -5.7118 -5.6989 -5.6989 -5.6849 -5.4601 -5.4599 -5.4599 -5.4599 -5.3929 -5.3929 -5.1949 -5.1746 -5.1746 -5.1537 -5.1478 -5.1478 -3.3186 -3.3182 -3.3182 -3.3178 -3.2477 -3.2477 -3.2241 -3.2206 -3.2206 -3.2174 -3.1972 -3.1972 -3.1792 -3.1739 -3.1739 -3.1685 -3.1357 -3.1357 1.3704 1.3704 1.5234 1.5263 1.5263 1.5294 3.5018 3.5085 3.5085 3.5094 3.5316 3.5316 3.7545 3.7545 3.7763 3.7811 3.7811 3.7937 4.0854 4.0854 4.1228 4.1228 4.2966 4.3003 4.3070 4.3070 5.1838 5.1935 5.1935 5.2025 8.2431 8.2431 8.3913 8.4254 8.4254 8.4390 8.5143 8.5411 8.5411 8.5508 9.7802 9.8369 9.8369 9.8987 10.4259 10.4259 k = 0.0214 0.0303 0.0525 ( 9132 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1731 -6.1731 -5.7513 -5.7513 -5.7178 -5.6989 -5.6989 -5.6776 -5.4600 -5.4598 -5.4598 -5.4598 -5.3930 -5.3930 -5.2061 -5.1760 -5.1760 -5.1488 -5.1488 -5.1446 -3.3185 -3.3180 -3.3180 -3.3174 -3.2477 -3.2477 -3.2266 -3.2213 -3.2213 -3.2164 -3.1976 -3.1976 -3.1816 -3.1738 -3.1738 -3.1659 -3.1360 -3.1360 1.3585 1.3585 1.5137 1.5178 1.5178 1.5224 3.4813 3.4896 3.4931 3.4931 3.5373 3.5373 3.7601 3.7601 3.8106 3.8106 3.8123 3.8347 4.0808 4.0808 4.1308 4.1308 4.2951 4.3008 4.3172 4.3172 5.1825 5.1972 5.1972 5.2105 8.2414 8.2414 8.3688 8.4253 8.4253 8.4284 8.5188 8.5566 8.5566 8.5604 9.7419 9.8225 9.8225 9.9151 10.4066 10.4066 k = 0.0286 0.0404 0.0700 ( 9123 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1692 -6.1692 -5.7507 -5.7507 -5.7234 -5.6989 -5.6989 -5.6701 -5.4599 -5.4596 -5.4595 -5.4595 -5.3931 -5.3931 -5.2174 -5.1778 -5.1778 -5.1501 -5.1501 -5.1360 -3.3183 -3.3177 -3.3177 -3.3169 -3.2477 -3.2477 -3.2294 -3.2221 -3.2221 -3.2156 -3.1980 -3.1980 -3.1837 -3.1737 -3.1737 -3.1633 -3.1364 -3.1364 1.3423 1.3423 1.5011 1.5063 1.5063 1.5124 3.4602 3.4680 3.4763 3.4763 3.5434 3.5434 3.7680 3.7680 3.8462 3.8462 3.8569 3.8828 4.0804 4.0804 4.1379 4.1379 4.2933 4.3012 4.3314 4.3314 5.1826 5.2024 5.2024 5.2200 8.2366 8.2366 8.3442 8.4102 8.4289 8.4289 8.5274 8.5673 8.5764 8.5764 9.7026 9.8028 9.8028 9.9252 10.3823 10.3823 k = 0.0357 0.0505 0.0875 ( 9129 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1643 -6.1643 -5.7499 -5.7499 -5.7287 -5.6990 -5.6990 -5.6626 -5.4598 -5.4594 -5.4592 -5.4592 -5.3933 -5.3933 -5.2288 -5.1802 -5.1802 -5.1518 -5.1518 -5.1280 -3.3180 -3.3174 -3.3174 -3.3162 -3.2477 -3.2477 -3.2325 -3.2232 -3.2232 -3.2150 -3.1987 -3.1987 -3.1856 -3.1735 -3.1735 -3.1609 -3.1368 -3.1368 1.3224 1.3224 1.4858 1.4920 1.4920 1.4994 3.4401 3.4468 3.4596 3.4596 3.5482 3.5482 3.7783 3.7783 3.8850 3.8850 3.9075 3.9358 4.0856 4.0856 4.1444 4.1444 4.2913 4.3016 4.3499 4.3499 5.1843 5.2094 5.2094 5.2311 8.2276 8.2276 8.3177 8.3876 8.4365 8.4365 8.5369 8.5708 8.6006 8.6006 9.6638 9.7782 9.7782 9.9294 10.3548 10.3548 k = 0.0429 0.0606 0.1050 ( 9126 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1583 -6.1583 -5.7490 -5.7490 -5.7337 -5.6990 -5.6990 -5.6551 -5.4597 -5.4591 -5.4589 -5.4589 -5.3936 -5.3936 -5.2402 -5.1830 -5.1830 -5.1539 -5.1539 -5.1208 -3.3176 -3.3169 -3.3169 -3.3155 -3.2477 -3.2477 -3.2359 -3.2244 -3.2244 -3.2146 -3.1994 -3.1994 -3.1872 -3.1735 -3.1735 -3.1588 -3.1374 -3.1374 1.2992 1.2992 1.4682 1.4752 1.4752 1.4840 3.4217 3.4270 3.4438 3.4438 3.5504 3.5504 3.7911 3.7911 3.9243 3.9243 3.9623 3.9919 4.0969 4.0969 4.1516 4.1516 4.2892 4.3024 4.3731 4.3731 5.1877 5.2181 5.2181 5.2439 8.2142 8.2142 8.2891 8.3622 8.4471 8.4471 8.5457 8.5704 8.6297 8.6297 9.6269 9.7495 9.7495 9.9280 10.3257 10.3257 k = 0.0500 0.0707 0.1225 ( 9114 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1513 -6.1513 -5.7480 -5.7480 -5.7382 -5.6991 -5.6991 -5.6477 -5.4595 -5.4587 -5.4584 -5.4584 -5.3939 -5.3939 -5.2516 -5.1863 -5.1863 -5.1563 -5.1563 -5.1142 -3.3172 -3.3163 -3.3163 -3.3147 -3.2478 -3.2478 -3.2394 -3.2256 -3.2256 -3.2143 -3.2003 -3.2003 -3.1887 -3.1734 -3.1734 -3.1570 -3.1380 -3.1380 1.2734 1.2734 1.4488 1.4564 1.4564 1.4663 3.4052 3.4092 3.4293 3.4293 3.5487 3.5487 3.8066 3.8066 3.9617 3.9617 4.0198 4.0493 4.1126 4.1126 4.1626 4.1626 4.2872 4.3042 4.4013 4.4013 5.1930 5.2287 5.2287 5.2587 8.1968 8.1968 8.2585 8.3348 8.4588 8.4588 8.5529 8.5661 8.6642 8.6642 9.5931 9.7176 9.7176 9.9218 10.2961 10.2961 k = 0.0571 0.0808 0.1400 ( 9120 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2417 -24.2417 -24.2417 -24.2417 -6.1433 -6.1433 -5.7469 -5.7469 -5.7425 -5.6991 -5.6991 -5.6405 -5.4593 -5.4583 -5.4579 -5.4579 -5.3942 -5.3942 -5.2627 -5.1900 -5.1900 -5.1591 -5.1591 -5.1084 -3.3166 -3.3157 -3.3157 -3.3138 -3.2479 -3.2479 -3.2430 -3.2270 -3.2270 -3.2142 -3.2014 -3.2014 -3.1899 -3.1735 -3.1735 -3.1554 -3.1386 -3.1386 1.2456 1.2456 1.4278 1.4358 1.4358 1.4468 3.3907 3.3934 3.4163 3.4163 3.5428 3.5428 3.8245 3.8245 3.9948 3.9948 4.0785 4.1058 4.1263 4.1263 4.1844 4.1844 4.2861 4.3086 4.4353 4.4353 5.2003 5.2413 5.2413 5.2755 8.1761 8.1761 8.2256 8.3056 8.4695 8.4695 8.5576 8.5583 8.7045 8.7045 9.5635 9.6834 9.6834 9.9116 10.2668 10.2668 k = 0.0643 0.0909 0.1575 ( 9126 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.1344 -6.1344 -5.7463 -5.7458 -5.7458 -5.6992 -5.6992 -5.6336 -5.4590 -5.4579 -5.4573 -5.4573 -5.3946 -5.3946 -5.2735 -5.1941 -5.1941 -5.1622 -5.1622 -5.1033 -3.3159 -3.3150 -3.3150 -3.3128 -3.2480 -3.2480 -3.2465 -3.2283 -3.2283 -3.2141 -3.2026 -3.2026 -3.1910 -3.1737 -3.1737 -3.1542 -3.1393 -3.1393 1.2164 1.2164 1.4057 1.4141 1.4141 1.4260 3.3782 3.3797 3.4048 3.4048 3.5329 3.5329 3.8448 3.8448 4.0226 4.0226 4.1339 4.1339 4.1356 4.1567 4.2203 4.2203 4.2876 4.3192 4.4758 4.4758 5.2099 5.2560 5.2560 5.2945 8.1528 8.1528 8.1903 8.2748 8.4779 8.4779 8.5453 8.5616 8.7501 8.7501 9.5390 9.6482 9.6482 9.8984 10.2383 10.2383 k = 0.0714 0.1010 0.1750 ( 9126 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.1247 -6.1247 -5.7498 -5.7446 -5.7446 -5.6992 -5.6992 -5.6271 -5.4587 -5.4573 -5.4566 -5.4566 -5.3951 -5.3951 -5.2838 -5.1985 -5.1985 -5.1656 -5.1656 -5.0991 -3.3152 -3.3142 -3.3142 -3.3118 -3.2500 -3.2483 -3.2483 -3.2296 -3.2296 -3.2142 -3.2038 -3.2038 -3.1920 -3.1741 -3.1741 -3.1534 -3.1400 -3.1400 1.1862 1.1862 1.3828 1.3913 1.3913 1.4040 3.3675 3.3680 3.3947 3.3947 3.5198 3.5198 3.8671 3.8671 4.0446 4.0446 4.1380 4.1380 4.1847 4.1951 4.2662 4.2662 4.2973 4.3422 4.5230 4.5230 5.2218 5.2728 5.2728 5.3158 8.1273 8.1273 8.1527 8.2428 8.4832 8.4832 8.5296 8.5628 8.8003 8.8003 9.5198 9.6131 9.6131 9.8833 10.2108 10.2108 k = 0.0786 0.1111 0.1925 ( 9126 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.1141 -6.1141 -5.7529 -5.7434 -5.7434 -5.6992 -5.6992 -5.6212 -5.4584 -5.4566 -5.4559 -5.4559 -5.3957 -5.3957 -5.2935 -5.2033 -5.2033 -5.1692 -5.1692 -5.0957 -3.3143 -3.3132 -3.3132 -3.3107 -3.2533 -3.2486 -3.2486 -3.2308 -3.2308 -3.2143 -3.2052 -3.2052 -3.1929 -3.1746 -3.1746 -3.1529 -3.1407 -3.1407 1.1557 1.1557 1.3595 1.3681 1.3681 1.3814 3.3581 3.3585 3.3859 3.3859 3.5042 3.5042 3.8912 3.8912 4.0609 4.0609 4.1409 4.1409 4.2140 4.2159 4.3179 4.3179 4.3264 4.3819 4.5771 4.5771 5.2361 5.2917 5.2917 5.3393 8.1002 8.1002 8.1127 8.2097 8.4853 8.4853 8.5114 8.5619 8.8534 8.8534 9.5060 9.5791 9.5791 9.8670 10.1843 10.1843 k = 0.0857 0.1212 0.2100 ( 9129 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.1028 -6.1028 -5.7557 -5.7424 -5.7424 -5.6992 -5.6992 -5.6162 -5.4581 -5.4558 -5.4550 -5.4550 -5.3963 -5.3963 -5.3024 -5.2084 -5.2084 -5.1730 -5.1730 -5.0932 -3.3134 -3.3122 -3.3122 -3.3095 -3.2564 -3.2491 -3.2491 -3.2319 -3.2319 -3.2145 -3.2067 -3.2067 -3.1937 -3.1753 -3.1753 -3.1527 -3.1414 -3.1414 1.1252 1.1252 1.3362 1.3446 1.3446 1.3584 3.3500 3.3511 3.3782 3.3782 3.4872 3.4872 3.9167 3.9167 4.0715 4.0715 4.1439 4.1439 4.2225 4.2231 4.3728 4.3728 4.3752 4.4337 4.6375 4.6375 5.2528 5.3125 5.3125 5.3651 8.0707 8.0717 8.0717 8.1757 8.4843 8.4843 8.4915 8.5591 8.9077 8.9077 9.4975 9.5470 9.5470 9.8503 10.1590 10.1590 k = 0.0929 0.1313 0.2275 ( 9132 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.0909 -6.0909 -5.7581 -5.7414 -5.7414 -5.6990 -5.6990 -5.6120 -5.4577 -5.4549 -5.4541 -5.4541 -5.3971 -5.3971 -5.3103 -5.2138 -5.2138 -5.1770 -5.1770 -5.0915 -3.3124 -3.3112 -3.3112 -3.3082 -3.2592 -3.2496 -3.2496 -3.2329 -3.2329 -3.2148 -3.2083 -3.2083 -3.1945 -3.1762 -3.1762 -3.1529 -3.1421 -3.1421 1.0952 1.0952 1.3130 1.3212 1.3212 1.3354 3.3433 3.3450 3.3714 3.3714 3.4695 3.4695 3.9432 3.9432 4.0770 4.0770 4.1476 4.1476 4.2208 4.2226 4.4291 4.4291 4.4324 4.4909 4.7033 4.7033 5.2718 5.3349 5.3349 5.3927 8.0273 8.0425 8.0425 8.1414 8.4707 8.4805 8.4805 8.5547 8.9609 8.9609 9.4936 9.5177 9.5177 9.8337 10.1348 10.1348 k = 0.1000 0.1414 0.2449 ( 9117 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.0783 -6.0783 -5.7602 -5.7407 -5.7407 -5.6988 -5.6988 -5.6090 -5.4572 -5.4539 -5.4530 -5.4530 -5.3979 -5.3979 -5.3170 -5.2194 -5.2194 -5.1812 -5.1812 -5.0907 -3.3113 -3.3100 -3.3100 -3.3070 -3.2616 -3.2503 -3.2503 -3.2338 -3.2338 -3.2151 -3.2099 -3.2099 -3.1952 -3.1772 -3.1772 -3.1534 -3.1427 -3.1427 1.0660 1.0660 1.2902 1.2981 1.2981 1.3126 3.3380 3.3401 3.3655 3.3655 3.4519 3.4519 3.9701 3.9701 4.0782 4.0782 4.1524 4.1524 4.2147 4.2179 4.4856 4.4856 4.4917 4.5495 4.7737 4.7737 5.2928 5.3586 5.3586 5.4218 7.9835 8.0131 8.0131 8.1071 8.4499 8.4745 8.4745 8.5489 9.0105 9.0105 9.4917 9.4917 9.4938 9.8176 10.1117 10.1117 k = 0.1071 0.1515 0.2624 ( 9141 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2417 -24.2417 -6.0653 -6.0653 -5.7619 -5.7402 -5.7402 -5.6985 -5.6985 -5.6072 -5.4568 -5.4528 -5.4519 -5.4519 -5.3987 -5.3987 -5.3225 -5.2252 -5.2252 -5.1854 -5.1854 -5.0908 -3.3101 -3.3087 -3.3087 -3.3057 -3.2637 -3.2512 -3.2512 -3.2345 -3.2345 -3.2156 -3.2116 -3.2116 -3.1959 -3.1783 -3.1783 -3.1543 -3.1433 -3.1433 1.0380 1.0380 1.2680 1.2755 1.2755 1.2902 3.3339 3.3363 3.3601 3.3601 3.4350 3.4350 3.9962 3.9962 4.0764 4.0764 4.1588 4.1588 4.2063 4.2107 4.5413 4.5413 4.5506 4.6074 4.8475 4.8475 5.3153 5.3829 5.3829 5.4517 7.9404 7.9843 7.9843 8.0735 8.4297 8.4669 8.4669 8.5422 9.0538 9.0538 9.4696 9.4696 9.4974 9.8022 10.0898 10.0898 k = 0.1143 0.1616 0.2799 ( 9147 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0519 -6.0519 -5.7634 -5.7399 -5.7399 -5.6980 -5.6980 -5.6068 -5.4563 -5.4517 -5.4506 -5.4506 -5.3997 -5.3997 -5.3265 -5.2313 -5.2313 -5.1896 -5.1896 -5.0917 -3.3088 -3.3073 -3.3073 -3.3044 -3.2652 -3.2521 -3.2521 -3.2351 -3.2351 -3.2161 -3.2133 -3.2133 -3.1966 -3.1796 -3.1796 -3.1554 -3.1440 -3.1440 1.0115 1.0115 1.2467 1.2537 1.2537 1.2685 3.3308 3.3334 3.3552 3.3552 3.4194 3.4194 4.0200 4.0200 4.0725 4.0725 4.1678 4.1678 4.1964 4.2016 4.5955 4.5955 4.6080 4.6635 4.9235 4.9235 5.3388 5.4071 5.4071 5.4815 7.8994 7.9570 7.9570 8.0413 8.4106 8.4582 8.4582 8.5350 9.0880 9.0880 9.4516 9.4516 9.5038 9.7874 10.0694 10.0694 k = 0.1214 0.1717 0.2974 ( 9159 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0381 -6.0381 -5.7645 -5.7399 -5.7399 -5.6973 -5.6973 -5.6078 -5.4558 -5.4505 -5.4493 -5.4493 -5.4007 -5.4007 -5.3290 -5.2374 -5.2374 -5.1938 -5.1938 -5.0934 -3.3075 -3.3059 -3.3059 -3.3032 -3.2663 -3.2531 -3.2531 -3.2356 -3.2356 -3.2166 -3.2151 -3.2151 -3.1972 -3.1809 -3.1809 -3.1569 -3.1446 -3.1446 0.9866 0.9866 1.2263 1.2327 1.2327 1.2476 3.3287 3.3314 3.3504 3.3504 3.4056 3.4056 4.0389 4.0389 4.0674 4.0674 4.1815 4.1815 4.1854 4.1913 4.6478 4.6478 4.6633 4.7174 5.0005 5.0005 5.3622 5.4304 5.4304 5.5101 7.8622 7.9320 7.9320 8.0113 8.3930 8.4490 8.4490 8.5278 9.1105 9.1105 9.4378 9.4378 9.5124 9.7732 10.0508 10.0508 k = 0.1286 0.1818 0.3149 ( 9153 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0242 -6.0242 -5.7653 -5.7403 -5.7403 -5.6966 -5.6966 -5.6102 -5.4553 -5.4494 -5.4478 -5.4478 -5.4018 -5.4018 -5.3298 -5.2437 -5.2437 -5.1978 -5.1978 -5.0960 -3.3062 -3.3043 -3.3043 -3.3019 -3.2669 -3.2541 -3.2541 -3.2360 -3.2360 -3.2173 -3.2168 -3.2168 -3.1979 -3.1823 -3.1823 -3.1585 -3.1452 -3.1452 0.9637 0.9637 1.2070 1.2127 1.2127 1.2276 3.3274 3.3300 3.3456 3.3456 3.3940 3.3940 4.0493 4.0493 4.0635 4.0635 4.1735 4.1799 4.2016 4.2016 4.6979 4.6979 4.7164 4.7686 5.0773 5.0773 5.3848 5.4519 5.4519 5.5362 7.8302 7.9105 7.9105 7.9845 8.3770 8.4401 8.4401 8.5209 9.1200 9.1200 9.4275 9.4275 9.5226 9.7596 10.0343 10.0343 k = 0.1357 0.1919 0.3324 ( 9159 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -6.0102 -6.0102 -5.7659 -5.7410 -5.7410 -5.6956 -5.6956 -5.6140 -5.4547 -5.4484 -5.4463 -5.4463 -5.4028 -5.4028 -5.3291 -5.2501 -5.2501 -5.2018 -5.2018 -5.0994 -3.3047 -3.3027 -3.3027 -3.3007 -3.2670 -3.2552 -3.2552 -3.2365 -3.2365 -3.2186 -3.2186 -3.2180 -3.1985 -3.1837 -3.1837 -3.1604 -3.1459 -3.1459 0.9429 0.9429 1.1887 1.1938 1.1938 1.2086 3.3267 3.3291 3.3407 3.3407 3.3847 3.3847 4.0476 4.0476 4.0641 4.0641 4.1610 4.1677 4.2285 4.2285 4.7456 4.7456 4.7670 4.8171 5.1528 5.1528 5.4053 5.4707 5.4707 5.5585 7.8049 7.8933 7.8933 7.9616 8.3630 8.4320 8.4320 8.5149 9.1169 9.1169 9.4192 9.4192 9.5340 9.7464 10.0201 10.0201 k = 0.1429 0.2020 0.3499 ( 9159 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9962 -5.9962 -5.7662 -5.7420 -5.7420 -5.6946 -5.6946 -5.6190 -5.4541 -5.4475 -5.4447 -5.4447 -5.4038 -5.4038 -5.3268 -5.2564 -5.2564 -5.2055 -5.2055 -5.1035 -3.3033 -3.3010 -3.3010 -3.2995 -3.2665 -3.2563 -3.2563 -3.2369 -3.2369 -3.2203 -3.2203 -3.2188 -3.1991 -3.1851 -3.1851 -3.1624 -3.1465 -3.1465 0.9244 0.9244 1.1717 1.1759 1.1759 1.1906 3.3265 3.3287 3.3359 3.3359 3.3777 3.3777 4.0405 4.0405 4.0641 4.0641 4.1480 4.1549 4.2611 4.2611 4.7906 4.7906 4.8151 4.8629 5.2254 5.2254 5.4228 5.4862 5.4862 5.5756 7.7877 7.8811 7.8811 7.9432 8.3511 8.4253 8.4253 8.5101 9.1032 9.1032 9.4109 9.4109 9.5463 9.7336 10.0078 10.0078 k = 0.1500 0.2121 0.3674 ( 9156 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9824 -5.9824 -5.7662 -5.7432 -5.7432 -5.6935 -5.6935 -5.6252 -5.4535 -5.4467 -5.4432 -5.4432 -5.4047 -5.4047 -5.3232 -5.2628 -5.2628 -5.2091 -5.2091 -5.1083 -3.3018 -3.2992 -3.2992 -3.2983 -3.2656 -3.2573 -3.2573 -3.2374 -3.2374 -3.2219 -3.2219 -3.2196 -3.1998 -3.1865 -3.1865 -3.1646 -3.1472 -3.1472 0.9083 0.9083 1.1557 1.1592 1.1592 1.1737 3.3268 3.3286 3.3316 3.3316 3.3726 3.3726 4.0322 4.0322 4.0610 4.0610 4.1347 4.1418 4.2979 4.2979 4.8329 4.8329 4.8607 4.9060 5.2935 5.2935 5.4362 5.4982 5.4982 5.5866 7.7793 7.8746 7.8746 7.9299 8.3417 8.4205 8.4205 8.5069 9.0815 9.0815 9.4013 9.4013 9.5592 9.7212 9.9961 9.9961 k = 0.1571 0.2222 0.3849 ( 9144 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9689 -5.9689 -5.7660 -5.7446 -5.7446 -5.6924 -5.6924 -5.6322 -5.4529 -5.4460 -5.4416 -5.4416 -5.4055 -5.4055 -5.3185 -5.2691 -5.2691 -5.2124 -5.2124 -5.1139 -3.3002 -3.2974 -3.2974 -3.2971 -3.2642 -3.2584 -3.2584 -3.2379 -3.2379 -3.2235 -3.2235 -3.2206 -3.2004 -3.1877 -3.1877 -3.1670 -3.1479 -3.1479 0.8948 0.8948 1.1410 1.1436 1.1436 1.1579 3.3274 3.3282 3.3282 3.3289 3.3691 3.3691 4.0234 4.0234 4.0554 4.0554 4.1212 4.1285 4.3377 4.3377 4.8723 4.8723 4.9038 4.9466 5.3549 5.3549 5.4451 5.5076 5.5076 5.5906 7.7801 7.8736 7.8736 7.9219 8.3352 8.4183 8.4183 8.5058 9.0546 9.0546 9.3895 9.3895 9.5726 9.7095 9.9838 9.9838 k = 0.1643 0.2323 0.4024 ( 9132 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9559 -5.9559 -5.7656 -5.7461 -5.7461 -5.6914 -5.6914 -5.6401 -5.4522 -5.4455 -5.4402 -5.4402 -5.4059 -5.4059 -5.3127 -5.2753 -5.2753 -5.2154 -5.2154 -5.1201 -3.2986 -3.2959 -3.2955 -3.2955 -3.2624 -3.2594 -3.2594 -3.2385 -3.2385 -3.2251 -3.2251 -3.2216 -3.2010 -3.1889 -3.1889 -3.1693 -3.1487 -3.1487 0.8840 0.8840 1.1273 1.1290 1.1290 1.1430 3.3260 3.3260 3.3283 3.3293 3.3666 3.3666 4.0144 4.0144 4.0482 4.0482 4.1078 4.1152 4.3797 4.3797 4.9085 4.9085 4.9445 4.9844 5.4054 5.4054 5.4490 5.5175 5.5175 5.5876 7.7896 7.8780 7.8780 7.9190 8.3320 8.4194 8.4194 8.5071 9.0250 9.0250 9.3752 9.3752 9.5865 9.6987 9.9696 9.9696 k = 0.1714 0.2424 0.4199 ( 9129 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9434 -5.9434 -5.7649 -5.7477 -5.7477 -5.6903 -5.6903 -5.6485 -5.4515 -5.4450 -5.4390 -5.4390 -5.4060 -5.4060 -5.3062 -5.2814 -5.2814 -5.2181 -5.2181 -5.1268 -3.2970 -3.2947 -3.2937 -3.2937 -3.2604 -3.2604 -3.2603 -3.2391 -3.2391 -3.2265 -3.2265 -3.2227 -3.2016 -3.1900 -3.1900 -3.1718 -3.1494 -3.1494 0.8760 0.8760 1.1146 1.1154 1.1154 1.1292 3.3252 3.3252 3.3294 3.3298 3.3650 3.3650 4.0054 4.0054 4.0400 4.0400 4.0945 4.1020 4.4233 4.4233 4.9411 4.9411 4.9824 5.0193 5.4377 5.4377 5.4483 5.5345 5.5345 5.5779 7.8067 7.8870 7.8870 7.9206 8.3328 8.4243 8.4243 8.5110 8.9947 8.9947 9.3583 9.3583 9.6007 9.6893 9.9528 9.9528 k = 0.1786 0.2525 0.4374 ( 9132 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9317 -5.9317 -5.7640 -5.7493 -5.7493 -5.6894 -5.6894 -5.6574 -5.4507 -5.4447 -5.4380 -5.4380 -5.4056 -5.4056 -5.2991 -5.2872 -5.2872 -5.2205 -5.2205 -5.1341 -3.2953 -3.2934 -3.2918 -3.2918 -3.2614 -3.2614 -3.2579 -3.2398 -3.2398 -3.2279 -3.2279 -3.2238 -3.2021 -3.1910 -3.1910 -3.1742 -3.1502 -3.1502 0.8709 0.8709 1.1027 1.1027 1.1028 1.1161 3.3258 3.3258 3.3304 3.3305 3.3642 3.3642 3.9964 3.9964 4.0313 4.0313 4.0814 4.0890 4.4680 4.4680 4.9696 4.9696 5.0174 5.0510 5.4436 5.4493 5.4493 5.5616 5.5616 5.5625 7.8297 7.8992 7.8992 7.9260 8.3385 8.4337 8.4337 8.5180 8.9657 8.9657 9.3384 9.3384 9.6155 9.6818 9.9332 9.9332 k = 0.1857 0.2626 0.4549 ( 9141 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9209 -5.9209 -5.7629 -5.7507 -5.7507 -5.6886 -5.6886 -5.6665 -5.4500 -5.4443 -5.4375 -5.4375 -5.4046 -5.4046 -5.2928 -5.2928 -5.2915 -5.2225 -5.2225 -5.1419 -3.2937 -3.2921 -3.2899 -3.2899 -3.2625 -3.2625 -3.2553 -3.2405 -3.2405 -3.2291 -3.2291 -3.2250 -3.2026 -3.1918 -3.1918 -3.1766 -3.1510 -3.1510 0.8687 0.8687 1.0908 1.0908 1.0918 1.1038 3.3275 3.3275 3.3310 3.3317 3.3641 3.3641 3.9874 3.9874 4.0226 4.0226 4.0688 4.0764 4.5135 4.5135 4.9932 4.9932 5.0487 5.0785 5.4364 5.4485 5.4485 5.5429 5.5910 5.5910 7.8561 7.9134 7.9134 7.9340 8.3501 8.4482 8.4482 8.5279 8.9391 8.9391 9.3151 9.3151 9.6309 9.6769 9.9117 9.9117 k = 0.1929 0.2727 0.4724 ( 9147 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9111 -5.9111 -5.7617 -5.7518 -5.7518 -5.6880 -5.6880 -5.6759 -5.4492 -5.4440 -5.4373 -5.4373 -5.4030 -5.4030 -5.2980 -5.2980 -5.2837 -5.2243 -5.2243 -5.1501 -3.2920 -3.2908 -3.2880 -3.2880 -3.2637 -3.2637 -3.2525 -3.2411 -3.2411 -3.2303 -3.2303 -3.2263 -3.2030 -3.1926 -3.1926 -3.1791 -3.1517 -3.1517 0.8696 0.8696 1.0794 1.0794 1.0814 1.0921 3.3301 3.3301 3.3316 3.3329 3.3648 3.3648 3.9785 3.9785 4.0142 4.0142 4.0567 4.0642 4.5594 4.5594 5.0111 5.0111 5.0757 5.1007 5.4285 5.4435 5.4435 5.5212 5.6158 5.6158 7.8833 7.9281 7.9281 7.9435 8.3685 8.4682 8.4682 8.5410 8.9157 8.9157 9.2876 9.2876 9.6472 9.6752 9.8894 9.8894 k = 0.2000 0.2828 0.4899 ( 9129 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9024 -5.9024 -5.7602 -5.7526 -5.7526 -5.6875 -5.6875 -5.6852 -5.4484 -5.4437 -5.4375 -5.4375 -5.4010 -5.4010 -5.3029 -5.3029 -5.2758 -5.2257 -5.2257 -5.1586 -3.2903 -3.2894 -3.2862 -3.2862 -3.2650 -3.2650 -3.2497 -3.2416 -3.2416 -3.2314 -3.2314 -3.2276 -3.2032 -3.1932 -3.1932 -3.1814 -3.1524 -3.1524 0.8735 0.8735 1.0685 1.0685 1.0715 1.0807 3.3323 3.3330 3.3330 3.3340 3.3665 3.3665 3.9697 3.9697 4.0066 4.0066 4.0452 4.0526 4.6052 4.6052 5.0223 5.0223 5.0969 5.1160 5.4225 5.4389 5.4389 5.5000 5.6330 5.6330 7.9089 7.9420 7.9420 7.9533 8.3943 8.4937 8.4937 8.5567 8.8960 8.8960 9.2551 9.2551 9.6646 9.6772 9.8682 9.8682 k = 0.2071 0.2929 0.5074 ( 9123 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8950 -5.8950 -5.7585 -5.7530 -5.7530 -5.6946 -5.6872 -5.6872 -5.4476 -5.4435 -5.4379 -5.4379 -5.3986 -5.3986 -5.3073 -5.3073 -5.2678 -5.2267 -5.2267 -5.1675 -3.2887 -3.2879 -3.2845 -3.2845 -3.2664 -3.2664 -3.2469 -3.2419 -3.2419 -3.2324 -3.2324 -3.2289 -3.2032 -3.1937 -3.1937 -3.1837 -3.1531 -3.1531 0.8807 0.8807 1.0579 1.0579 1.0618 1.0697 3.3329 3.3350 3.3357 3.3357 3.3694 3.3694 3.9612 3.9612 4.0001 4.0001 4.0344 4.0416 4.6506 4.6506 5.0265 5.0265 5.1108 5.1230 5.4209 5.4374 5.4374 5.4822 5.6415 5.6415 7.9309 7.9541 7.9541 7.9625 8.4274 8.5241 8.5241 8.5748 8.8796 8.8796 9.2173 9.2173 9.6831 9.6834 9.8497 9.8497 k = 0.2143 0.3030 0.5249 ( 9123 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8889 -5.8889 -5.7567 -5.7529 -5.7529 -5.7037 -5.6870 -5.6870 -5.4467 -5.4432 -5.4386 -5.4386 -5.3961 -5.3961 -5.3111 -5.3111 -5.2600 -5.2273 -5.2273 -5.1767 -3.2870 -3.2864 -3.2829 -3.2829 -3.2679 -3.2679 -3.2442 -3.2420 -3.2420 -3.2334 -3.2334 -3.2302 -3.2030 -3.1942 -3.1942 -3.1859 -3.1538 -3.1538 0.8910 0.8910 1.0473 1.0473 1.0521 1.0586 3.3336 3.3360 3.3377 3.3377 3.3735 3.3735 3.9533 3.9533 3.9948 3.9948 4.0245 4.0313 4.6948 4.6948 5.0243 5.0243 5.1158 5.1209 5.4255 5.4404 5.4404 5.4706 5.6408 5.6408 7.9485 7.9640 7.9640 7.9704 8.4669 8.5586 8.5586 8.5945 8.8656 8.8656 9.1745 9.1745 9.6939 9.7026 9.8352 9.8352 k = 0.2214 0.3131 0.5424 ( 9123 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8842 -5.8842 -5.7547 -5.7522 -5.7522 -5.7127 -5.6870 -5.6870 -5.4458 -5.4430 -5.4393 -5.4393 -5.3937 -5.3937 -5.3143 -5.3143 -5.2523 -5.2276 -5.2276 -5.1860 -3.2854 -3.2849 -3.2814 -3.2814 -3.2696 -3.2696 -3.2418 -3.2418 -3.2418 -3.2342 -3.2342 -3.2315 -3.2025 -3.1946 -3.1946 -3.1881 -3.1543 -3.1543 0.9045 0.9045 1.0366 1.0366 1.0423 1.0474 3.3343 3.3368 3.3390 3.3390 3.3783 3.3783 3.9461 3.9461 3.9908 3.9908 4.0156 4.0217 4.7366 4.7366 5.0176 5.0176 5.1105 5.1111 5.4364 5.4484 5.4484 5.4670 5.6312 5.6312 7.9617 7.9715 7.9715 7.9766 8.5111 8.5957 8.5957 8.6151 8.8522 8.8522 9.1286 9.1286 9.7086 9.7230 9.8251 9.8251 k = 0.2286 0.3232 0.5599 ( 9129 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8807 -5.8807 -5.7526 -5.7510 -5.7510 -5.7214 -5.6871 -5.6871 -5.4449 -5.4428 -5.4400 -5.4400 -5.3916 -5.3916 -5.3167 -5.3167 -5.2448 -5.2275 -5.2275 -5.1955 -3.2837 -3.2834 -3.2801 -3.2801 -3.2715 -3.2715 -3.2415 -3.2415 -3.2397 -3.2350 -3.2350 -3.2327 -3.2015 -3.1950 -3.1950 -3.1902 -3.1548 -3.1548 0.9213 0.9213 1.0256 1.0256 1.0320 1.0357 3.3351 3.3374 3.3396 3.3396 3.3832 3.3832 3.9402 3.9402 3.9884 3.9884 4.0077 4.0129 4.7742 4.7742 5.0098 5.0098 5.0939 5.0977 5.4526 5.4605 5.4605 5.4716 5.6131 5.6131 7.9709 7.9769 7.9769 7.9808 8.5578 8.6334 8.6334 8.6360 8.8364 8.8364 9.0836 9.0836 9.7271 9.7435 9.8186 9.8186 k = 0.2357 0.3334 0.5774 ( 9114 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8784 -5.8784 -5.7502 -5.7493 -5.7493 -5.7297 -5.6872 -5.6872 -5.4440 -5.4425 -5.4408 -5.4408 -5.3899 -5.3899 -5.3184 -5.3184 -5.2376 -5.2269 -5.2269 -5.2051 -3.2821 -3.2819 -3.2790 -3.2790 -3.2734 -3.2734 -3.2411 -3.2411 -3.2380 -3.2356 -3.2356 -3.2339 -3.2001 -3.1954 -3.1954 -3.1922 -3.1551 -3.1551 0.9412 0.9412 1.0140 1.0140 1.0211 1.0235 3.3361 3.3380 3.3397 3.3397 3.3875 3.3875 3.9357 3.9357 3.9876 3.9876 4.0010 4.0049 4.8044 4.8044 5.0057 5.0057 5.0733 5.0779 5.4725 5.4759 5.4759 5.4828 5.5873 5.5873 7.9770 7.9803 7.9803 7.9832 8.6052 8.6565 8.6691 8.6691 8.8136 8.8136 9.0459 9.0459 9.7484 9.7632 9.8134 9.8134 k = 0.2429 0.3435 0.5949 ( 9132 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8772 -5.8772 -5.7478 -5.7473 -5.7473 -5.7376 -5.6873 -5.6873 -5.4431 -5.4423 -5.4415 -5.4415 -5.3889 -5.3889 -5.3194 -5.3194 -5.2308 -5.2259 -5.2259 -5.2147 -3.2805 -3.2804 -3.2783 -3.2783 -3.2753 -3.2753 -3.2407 -3.2407 -3.2368 -3.2361 -3.2361 -3.2350 -3.1983 -3.1957 -3.1957 -3.1941 -3.1553 -3.1553 0.9641 0.9641 1.0020 1.0020 1.0092 1.0104 3.3373 3.3384 3.3394 3.3394 3.3904 3.3904 3.9329 3.9329 3.9887 3.9887 3.9957 3.9979 4.8233 4.8233 5.0110 5.0110 5.0511 5.0541 5.4935 5.4935 5.4947 5.4990 5.5546 5.5546 7.9807 7.9821 7.9821 7.9837 8.6514 8.6763 8.6973 8.6973 8.7824 8.7824 9.0220 9.0220 9.7711 9.7805 9.8062 9.8062 k = 0.2500 0.3536 0.6124 ( 9168 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8768 -5.8768 -5.7451 -5.7451 -5.7451 -5.7451 -5.6874 -5.6874 -5.4421 -5.4421 -5.4421 -5.4421 -5.3886 -5.3886 -5.3197 -5.3197 -5.2244 -5.2244 -5.2244 -5.2244 -3.2789 -3.2789 -3.2789 -3.2789 -3.2761 -3.2761 -3.2405 -3.2405 -3.2361 -3.2361 -3.2361 -3.2361 -3.1960 -3.1960 -3.1960 -3.1960 -3.1554 -3.1554 0.9828 0.9828 0.9963 0.9963 0.9963 0.9963 3.3387 3.3387 3.3387 3.3387 3.3915 3.3915 3.9320 3.9320 3.9918 3.9918 3.9918 3.9918 4.8290 4.8290 5.0288 5.0288 5.0288 5.0288 5.5102 5.5102 5.5181 5.5181 5.5181 5.5181 7.9827 7.9827 7.9827 7.9827 8.6953 8.6953 8.6953 8.6953 8.7628 8.7628 9.0144 9.0144 9.7936 9.7936 9.7936 9.7936 k = 0.2500 0.3536 0.6124 ( 9168 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8768 -5.8768 -5.7451 -5.7451 -5.7451 -5.7451 -5.6874 -5.6874 -5.4421 -5.4421 -5.4421 -5.4421 -5.3886 -5.3886 -5.3197 -5.3197 -5.2244 -5.2244 -5.2244 -5.2244 -3.2789 -3.2789 -3.2789 -3.2789 -3.2761 -3.2761 -3.2405 -3.2405 -3.2361 -3.2361 -3.2361 -3.2361 -3.1960 -3.1960 -3.1960 -3.1960 -3.1554 -3.1554 0.9828 0.9828 0.9963 0.9963 0.9963 0.9963 3.3387 3.3387 3.3387 3.3387 3.3915 3.3915 3.9320 3.9320 3.9918 3.9918 3.9918 3.9918 4.8290 4.8290 5.0288 5.0288 5.0288 5.0288 5.5102 5.5102 5.5181 5.5181 5.5181 5.5181 7.9827 7.9827 7.9827 7.9827 8.6953 8.6953 8.6953 8.6953 8.7628 8.7628 9.0144 9.0144 9.7936 9.7936 9.7936 9.7936 k = 0.2571 0.3334 0.6124 ( 9123 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8771 -5.8771 -5.7521 -5.7428 -5.7428 -5.7423 -5.6873 -5.6873 -5.4427 -5.4427 -5.4419 -5.4411 -5.3889 -5.3889 -5.3195 -5.3195 -5.2340 -5.2224 -5.2224 -5.2184 -3.2809 -3.2809 -3.2774 -3.2773 -3.2758 -3.2758 -3.2407 -3.2407 -3.2370 -3.2358 -3.2356 -3.2356 -3.1979 -3.1963 -3.1963 -3.1934 -3.1553 -3.1553 0.9717 0.9717 0.9809 0.9820 1.0225 1.0225 3.3376 3.3376 3.3389 3.3404 3.3903 3.3903 3.9329 3.9329 3.9869 3.9897 3.9972 3.9972 4.8250 4.8250 5.0037 5.0078 5.0569 5.0569 5.4717 5.4717 5.5325 5.5325 5.5390 5.5420 7.9805 7.9825 7.9825 7.9837 8.6471 8.6471 8.7133 8.7359 8.7732 8.7732 9.0206 9.0206 9.7739 9.7739 9.8006 9.8138 k = 0.2643 0.3131 0.6124 ( 9111 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8779 -5.8779 -5.7586 -5.7406 -5.7406 -5.7394 -5.6870 -5.6870 -5.4431 -5.4431 -5.4417 -5.4401 -5.3898 -5.3898 -5.3189 -5.3189 -5.2436 -5.2200 -5.2200 -5.2129 -3.2832 -3.2832 -3.2760 -3.2758 -3.2753 -3.2753 -3.2412 -3.2412 -3.2378 -3.2358 -3.2348 -3.2348 -3.1997 -3.1965 -3.1965 -3.1905 -3.1551 -3.1551 0.9559 0.9559 0.9642 0.9663 1.0553 1.0553 3.3360 3.3360 3.3388 3.3424 3.3867 3.3867 3.9357 3.9357 3.9834 3.9894 4.0050 4.0050 4.8162 4.8162 4.9801 4.9890 5.0909 5.0909 5.4245 5.4245 5.5519 5.5519 5.5607 5.5657 7.9774 7.9816 7.9816 7.9840 8.5841 8.5841 8.7303 8.7728 8.7864 8.7864 9.0362 9.0362 9.7479 9.7479 9.7999 9.8298 k = 0.2714 0.2929 0.6124 ( 9123 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8791 -5.8791 -5.7646 -5.7385 -5.7385 -5.7363 -5.6865 -5.6865 -5.4434 -5.4434 -5.4416 -5.4391 -5.3913 -5.3913 -5.3182 -5.3182 -5.2531 -5.2171 -5.2171 -5.2080 -3.2856 -3.2856 -3.2749 -3.2749 -3.2747 -3.2743 -3.2419 -3.2419 -3.2385 -3.2361 -3.2338 -3.2338 -3.2015 -3.1967 -3.1967 -3.1874 -3.1547 -3.1547 0.9383 0.9383 0.9459 0.9488 1.0914 1.0914 3.3339 3.3339 3.3386 3.3446 3.3805 3.3805 3.9404 3.9404 3.9814 3.9914 4.0151 4.0151 4.8063 4.8063 4.9590 4.9731 5.1275 5.1275 5.3745 5.3745 5.5709 5.5709 5.5823 5.5889 7.9736 7.9802 7.9802 7.9840 8.5177 8.5177 8.7466 8.7951 8.7951 8.8059 9.0574 9.0574 9.7180 9.7180 9.7906 9.8392 k = 0.2786 0.2727 0.6124 ( 9120 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8804 -5.8804 -5.7700 -5.7365 -5.7365 -5.7330 -5.6858 -5.6858 -5.4437 -5.4437 -5.4414 -5.4381 -5.3931 -5.3931 -5.3175 -5.3175 -5.2624 -5.2138 -5.2138 -5.2035 -3.2881 -3.2881 -3.2746 -3.2746 -3.2734 -3.2728 -3.2428 -3.2428 -3.2391 -3.2366 -3.2327 -3.2327 -3.2032 -3.1968 -3.1968 -3.1842 -3.1542 -3.1542 0.9189 0.9189 0.9259 0.9296 1.1308 1.1308 3.3309 3.3309 3.3382 3.3470 3.3722 3.3722 3.9471 3.9471 3.9812 3.9957 4.0270 4.0270 4.7976 4.7976 4.9408 4.9606 5.1645 5.1645 5.3235 5.3235 5.5891 5.5891 5.6036 5.6112 7.9695 7.9785 7.9785 7.9842 8.4517 8.4517 8.7620 8.7985 8.7985 8.8351 9.0807 9.0807 9.6867 9.6867 9.7726 9.8404 k = 0.2857 0.2525 0.6124 ( 9121 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8818 -5.8818 -5.7747 -5.7348 -5.7348 -5.7296 -5.6847 -5.6847 -5.4438 -5.4438 -5.4413 -5.4370 -5.3951 -5.3951 -5.3170 -5.3170 -5.2716 -5.2102 -5.2102 -5.1996 -3.2907 -3.2907 -3.2744 -3.2744 -3.2722 -3.2713 -3.2438 -3.2438 -3.2395 -3.2373 -3.2317 -3.2317 -3.2049 -3.1968 -3.1968 -3.1810 -3.1536 -3.1536 0.8978 0.8978 0.9041 0.9084 1.1731 1.1731 3.3268 3.3268 3.3375 3.3495 3.3621 3.3621 3.9560 3.9560 3.9831 4.0027 4.0402 4.0402 4.7911 4.7911 4.9260 4.9517 5.1983 5.1983 5.2750 5.2750 5.6063 5.6063 5.6240 5.6323 7.9654 7.9765 7.9765 7.9847 8.3882 8.3882 8.7767 8.7969 8.7969 8.8603 9.1038 9.1038 9.6562 9.6562 9.7468 9.8321 k = 0.2929 0.2323 0.6124 ( 9112 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8831 -5.8831 -5.7789 -5.7333 -5.7333 -5.7260 -5.6834 -5.6834 -5.4438 -5.4438 -5.4411 -5.4359 -5.3974 -5.3974 -5.3167 -5.3167 -5.2805 -5.2063 -5.2063 -5.1962 -3.2933 -3.2933 -3.2744 -3.2744 -3.2711 -3.2698 -3.2450 -3.2450 -3.2399 -3.2381 -3.2307 -3.2307 -3.2066 -3.1967 -3.1967 -3.1779 -3.1528 -3.1528 0.8748 0.8748 0.8806 0.8854 1.2183 1.2184 3.3212 3.3212 3.3365 3.3510 3.3510 3.3520 3.9671 3.9671 3.9874 4.0126 4.0538 4.0538 4.7874 4.7874 4.9148 4.9467 5.2008 5.2008 5.2574 5.2574 5.6221 5.6221 5.6434 5.6521 7.9615 7.9742 7.9742 7.9857 8.3289 8.3289 8.7903 8.7903 8.7905 8.8817 9.1251 9.1251 9.6280 9.6280 9.7144 9.8142 k = 0.3000 0.2121 0.6124 ( 9133 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8843 -5.8843 -5.7825 -5.7319 -5.7319 -5.7223 -5.6818 -5.6818 -5.4437 -5.4437 -5.4410 -5.4349 -5.3998 -5.3998 -5.3168 -5.3168 -5.2893 -5.2024 -5.2024 -5.1934 -3.2959 -3.2959 -3.2744 -3.2744 -3.2701 -3.2683 -3.2462 -3.2462 -3.2402 -3.2390 -3.2297 -3.2297 -3.2082 -3.1965 -3.1965 -3.1748 -3.1520 -3.1520 0.8501 0.8501 0.8553 0.8605 1.2664 1.2664 3.3132 3.3132 3.3352 3.3401 3.3401 3.3544 3.9806 3.9806 3.9943 4.0256 4.0670 4.0670 4.7868 4.7868 4.9072 4.9457 5.1579 5.1579 5.2859 5.2859 5.6366 5.6366 5.6615 5.6704 7.9581 7.9713 7.9713 7.9875 8.2748 8.2748 8.7789 8.7789 8.8031 8.8991 9.1437 9.1437 9.6027 9.6027 9.6772 9.7875 k = 0.3071 0.1919 0.6124 ( 9097 PWs) bands (ev): -48.7674 -48.7674 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8853 -5.8853 -5.7854 -5.7307 -5.7307 -5.7185 -5.6801 -5.6801 -5.4434 -5.4434 -5.4409 -5.4338 -5.4022 -5.4022 -5.3172 -5.3172 -5.2978 -5.1984 -5.1984 -5.1912 -3.2984 -3.2984 -3.2745 -3.2745 -3.2692 -3.2669 -3.2475 -3.2475 -3.2403 -3.2398 -3.2289 -3.2289 -3.2098 -3.1961 -3.1961 -3.1719 -3.1511 -3.1511 0.8236 0.8236 0.8283 0.8337 1.3169 1.3170 3.3022 3.3022 3.3304 3.3304 3.3337 3.3566 3.9964 3.9964 4.0042 4.0417 4.0789 4.0789 4.7892 4.7892 4.9033 4.9485 5.1109 5.1109 5.3197 5.3197 5.6496 5.6496 5.6782 5.6871 7.9554 7.9675 7.9675 7.9903 8.2274 8.2274 8.7628 8.7628 8.8144 8.9123 9.1594 9.1594 9.5803 9.5803 9.6372 9.7537 k = 0.3143 0.1717 0.6124 ( 9115 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8859 -5.8859 -5.7878 -5.7296 -5.7296 -5.7145 -5.6781 -5.6781 -5.4431 -5.4431 -5.4408 -5.4327 -5.4047 -5.4047 -5.3179 -5.3179 -5.3060 -5.1946 -5.1946 -5.1895 -3.3010 -3.3010 -3.2747 -3.2747 -3.2685 -3.2655 -3.2490 -3.2490 -3.2406 -3.2405 -3.2281 -3.2281 -3.2113 -3.1957 -3.1957 -3.1691 -3.1502 -3.1502 0.7955 0.7955 0.7997 0.8052 1.3699 1.3699 3.2884 3.2884 3.3222 3.3222 3.3318 3.3584 4.0140 4.0140 4.0171 4.0611 4.0889 4.0889 4.7945 4.7945 4.9030 4.9553 5.0666 5.0666 5.3533 5.3533 5.6609 5.6609 5.6934 5.7021 7.9536 7.9619 7.9619 7.9940 8.1875 8.1875 8.7422 8.7422 8.8238 8.9209 9.1724 9.1724 9.5598 9.5598 9.5961 9.7150 k = 0.3214 0.1515 0.6124 ( 9121 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8863 -5.8863 -5.7894 -5.7285 -5.7285 -5.7105 -5.6761 -5.6761 -5.4426 -5.4426 -5.4407 -5.4316 -5.4071 -5.4071 -5.3188 -5.3188 -5.3140 -5.1909 -5.1909 -5.1885 -3.3036 -3.3036 -3.2750 -3.2750 -3.2680 -3.2641 -3.2505 -3.2505 -3.2414 -3.2406 -3.2274 -3.2274 -3.2127 -3.1952 -3.1952 -3.1666 -3.1493 -3.1493 0.7658 0.7658 0.7696 0.7751 1.4251 1.4251 3.2731 3.2731 3.3148 3.3148 3.3297 3.3597 4.0320 4.0320 4.0331 4.0836 4.0972 4.0972 4.8022 4.8022 4.9063 4.9658 5.0270 5.0270 5.3857 5.3857 5.6706 5.6706 5.7070 5.7154 7.9528 7.9541 7.9541 7.9989 8.1562 8.1562 8.7179 8.7179 8.8308 8.9245 9.1833 9.1833 9.5399 9.5399 9.5556 9.6736 k = 0.3286 0.1313 0.6124 ( 9127 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8863 -5.8863 -5.7905 -5.7275 -5.7275 -5.7064 -5.6740 -5.6740 -5.4420 -5.4420 -5.4407 -5.4306 -5.4095 -5.4095 -5.3216 -5.3201 -5.3201 -5.1880 -5.1876 -5.1876 -3.3062 -3.3062 -3.2753 -3.2753 -3.2677 -3.2627 -3.2520 -3.2520 -3.2420 -3.2406 -3.2268 -3.2268 -3.2140 -3.1946 -3.1946 -3.1643 -3.1484 -3.1484 0.7348 0.7348 0.7382 0.7435 1.4821 1.4821 3.2573 3.2573 3.3079 3.3079 3.3275 3.3606 4.0467 4.0467 4.0523 4.1063 4.1063 4.1093 4.8117 4.8117 4.9129 4.9800 4.9937 4.9937 5.4168 5.4168 5.6785 5.6785 5.7190 5.7268 7.9433 7.9433 7.9532 8.0049 8.1341 8.1341 8.6907 8.6907 8.8349 8.9224 9.1928 9.1928 9.5175 9.5189 9.5189 9.6316 k = 0.3357 0.1111 0.6124 ( 9115 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8858 -5.8858 -5.7909 -5.7263 -5.7263 -5.7022 -5.6719 -5.6719 -5.4412 -5.4412 -5.4407 -5.4295 -5.4117 -5.4117 -5.3288 -5.3215 -5.3215 -5.1880 -5.1847 -5.1847 -3.3088 -3.3088 -3.2757 -3.2757 -3.2676 -3.2614 -3.2536 -3.2536 -3.2425 -3.2407 -3.2263 -3.2263 -3.2152 -3.1940 -3.1940 -3.1622 -3.1475 -3.1475 0.7026 0.7026 0.7056 0.7108 1.5406 1.5406 3.2416 3.2416 3.3011 3.3011 3.3251 3.3610 4.0520 4.0520 4.0745 4.1215 4.1215 4.1378 4.8217 4.8217 4.9229 4.9686 4.9686 4.9978 5.4464 5.4464 5.6849 5.6849 5.7294 5.7364 7.9298 7.9298 7.9547 8.0121 8.1207 8.1207 8.6618 8.6618 8.8355 8.9143 9.2011 9.2011 9.4829 9.4954 9.4954 9.5906 k = 0.3429 0.0909 0.6124 ( 9148 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8849 -5.8849 -5.7908 -5.7251 -5.7251 -5.6980 -5.6699 -5.6699 -5.4406 -5.4403 -5.4403 -5.4285 -5.4139 -5.4139 -5.3356 -5.3232 -5.3232 -5.1887 -5.1823 -5.1823 -3.3114 -3.3114 -3.2762 -3.2762 -3.2677 -3.2601 -3.2552 -3.2552 -3.2428 -3.2408 -3.2259 -3.2259 -3.2162 -3.1933 -3.1933 -3.1604 -3.1467 -3.1467 0.6694 0.6694 0.6721 0.6770 1.6004 1.6004 3.2267 3.2267 3.2945 3.2945 3.3227 3.3609 4.0453 4.0453 4.0995 4.1447 4.1447 4.1688 4.8301 4.8301 4.9361 4.9539 4.9539 5.0190 5.4744 5.4744 5.6895 5.6895 5.7381 5.7442 7.9144 7.9144 7.9574 8.0205 8.1148 8.1148 8.6324 8.6324 8.8320 8.9000 9.2086 9.2086 9.4527 9.4687 9.4687 9.5520 k = 0.3500 0.0707 0.6124 ( 9142 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8836 -5.8836 -5.7900 -5.7238 -5.7238 -5.6937 -5.6680 -5.6680 -5.4406 -5.4393 -5.4393 -5.4276 -5.4158 -5.4158 -5.3419 -5.3250 -5.3250 -5.1898 -5.1805 -5.1805 -3.3139 -3.3139 -3.2766 -3.2766 -3.2680 -3.2590 -3.2568 -3.2568 -3.2430 -3.2410 -3.2255 -3.2255 -3.2169 -3.1926 -3.1926 -3.1589 -3.1460 -3.1460 0.6356 0.6356 0.6379 0.6426 1.6609 1.6609 3.2131 3.2131 3.2882 3.2882 3.3203 3.3603 4.0289 4.0289 4.1270 4.1731 4.1731 4.2020 4.8348 4.8348 4.9517 4.9517 4.9525 5.0434 5.5008 5.5008 5.6925 5.6925 5.7453 5.7501 7.8980 7.8980 7.9613 8.0299 8.1148 8.1148 8.6039 8.6039 8.8242 8.8796 9.2152 9.2152 9.4273 9.4382 9.4382 9.5169 k = 0.3571 0.0505 0.6124 ( 9148 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8818 -5.8818 -5.7886 -5.7224 -5.7224 -5.6896 -5.6662 -5.6662 -5.4406 -5.4383 -5.4383 -5.4269 -5.4176 -5.4176 -5.3477 -5.3269 -5.3269 -5.1915 -5.1793 -5.1793 -3.3164 -3.3164 -3.2771 -3.2771 -3.2685 -3.2583 -3.2583 -3.2580 -3.2431 -3.2412 -3.2253 -3.2253 -3.2174 -3.1919 -3.1919 -3.1576 -3.1454 -3.1454 0.6013 0.6013 0.6033 0.6076 1.7217 1.7217 3.2013 3.2013 3.2823 3.2823 3.3180 3.3593 4.0051 4.0051 4.1567 4.2043 4.2043 4.2369 4.8350 4.8350 4.9619 4.9619 4.9719 5.0709 5.5256 5.5256 5.6940 5.6940 5.7509 5.7543 7.8812 7.8812 7.9663 8.0403 8.1191 8.1191 8.5775 8.5775 8.8120 8.8538 9.2207 9.2207 9.4044 9.4044 9.4063 9.4857 k = 0.3643 0.0303 0.6124 ( 9139 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8796 -5.8796 -5.7867 -5.7209 -5.7209 -5.6854 -5.6647 -5.6647 -5.4407 -5.4372 -5.4372 -5.4262 -5.4189 -5.4189 -5.3529 -5.3289 -5.3288 -5.1938 -5.1787 -5.1787 -3.3190 -3.3190 -3.2776 -3.2776 -3.2691 -3.2597 -3.2597 -3.2572 -3.2430 -3.2415 -3.2251 -3.2251 -3.2176 -3.1912 -3.1912 -3.1566 -3.1449 -3.1449 0.5667 0.5667 0.5685 0.5725 1.7823 1.7823 3.1918 3.1918 3.2767 3.2767 3.3159 3.3580 3.9757 3.9757 4.1881 4.2372 4.2372 4.2731 4.8326 4.8326 4.9819 4.9819 4.9943 5.1014 5.5489 5.5489 5.6939 5.6939 5.7552 5.7568 7.8642 7.8642 7.9722 8.0516 8.1266 8.1266 8.5546 8.5546 8.7956 8.8237 9.2244 9.2244 9.3683 9.3683 9.3891 9.4584 k = 0.3714 0.0101 0.6124 ( 9127 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8769 -5.8769 -5.7842 -5.7193 -5.7193 -5.6815 -5.6633 -5.6633 -5.4407 -5.4362 -5.4362 -5.4258 -5.4198 -5.4198 -5.3574 -5.3308 -5.3308 -5.1965 -5.1788 -5.1788 -3.3214 -3.3214 -3.2780 -3.2780 -3.2698 -3.2610 -3.2610 -3.2567 -3.2428 -3.2417 -3.2250 -3.2250 -3.2175 -3.1904 -3.1904 -3.1559 -3.1445 -3.1445 0.5322 0.5322 0.5338 0.5374 1.8420 1.8420 3.1849 3.1849 3.2717 3.2717 3.3140 3.3565 3.9420 3.9420 4.2210 4.2709 4.2709 4.3101 4.8293 4.8293 5.0088 5.0088 5.0196 5.1345 5.5706 5.5706 5.6924 5.6924 5.7576 5.7581 7.8469 7.8469 7.9790 8.0634 8.1362 8.1362 8.5358 8.5358 8.7758 8.7906 9.2250 9.2250 9.3317 9.3317 9.3748 9.4346 k = 0.3786-0.0101 0.6124 ( 9124 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8737 -5.8737 -5.7812 -5.7176 -5.7176 -5.6777 -5.6623 -5.6623 -5.4408 -5.4355 -5.4355 -5.4257 -5.4200 -5.4200 -5.3611 -5.3328 -5.3328 -5.1998 -5.1796 -5.1796 -3.3239 -3.3239 -3.2784 -3.2784 -3.2707 -3.2623 -3.2623 -3.2565 -3.2425 -3.2419 -3.2251 -3.2251 -3.2171 -3.1897 -3.1897 -3.1555 -3.1443 -3.1443 0.4980 0.4980 0.4994 0.5026 1.9003 1.9003 3.1811 3.1811 3.2674 3.2674 3.3123 3.3547 3.9053 3.9053 4.2547 4.3048 4.3048 4.3473 4.8259 4.8259 5.0408 5.0408 5.0477 5.1702 5.5908 5.5908 5.6897 5.6897 5.7570 5.7599 7.8290 7.8290 7.9863 8.0757 8.1470 8.1470 8.5220 8.5220 8.7533 8.7559 9.2197 9.2197 9.2987 9.2987 9.3623 9.4137 k = 0.3857-0.0303 0.6124 ( 9118 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8702 -5.8702 -5.7778 -5.7158 -5.7158 -5.6742 -5.6616 -5.6616 -5.4409 -5.4352 -5.4352 -5.4259 -5.4193 -5.4193 -5.3640 -5.3347 -5.3347 -5.2035 -5.1811 -5.1811 -3.3263 -3.3263 -3.2787 -3.2787 -3.2716 -3.2635 -3.2635 -3.2566 -3.2422 -3.2419 -3.2253 -3.2253 -3.2164 -3.1890 -3.1890 -3.1554 -3.1441 -3.1441 0.4644 0.4644 0.4656 0.4684 1.9563 1.9563 3.1806 3.1806 3.2639 3.2639 3.3110 3.3529 3.8668 3.8668 4.2890 4.3383 4.3383 4.3841 4.8223 4.8223 5.0766 5.0766 5.0785 5.2080 5.6095 5.6095 5.6858 5.6858 5.7549 5.7607 7.8103 7.8103 7.9940 8.0880 8.1581 8.1581 8.5131 8.5131 8.7206 8.7293 9.2031 9.2031 9.2755 9.2755 9.3507 9.3947 k = 0.3929-0.0505 0.6124 ( 9121 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8662 -5.8662 -5.7738 -5.7140 -5.7140 -5.6709 -5.6612 -5.6612 -5.4409 -5.4354 -5.4354 -5.4264 -5.4177 -5.4177 -5.3659 -5.3364 -5.3364 -5.2077 -5.1833 -5.1833 -3.3286 -3.3286 -3.2789 -3.2789 -3.2725 -3.2645 -3.2645 -3.2572 -3.2418 -3.2417 -3.2255 -3.2255 -3.2154 -3.1883 -3.1883 -3.1555 -3.1441 -3.1441 0.4315 0.4315 0.4326 0.4350 2.0096 2.0096 3.1834 3.1834 3.2615 3.2615 3.3100 3.3509 3.8278 3.8278 4.3234 4.3711 4.3711 4.4202 4.8183 4.8183 5.1116 5.1155 5.1155 5.2475 5.6266 5.6266 5.6812 5.6812 5.7517 5.7607 7.7905 7.7905 8.0018 8.1000 8.1688 8.1688 8.5090 8.5090 8.6861 8.7047 9.1755 9.1755 9.2635 9.2635 9.3393 9.3768 k = 0.4000-0.0707 0.6124 ( 9121 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8620 -5.8620 -5.7695 -5.7122 -5.7121 -5.6681 -5.6613 -5.6613 -5.4410 -5.4359 -5.4359 -5.4273 -5.4154 -5.4154 -5.3668 -5.3380 -5.3380 -5.2123 -5.1863 -5.1863 -3.3308 -3.3308 -3.2791 -3.2791 -3.2735 -3.2655 -3.2655 -3.2581 -3.2415 -3.2414 -3.2259 -3.2259 -3.2141 -3.1876 -3.1876 -3.1559 -3.1442 -3.1442 0.3997 0.3997 0.4006 0.4027 2.0593 2.0593 3.1892 3.1892 3.2607 3.2607 3.3092 3.3490 3.7893 3.7893 4.3576 4.4028 4.4028 4.4549 4.8134 4.8134 5.1467 5.1566 5.1566 5.2884 5.6415 5.6415 5.6765 5.6765 5.7474 5.7601 7.7699 7.7699 8.0094 8.1113 8.1781 8.1781 8.5086 8.5086 8.6531 8.6806 9.1445 9.1445 9.2566 9.2566 9.3275 9.3593 k = 0.4071-0.0909 0.6124 ( 9133 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8573 -5.8573 -5.7648 -5.7103 -5.7103 -5.6656 -5.6617 -5.6617 -5.4412 -5.4365 -5.4365 -5.4285 -5.4124 -5.4124 -5.3668 -5.3394 -5.3394 -5.2173 -5.1899 -5.1899 -3.3330 -3.3330 -3.2792 -3.2792 -3.2744 -3.2663 -3.2663 -3.2592 -3.2411 -3.2410 -3.2265 -3.2265 -3.2127 -3.1869 -3.1869 -3.1566 -3.1444 -3.1444 0.3691 0.3691 0.3699 0.3717 2.1050 2.1050 3.1968 3.1968 3.2623 3.2623 3.3088 3.3470 3.7525 3.7525 4.3912 4.4331 4.4331 4.4880 4.8074 4.8074 5.1836 5.1992 5.1992 5.3300 5.6517 5.6517 5.6747 5.6747 5.7424 5.7591 7.7487 7.7487 8.0167 8.1215 8.1854 8.1854 8.5107 8.5107 8.6225 8.6578 9.1158 9.1158 9.2508 9.2508 9.3151 9.3416 k = 0.4143-0.1111 0.6124 ( 9157 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8525 -5.8525 -5.7597 -5.7084 -5.7084 -5.6637 -5.6626 -5.6626 -5.4413 -5.4373 -5.4373 -5.4300 -5.4089 -5.4089 -5.3658 -5.3404 -5.3404 -5.2227 -5.1943 -5.1943 -3.3351 -3.3351 -3.2791 -3.2791 -3.2752 -3.2671 -3.2671 -3.2606 -3.2406 -3.2405 -3.2271 -3.2271 -3.2110 -3.1863 -3.1863 -3.1575 -3.1447 -3.1447 0.3400 0.3400 0.3407 0.3422 2.1462 2.1462 3.2045 3.2045 3.2676 3.2676 3.3087 3.3450 3.7185 3.7185 4.4239 4.4620 4.4620 4.5191 4.8000 4.8000 5.2215 5.2427 5.2427 5.3716 5.6517 5.6517 5.6813 5.6813 5.7369 5.7581 7.7273 7.7273 8.0233 8.1302 8.1900 8.1900 8.5138 8.5138 8.5950 8.6369 9.0927 9.0927 9.2444 9.2444 9.3018 9.3233 k = 0.4214-0.1313 0.6124 ( 9160 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8474 -5.8474 -5.7543 -5.7066 -5.7066 -5.6639 -5.6639 -5.6624 -5.4414 -5.4381 -5.4381 -5.4315 -5.4051 -5.4051 -5.3639 -5.3410 -5.3410 -5.2285 -5.1993 -5.1993 -3.3370 -3.3370 -3.2790 -3.2790 -3.2760 -3.2677 -3.2677 -3.2621 -3.2402 -3.2401 -3.2279 -3.2279 -3.2091 -3.1857 -3.1857 -3.1587 -3.1451 -3.1451 0.3125 0.3125 0.3131 0.3143 2.1828 2.1828 3.2103 3.2103 3.2776 3.2776 3.3089 3.3431 3.6887 3.6887 4.4556 4.4891 4.4891 4.5479 4.7911 4.7911 5.2599 5.2862 5.2862 5.4124 5.6457 5.6457 5.6927 5.6927 5.7313 5.7574 7.7061 7.7061 8.0292 8.1369 8.1913 8.1913 8.5166 8.5166 8.5710 8.6183 9.0770 9.0770 9.2371 9.2371 9.2876 9.3044 k = 0.4286-0.1515 0.6124 ( 9172 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8422 -5.8422 -5.7486 -5.7048 -5.7048 -5.6656 -5.6656 -5.6616 -5.4416 -5.4388 -5.4388 -5.4332 -5.4012 -5.4012 -5.3613 -5.3410 -5.3410 -5.2346 -5.2049 -5.2049 -3.3388 -3.3388 -3.2788 -3.2788 -3.2768 -3.2682 -3.2682 -3.2637 -3.2397 -3.2397 -3.2288 -3.2288 -3.2070 -3.1851 -3.1851 -3.1600 -3.1455 -3.1455 0.2869 0.2869 0.2873 0.2883 2.2146 2.2146 3.2133 3.2133 3.2915 3.2915 3.3093 3.3412 3.6645 3.6645 4.4859 4.5143 4.5143 4.5742 4.7806 4.7806 5.2980 5.3289 5.3289 5.4513 5.6380 5.6380 5.7048 5.7048 5.7264 5.7573 7.6855 7.6855 8.0343 8.1414 8.1889 8.1889 8.5183 8.5183 8.5509 8.6022 9.0691 9.0691 9.2287 9.2287 9.2728 9.2849 k = 0.4357-0.1717 0.6124 ( 9160 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8369 -5.8369 -5.7427 -5.7031 -5.7031 -5.6676 -5.6676 -5.6615 -5.4417 -5.4395 -5.4395 -5.4347 -5.3973 -5.3973 -5.3579 -5.3404 -5.3404 -5.2410 -5.2110 -5.2110 -3.3405 -3.3405 -3.2785 -3.2785 -3.2774 -3.2686 -3.2686 -3.2653 -3.2393 -3.2393 -3.2298 -3.2298 -3.2048 -3.1845 -3.1845 -3.1616 -3.1460 -3.1460 0.2632 0.2632 0.2635 0.2643 2.2418 2.2418 3.2141 3.2141 3.3066 3.3066 3.3100 3.3393 3.6477 3.6477 4.5146 4.5375 4.5375 4.5979 4.7685 4.7685 5.3351 5.3697 5.3697 5.4870 5.6297 5.6297 5.7168 5.7168 5.7228 5.7580 7.6659 7.6659 8.0388 8.1434 8.1826 8.1826 8.5190 8.5190 8.5347 8.5885 9.0688 9.0688 9.2194 9.2194 9.2575 9.2652 k = 0.4429-0.1919 0.6124 ( 9160 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8316 -5.8316 -5.7367 -5.7014 -5.7014 -5.6699 -5.6699 -5.6620 -5.4419 -5.4401 -5.4401 -5.4362 -5.3937 -5.3937 -5.3539 -5.3388 -5.3388 -5.2477 -5.2176 -5.2176 -3.3420 -3.3420 -3.2782 -3.2782 -3.2779 -3.2688 -3.2688 -3.2669 -3.2390 -3.2389 -3.2309 -3.2309 -3.2025 -3.1840 -3.1840 -3.1633 -3.1465 -3.1465 0.2416 0.2416 0.2419 0.2425 2.2647 2.2647 3.2134 3.2134 3.3109 3.3199 3.3199 3.3374 3.6398 3.6398 4.5416 4.5586 4.5586 4.6187 4.7551 4.7551 5.3702 5.4079 5.4079 5.5177 5.6216 5.6216 5.7217 5.7285 5.7285 5.7599 7.6478 7.6478 8.0429 8.1430 8.1728 8.1728 8.5188 8.5188 8.5225 8.5769 9.0745 9.0745 9.2096 9.2096 9.2420 9.2458 k = 0.4500-0.2121 0.6124 ( 9160 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8265 -5.8265 -5.7305 -5.6999 -5.6999 -5.6725 -5.6725 -5.6632 -5.4420 -5.4406 -5.4406 -5.4376 -5.3904 -5.3904 -5.3494 -5.3364 -5.3364 -5.2546 -5.2247 -5.2247 -3.3434 -3.3434 -3.2783 -3.2778 -3.2778 -3.2689 -3.2689 -3.2685 -3.2386 -3.2385 -3.2320 -3.2320 -3.2001 -3.1836 -3.1836 -3.1652 -3.1469 -3.1469 0.2223 0.2223 0.2225 0.2229 2.2836 2.2836 3.2119 3.2119 3.3121 3.3289 3.3289 3.3356 3.6415 3.6415 4.5667 4.5774 4.5774 4.6366 4.7408 4.7408 5.4027 5.4424 5.4424 5.5418 5.6140 5.6140 5.7244 5.7399 5.7399 5.7632 7.6313 7.6313 8.0467 8.1402 8.1601 8.1601 8.5138 8.5184 8.5184 8.5672 9.0844 9.0844 9.1996 9.1996 9.2269 9.2272 k = 0.4571-0.2323 0.6124 ( 9154 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8216 -5.8216 -5.7243 -5.6984 -5.6984 -5.6752 -5.6752 -5.6651 -5.4421 -5.4410 -5.4410 -5.4387 -5.3877 -5.3877 -5.3443 -5.3328 -5.3328 -5.2616 -5.2321 -5.2321 -3.3446 -3.3446 -3.2785 -3.2776 -3.2776 -3.2700 -3.2688 -3.2688 -3.2383 -3.2382 -3.2331 -3.2331 -3.1976 -3.1831 -3.1831 -3.1673 -3.1474 -3.1474 0.2053 0.2053 0.2055 0.2058 2.2990 2.2990 3.2097 3.2097 3.3133 3.3332 3.3332 3.3338 3.6519 3.6519 4.5897 4.5937 4.5937 4.6516 4.7260 4.7260 5.4321 5.4724 5.4724 5.5579 5.6074 5.6074 5.7315 5.7508 5.7508 5.7677 7.6167 7.6167 8.0507 8.1355 8.1457 8.1457 8.5083 8.5181 8.5181 8.5587 9.0965 9.0965 9.1898 9.1898 9.2099 9.2124 k = 0.4643-0.2525 0.6124 ( 9160 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8171 -5.8171 -5.7180 -5.6971 -5.6971 -5.6780 -5.6780 -5.6676 -5.4422 -5.4414 -5.4414 -5.4397 -5.3856 -5.3856 -5.3387 -5.3284 -5.3284 -5.2689 -5.2397 -5.2397 -3.3456 -3.3456 -3.2786 -3.2773 -3.2773 -3.2715 -3.2686 -3.2686 -3.2381 -3.2379 -3.2342 -3.2342 -3.1951 -3.1828 -3.1828 -3.1695 -3.1478 -3.1478 0.1908 0.1908 0.1909 0.1911 2.3113 2.3113 3.2073 3.2073 3.3147 3.3320 3.3334 3.3334 3.6685 3.6685 4.6075 4.6075 4.6105 4.6634 4.7115 4.7115 5.4579 5.4971 5.4971 5.5661 5.6022 5.6022 5.7424 5.7612 5.7612 5.7733 7.6042 7.6042 8.0550 8.1292 8.1309 8.1309 8.5055 8.5179 8.5179 8.5511 9.1092 9.1092 9.1809 9.1809 9.1947 9.1991 k = 0.4714-0.2727 0.6124 ( 9148 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8131 -5.8131 -5.7118 -5.6958 -5.6958 -5.6808 -5.6808 -5.6708 -5.4423 -5.4417 -5.4417 -5.4405 -5.3841 -5.3841 -5.3327 -5.3231 -5.3231 -5.2762 -5.2473 -5.2473 -3.3465 -3.3465 -3.2786 -3.2771 -3.2771 -3.2728 -3.2684 -3.2684 -3.2379 -3.2377 -3.2353 -3.2353 -3.1925 -3.1825 -3.1825 -3.1718 -3.1481 -3.1481 0.1788 0.1788 0.1788 0.1790 2.3209 2.3209 3.2047 3.2047 3.3163 3.3302 3.3313 3.3313 3.6880 3.6880 4.6183 4.6183 4.6288 4.6721 4.6983 4.6983 5.4801 5.5159 5.5159 5.5678 5.5989 5.5989 5.7554 5.7708 5.7708 5.7793 7.5939 7.5939 8.0599 8.1168 8.1168 8.1217 8.5049 8.5180 8.5180 8.5440 9.1208 9.1208 9.1732 9.1732 9.1821 9.1872 k = 0.4786-0.2929 0.6124 ( 9142 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8098 -5.8098 -5.7057 -5.6945 -5.6945 -5.6834 -5.6834 -5.6745 -5.4424 -5.4419 -5.4419 -5.4411 -5.3830 -5.3830 -5.3263 -5.3174 -5.3174 -5.2836 -5.2547 -5.2547 -3.3471 -3.3471 -3.2784 -3.2770 -3.2770 -3.2740 -3.2680 -3.2680 -3.2377 -3.2376 -3.2361 -3.2361 -3.1898 -3.1822 -3.1822 -3.1742 -3.1484 -3.1484 0.1694 0.1694 0.1694 0.1695 2.3280 2.3280 3.2023 3.2023 3.3179 3.3283 3.3283 3.3284 3.7070 3.7070 4.6259 4.6259 4.6446 4.6776 4.6875 4.6875 5.4991 5.5287 5.5287 5.5650 5.5979 5.5979 5.7681 5.7790 5.7790 5.7850 7.5858 7.5858 8.0656 8.1047 8.1047 8.1135 8.5063 8.5181 8.5181 8.5372 9.1302 9.1302 9.1673 9.1673 9.1723 9.1773 k = 0.4857-0.3131 0.6124 ( 9115 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8073 -5.8073 -5.6997 -5.6933 -5.6933 -5.6857 -5.6857 -5.6787 -5.4424 -5.4421 -5.4421 -5.4416 -5.3823 -5.3823 -5.3197 -5.3118 -5.3118 -5.2910 -5.2614 -5.2614 -3.3476 -3.3476 -3.2780 -3.2769 -3.2769 -3.2751 -3.2677 -3.2677 -3.2375 -3.2375 -3.2368 -3.2368 -3.1872 -3.1820 -3.1820 -3.1767 -3.1486 -3.1486 0.1626 0.1626 0.1626 0.1627 2.3329 2.3329 3.2004 3.2004 3.3196 3.3256 3.3256 3.3266 3.7228 3.7228 4.6302 4.6302 4.6576 4.6799 4.6800 4.6800 5.5152 5.5362 5.5362 5.5590 5.5985 5.5985 5.7789 5.7853 5.7853 5.7894 7.5799 7.5799 8.0722 8.0954 8.0954 8.1048 8.5092 8.5183 8.5183 8.5306 9.1366 9.1366 9.1636 9.1636 9.1656 9.1695 k = 0.4929-0.3334 0.6124 ( 9115 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8058 -5.8058 -5.6940 -5.6920 -5.6920 -5.6876 -5.6876 -5.6834 -5.4423 -5.4421 -5.4421 -5.4419 -5.3820 -5.3820 -5.3127 -5.3074 -5.3074 -5.2984 -5.2665 -5.2665 -3.3479 -3.3479 -3.2775 -3.2769 -3.2769 -3.2761 -3.2675 -3.2675 -3.2375 -3.2374 -3.2373 -3.2373 -3.1845 -3.1819 -3.1819 -3.1793 -3.1487 -3.1487 0.1586 0.1586 0.1586 0.1586 2.3357 2.3357 3.1991 3.1991 3.3213 3.3237 3.3237 3.3248 3.7331 3.7331 4.6319 4.6319 4.6677 4.6761 4.6761 4.6790 5.5289 5.5397 5.5397 5.5507 5.5996 5.5996 5.7866 5.7894 5.7894 5.7916 7.5764 7.5764 8.0795 8.0896 8.0896 8.0961 8.5133 8.5184 8.5184 8.5242 9.1399 9.1399 9.1620 9.1620 9.1621 9.1642 k = 0.5000-0.3536 0.6124 ( 9136 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8052 -5.8052 -5.6913 -5.6913 -5.6885 -5.6885 -5.6885 -5.6885 -5.4422 -5.4422 -5.4422 -5.4422 -5.3818 -5.3818 -5.3056 -5.3056 -5.3056 -5.3056 -5.2685 -5.2685 -3.3480 -3.3480 -3.2769 -3.2769 -3.2769 -3.2769 -3.2675 -3.2675 -3.2374 -3.2374 -3.2374 -3.2374 -3.1819 -3.1819 -3.1819 -3.1819 -3.1488 -3.1488 0.1572 0.1572 0.1572 0.1572 2.3367 2.3367 3.1986 3.1986 3.3230 3.3230 3.3230 3.3230 3.7367 3.7367 4.6322 4.6322 4.6749 4.6749 4.6749 4.6749 5.5407 5.5407 5.5407 5.5407 5.6002 5.6002 5.7908 5.7908 5.7908 5.7908 7.5753 7.5753 8.0876 8.0876 8.0876 8.0876 8.5184 8.5184 8.5184 8.5184 9.1408 9.1408 9.1617 9.1617 9.1617 9.1617 k = 0.2500 0.3536 0.6124 ( 9168 PWs) bands (ev): -48.7677 -48.7677 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8768 -5.8768 -5.7451 -5.7451 -5.7451 -5.7451 -5.6874 -5.6874 -5.4421 -5.4421 -5.4421 -5.4421 -5.3886 -5.3886 -5.3197 -5.3197 -5.2244 -5.2244 -5.2244 -5.2244 -3.2789 -3.2789 -3.2789 -3.2789 -3.2761 -3.2761 -3.2405 -3.2405 -3.2361 -3.2361 -3.2361 -3.2361 -3.1960 -3.1960 -3.1960 -3.1960 -3.1554 -3.1554 0.9828 0.9828 0.9963 0.9963 0.9963 0.9963 3.3387 3.3387 3.3387 3.3387 3.3915 3.3915 3.9320 3.9320 3.9918 3.9918 3.9918 3.9918 4.8290 4.8290 5.0288 5.0288 5.0288 5.0288 5.5102 5.5102 5.5181 5.5181 5.5181 5.5181 7.9827 7.9827 7.9827 7.9827 8.6953 8.6953 8.6953 8.6953 8.7628 8.7628 9.0144 9.0144 9.7936 9.7936 9.7936 9.7936 k = 0.2381 0.3367 0.6124 ( 9126 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8771 -5.8771 -5.7491 -5.7491 -5.7410 -5.7410 -5.6873 -5.6873 -5.4427 -5.4427 -5.4415 -5.4415 -5.3889 -5.3889 -5.3195 -5.3195 -5.2300 -5.2300 -5.2187 -5.2187 -3.2806 -3.2806 -3.2779 -3.2779 -3.2755 -3.2755 -3.2407 -3.2407 -3.2365 -3.2365 -3.2355 -3.2355 -3.1975 -3.1975 -3.1945 -3.1945 -3.1553 -3.1553 0.9672 0.9672 0.9918 0.9918 1.0168 1.0168 3.3375 3.3375 3.3397 3.3397 3.3906 3.3906 3.9328 3.9328 3.9884 3.9884 3.9969 3.9969 4.8245 4.8245 5.0088 5.0088 5.0539 5.0539 5.4813 5.4813 5.5128 5.5128 5.5508 5.5508 7.9809 7.9809 7.9836 7.9836 8.6553 8.6553 8.7110 8.7110 8.7787 8.7787 9.0207 9.0207 9.7752 9.7752 9.8068 9.8068 k = 0.2262 0.3199 0.6124 ( 9110 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8781 -5.8781 -5.7528 -5.7528 -5.7368 -5.7368 -5.6871 -5.6871 -5.4433 -5.4433 -5.4408 -5.4408 -5.3898 -5.3898 -5.3188 -5.3188 -5.2353 -5.2353 -5.2130 -5.2130 -3.2826 -3.2826 -3.2775 -3.2775 -3.2742 -3.2742 -3.2412 -3.2412 -3.2368 -3.2368 -3.2348 -3.2348 -3.1987 -3.1987 -3.1929 -3.1929 -3.1551 -3.1551 0.9455 0.9455 0.9905 0.9905 1.0408 1.0408 3.3349 3.3349 3.3400 3.3400 3.3895 3.3895 3.9345 3.9345 3.9867 3.9867 4.0044 4.0044 4.8112 4.8112 4.9953 4.9953 5.0825 5.0825 5.4488 5.4488 5.5054 5.5054 5.5861 5.5861 7.9767 7.9767 7.9849 7.9849 8.6046 8.6046 8.7054 8.7054 8.8116 8.8116 9.0380 9.0380 9.7529 9.7529 9.8146 9.8146 k = 0.2143 0.3030 0.6124 ( 9120 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8796 -5.8796 -5.7562 -5.7562 -5.7325 -5.7325 -5.6868 -5.6868 -5.4438 -5.4438 -5.4400 -5.4400 -5.3912 -5.3912 -5.3179 -5.3179 -5.2402 -5.2402 -5.2073 -5.2073 -3.2848 -3.2848 -3.2774 -3.2774 -3.2728 -3.2728 -3.2419 -3.2419 -3.2369 -3.2369 -3.2342 -3.2342 -3.1998 -3.1998 -3.1912 -3.1912 -3.1548 -3.1548 0.9241 0.9241 0.9887 0.9887 1.0657 1.0657 3.3287 3.3287 3.3385 3.3385 3.3924 3.3924 3.9358 3.9358 3.9861 3.9861 4.0152 4.0152 4.7908 4.7908 4.9880 4.9880 5.1130 5.1130 5.4178 5.4178 5.4934 5.4934 5.6217 5.6217 7.9699 7.9699 7.9867 7.9867 8.5491 8.5491 8.6917 8.6917 8.8464 8.8464 9.0628 9.0628 9.7287 9.7287 9.8178 9.8178 k = 0.2024 0.2862 0.6124 ( 9118 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8816 -5.8816 -5.7594 -5.7594 -5.7283 -5.7283 -5.6862 -5.6862 -5.4443 -5.4443 -5.4393 -5.4393 -5.3930 -5.3930 -5.3170 -5.3170 -5.2445 -5.2445 -5.2017 -5.2017 -3.2870 -3.2870 -3.2774 -3.2774 -3.2714 -3.2714 -3.2427 -3.2427 -3.2369 -3.2369 -3.2337 -3.2337 -3.2006 -3.2006 -3.1896 -3.1896 -3.1544 -3.1544 0.9036 0.9036 0.9863 0.9863 1.0910 1.0910 3.3162 3.3162 3.3357 3.3357 3.4023 3.4023 3.9354 3.9354 3.9862 3.9862 4.0301 4.0301 4.7652 4.7652 4.9861 4.9861 5.1445 5.1445 5.3888 5.3888 5.4769 5.4769 5.6571 5.6571 7.9605 7.9605 7.9888 7.9888 8.4907 8.4907 8.6752 8.6752 8.8799 8.8799 9.0915 9.0915 9.7042 9.7042 9.8175 9.8175 k = 0.1905 0.2694 0.6124 ( 9124 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8841 -5.8841 -5.7622 -5.7622 -5.7244 -5.7244 -5.6853 -5.6853 -5.4447 -5.4447 -5.4384 -5.4384 -5.3950 -5.3950 -5.3164 -5.3164 -5.2480 -5.2480 -5.1962 -5.1962 -3.2892 -3.2892 -3.2774 -3.2774 -3.2702 -3.2702 -3.2436 -3.2436 -3.2368 -3.2368 -3.2334 -3.2334 -3.2010 -3.2010 -3.1879 -3.1879 -3.1538 -3.1538 0.8841 0.8841 0.9833 0.9833 1.1165 1.1165 3.2980 3.2980 3.3325 3.3325 3.4187 3.4187 3.9334 3.9334 3.9860 3.9860 4.0488 4.0488 4.7364 4.7364 4.9882 4.9882 5.1759 5.1759 5.3620 5.3620 5.4561 5.4561 5.6919 5.6919 7.9487 7.9487 7.9907 7.9907 8.4309 8.4309 8.6588 8.6588 8.9120 8.9120 9.1211 9.1211 9.6806 9.6806 9.8148 9.8148 k = 0.1786 0.2525 0.6124 ( 9118 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8869 -5.8869 -5.7648 -5.7648 -5.7208 -5.7208 -5.6841 -5.6841 -5.4452 -5.4452 -5.4376 -5.4376 -5.3971 -5.3971 -5.3165 -5.3165 -5.2505 -5.2505 -5.1910 -5.1910 -3.2915 -3.2915 -3.2774 -3.2774 -3.2691 -3.2691 -3.2444 -3.2444 -3.2367 -3.2367 -3.2334 -3.2334 -3.2011 -3.2011 -3.1863 -3.1863 -3.1532 -3.1532 0.8655 0.8655 0.9798 0.9798 1.1422 1.1422 3.2762 3.2762 3.3289 3.3289 3.4402 3.4402 3.9302 3.9302 3.9849 3.9849 4.0703 4.0703 4.7062 4.7062 4.9932 4.9932 5.2067 5.2067 5.3379 5.3379 5.4317 5.4317 5.7259 5.7259 7.9347 7.9347 7.9919 7.9919 8.3708 8.3708 8.6442 8.6442 8.9430 8.9430 9.1496 9.1496 9.6586 9.6586 9.8104 9.8104 k = 0.1667 0.2357 0.6124 ( 9130 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8901 -5.8901 -5.7672 -5.7672 -5.7177 -5.7177 -5.6824 -5.6824 -5.4455 -5.4455 -5.4367 -5.4367 -5.3993 -5.3993 -5.3175 -5.3175 -5.2519 -5.2519 -5.1859 -5.1859 -3.2938 -3.2938 -3.2774 -3.2774 -3.2682 -3.2682 -3.2452 -3.2452 -3.2365 -3.2365 -3.2337 -3.2337 -3.2009 -3.2009 -3.1848 -3.1848 -3.1525 -3.1525 0.8480 0.8480 0.9759 0.9759 1.1677 1.1677 3.2524 3.2524 3.3251 3.3251 3.4661 3.4661 3.9263 3.9263 3.9826 3.9826 4.0934 4.0934 4.6755 4.6755 5.0002 5.0002 5.2359 5.2359 5.3166 5.3166 5.4042 5.4042 5.7588 5.7588 7.9188 7.9188 7.9917 7.9917 8.3114 8.3114 8.6330 8.6330 8.9730 8.9730 9.1757 9.1757 9.6385 9.6385 9.8047 9.8047 k = 0.1548 0.2189 0.6124 ( 9128 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8934 -5.8934 -5.7693 -5.7693 -5.7152 -5.7152 -5.6802 -5.6802 -5.4459 -5.4459 -5.4358 -5.4358 -5.4013 -5.4013 -5.3195 -5.3195 -5.2520 -5.2520 -5.1812 -5.1812 -3.2960 -3.2960 -3.2774 -3.2774 -3.2674 -3.2674 -3.2460 -3.2460 -3.2364 -3.2364 -3.2341 -3.2341 -3.2003 -3.2003 -3.1833 -3.1833 -3.1518 -3.1518 0.8316 0.8316 0.9717 0.9717 1.1930 1.1930 3.2277 3.2277 3.3209 3.3209 3.4958 3.4958 3.9220 3.9220 3.9791 3.9791 4.1171 4.1171 4.6454 4.6454 5.0084 5.0084 5.2614 5.2614 5.2993 5.2993 5.3750 5.3750 5.7902 5.7902 7.9011 7.9011 7.9894 7.9894 8.2539 8.2539 8.6261 8.6261 9.0021 9.0021 9.1990 9.1990 9.6201 9.6201 9.7979 9.7979 k = 0.1429 0.2020 0.6124 ( 9130 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.8969 -5.8969 -5.7713 -5.7713 -5.7133 -5.7133 -5.6775 -5.6775 -5.4463 -5.4463 -5.4349 -5.4349 -5.4031 -5.4031 -5.3225 -5.3225 -5.2510 -5.2510 -5.1767 -5.1767 -3.2981 -3.2981 -3.2774 -3.2774 -3.2667 -3.2667 -3.2467 -3.2467 -3.2364 -3.2364 -3.2346 -3.2346 -3.1995 -3.1995 -3.1818 -3.1818 -3.1511 -3.1511 0.8163 0.8163 0.9673 0.9673 1.2178 1.2178 3.2028 3.2028 3.3166 3.3166 3.5289 3.5289 3.9175 3.9175 3.9743 3.9743 4.1404 4.1404 4.6163 4.6163 5.0173 5.0173 5.2717 5.2717 5.2933 5.2933 5.3490 5.3490 5.8200 5.8200 7.8821 7.8821 7.9842 7.9842 8.1996 8.1996 8.6244 8.6244 9.0299 9.0299 9.2193 9.2193 9.6035 9.6035 9.7899 9.7899 k = 0.1310 0.1852 0.6124 ( 9134 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9004 -5.9004 -5.7730 -5.7730 -5.7119 -5.7119 -5.6745 -5.6745 -5.4466 -5.4466 -5.4341 -5.4341 -5.4046 -5.4046 -5.3262 -5.3262 -5.2492 -5.2492 -5.1725 -5.1725 -3.3001 -3.3001 -3.2775 -3.2775 -3.2661 -3.2661 -3.2474 -3.2474 -3.2368 -3.2368 -3.2348 -3.2348 -3.1985 -3.1985 -3.1804 -3.1804 -3.1504 -3.1504 0.8022 0.8022 0.9628 0.9628 1.2419 1.2419 3.1783 3.1783 3.3122 3.3122 3.5647 3.5647 3.9129 3.9129 3.9684 3.9684 4.1624 4.1624 4.5887 4.5887 5.0263 5.0263 5.2620 5.2620 5.2857 5.2857 5.3441 5.3441 5.8480 5.8480 7.8618 7.8618 7.9750 7.9750 8.1500 8.1500 8.6284 8.6284 9.0562 9.0562 9.2366 9.2366 9.5886 9.5886 9.7804 9.7804 k = 0.1190 0.1684 0.6124 ( 9138 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9038 -5.9038 -5.7746 -5.7746 -5.7110 -5.7110 -5.6712 -5.6712 -5.4469 -5.4469 -5.4334 -5.4334 -5.4057 -5.4057 -5.3306 -5.3306 -5.2467 -5.2467 -5.1686 -5.1686 -3.3021 -3.3021 -3.2776 -3.2776 -3.2656 -3.2656 -3.2480 -3.2480 -3.2375 -3.2375 -3.2348 -3.2348 -3.1973 -3.1973 -3.1791 -3.1791 -3.1497 -3.1497 0.7893 0.7893 0.9583 0.9583 1.2650 1.2650 3.1548 3.1548 3.3078 3.3078 3.6030 3.6030 3.9082 3.9082 3.9617 3.9617 4.1824 4.1824 4.5631 4.5631 5.0346 5.0346 5.2477 5.2477 5.2616 5.2616 5.3607 5.3607 5.8740 5.8740 7.8407 7.8407 7.9608 7.9608 8.1072 8.1072 8.6380 8.6380 9.0804 9.0804 9.2513 9.2513 9.5752 9.5752 9.7692 9.7692 k = 0.1071 0.1515 0.6124 ( 9130 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9071 -5.9071 -5.7759 -5.7759 -5.7104 -5.7104 -5.6678 -5.6678 -5.4472 -5.4472 -5.4327 -5.4327 -5.4063 -5.4063 -5.3354 -5.3354 -5.2439 -5.2439 -5.1651 -5.1651 -3.3039 -3.3039 -3.2777 -3.2777 -3.2652 -3.2652 -3.2486 -3.2486 -3.2384 -3.2384 -3.2347 -3.2347 -3.1961 -3.1961 -3.1778 -3.1778 -3.1490 -3.1490 0.7776 0.7776 0.9539 0.9539 1.2870 1.2870 3.1326 3.1326 3.3035 3.3035 3.6431 3.6431 3.9035 3.9035 3.9544 3.9545 4.1999 4.1999 4.5396 4.5396 5.0411 5.0411 5.2210 5.2210 5.2476 5.2476 5.3812 5.3812 5.8979 5.8979 7.8190 7.8190 7.9409 7.9409 8.0728 8.0728 8.6531 8.6531 9.1019 9.1019 9.2633 9.2633 9.5635 9.5635 9.7560 9.7560 k = 0.0952 0.1347 0.6124 ( 9148 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9102 -5.9102 -5.7772 -5.7772 -5.7101 -5.7101 -5.6645 -5.6645 -5.4474 -5.4474 -5.4323 -5.4323 -5.4065 -5.4065 -5.3404 -5.3404 -5.2410 -5.2410 -5.1619 -5.1619 -3.3055 -3.3055 -3.2778 -3.2778 -3.2648 -3.2648 -3.2491 -3.2491 -3.2394 -3.2394 -3.2344 -3.2344 -3.1949 -3.1949 -3.1766 -3.1766 -3.1484 -3.1484 0.7671 0.7671 0.9496 0.9496 1.3076 1.3076 3.1120 3.1120 3.2994 3.2994 3.6843 3.6843 3.8988 3.8988 3.9472 3.9472 4.2141 4.2141 4.5184 4.5184 5.0443 5.0443 5.1915 5.1915 5.2404 5.2404 5.4010 5.4010 5.9196 5.9196 7.7970 7.7970 7.9161 7.9161 8.0470 8.0470 8.6730 8.6730 9.1203 9.1203 9.2729 9.2729 9.5532 9.5532 9.7409 9.7409 k = 0.0833 0.1179 0.6124 ( 9134 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9131 -5.9131 -5.7783 -5.7783 -5.7100 -5.7100 -5.6613 -5.6613 -5.4477 -5.4477 -5.4320 -5.4320 -5.4061 -5.4061 -5.3455 -5.3455 -5.2381 -5.2381 -5.1591 -5.1591 -3.3070 -3.3070 -3.2779 -3.2779 -3.2645 -3.2645 -3.2495 -3.2495 -3.2404 -3.2404 -3.2342 -3.2342 -3.1938 -3.1938 -3.1755 -3.1755 -3.1479 -3.1479 0.7578 0.7578 0.9457 0.9457 1.3265 1.3265 3.0933 3.0933 3.2955 3.2955 3.7258 3.7258 3.8940 3.8940 3.9406 3.9406 4.2248 4.2248 4.4996 4.4996 5.0420 5.0420 5.1670 5.1670 5.2356 5.2356 5.4193 5.4193 5.9389 5.9389 7.7749 7.7749 7.8891 7.8891 8.0281 8.0281 8.6970 8.6970 9.1350 9.1350 9.2801 9.2801 9.5442 9.5442 9.7244 9.7244 k = 0.0714 0.1010 0.6124 ( 9146 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9157 -5.9157 -5.7792 -5.7792 -5.7100 -5.7100 -5.6584 -5.6584 -5.4479 -5.4479 -5.4318 -5.4318 -5.4052 -5.4052 -5.3506 -5.3506 -5.2353 -5.2353 -5.1567 -5.1567 -3.3084 -3.3084 -3.2780 -3.2780 -3.2642 -3.2642 -3.2499 -3.2499 -3.2413 -3.2413 -3.2340 -3.2340 -3.1928 -3.1928 -3.1745 -3.1745 -3.1475 -3.1475 0.7497 0.7497 0.9421 0.9421 1.3434 1.3434 3.0768 3.0768 3.2920 3.2920 3.7662 3.7662 3.8894 3.8894 3.9353 3.9353 4.2314 4.2314 4.4833 4.4833 5.0322 5.0322 5.1510 5.1510 5.2325 5.2325 5.4355 5.4355 5.9558 5.9558 7.7533 7.7533 7.8631 7.8631 8.0139 8.0139 8.7239 8.7239 9.1457 9.1457 9.2848 9.2848 9.5358 9.5358 9.7081 9.7081 k = 0.0595 0.0842 0.6124 ( 9138 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9180 -5.9180 -5.7800 -5.7800 -5.7100 -5.7100 -5.6558 -5.6558 -5.4481 -5.4481 -5.4318 -5.4318 -5.4039 -5.4039 -5.3554 -5.3554 -5.2328 -5.2328 -5.1546 -5.1546 -3.3095 -3.3095 -3.2781 -3.2781 -3.2640 -3.2640 -3.2503 -3.2503 -3.2421 -3.2421 -3.2338 -3.2338 -3.1918 -3.1918 -3.1736 -3.1736 -3.1471 -3.1471 0.7429 0.7429 0.9389 0.9389 1.3583 1.3583 3.0625 3.0625 3.2890 3.2890 3.8036 3.8036 3.8857 3.8857 3.9323 3.9323 4.2339 4.2339 4.4693 4.4693 5.0160 5.0160 5.1434 5.1434 5.2306 5.2306 5.4494 5.4494 5.9703 5.9703 7.7329 7.7329 7.8401 7.8401 8.0030 8.0030 8.7526 8.7526 9.1521 9.1521 9.2874 9.2874 9.5274 9.5274 9.6935 9.6935 k = 0.0476 0.0673 0.6124 ( 9142 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9199 -5.9199 -5.7806 -5.7806 -5.7101 -5.7101 -5.6535 -5.6535 -5.4483 -5.4483 -5.4319 -5.4319 -5.4023 -5.4023 -5.3600 -5.3600 -5.2306 -5.2306 -5.1529 -5.1529 -3.3104 -3.3104 -3.2782 -3.2782 -3.2638 -3.2638 -3.2506 -3.2506 -3.2428 -3.2428 -3.2337 -3.2337 -3.1911 -3.1911 -3.1728 -3.1728 -3.1468 -3.1468 0.7373 0.7373 0.9362 0.9362 1.3707 1.3707 3.0506 3.0506 3.2864 3.2864 3.8337 3.8337 3.8845 3.8845 3.9329 3.9329 4.2325 4.2325 4.4578 4.4578 4.9973 4.9973 5.1412 5.1412 5.2297 5.2297 5.4609 5.4609 5.9822 5.9822 7.7145 7.7145 7.8209 7.8209 7.9944 7.9944 8.7814 8.7814 9.1544 9.1544 9.2883 9.2883 9.5187 9.5187 9.6821 9.6821 k = 0.0357 0.0505 0.6124 ( 9152 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9214 -5.9214 -5.7812 -5.7812 -5.7102 -5.7102 -5.6518 -5.6518 -5.4485 -5.4485 -5.4320 -5.4320 -5.4005 -5.4005 -5.3641 -5.3641 -5.2289 -5.2289 -5.1516 -5.1516 -3.3112 -3.3112 -3.2783 -3.2783 -3.2636 -3.2636 -3.2509 -3.2509 -3.2434 -3.2434 -3.2335 -3.2335 -3.1905 -3.1905 -3.1721 -3.1721 -3.1465 -3.1465 0.7329 0.7329 0.9341 0.9341 1.3806 1.3806 3.0412 3.0412 3.2843 3.2843 3.8503 3.8503 3.8882 3.8882 3.9398 3.9398 4.2279 4.2279 4.4488 4.4488 4.9799 4.9799 5.1415 5.1415 5.2294 5.2294 5.4700 5.4700 5.9915 5.9915 7.6990 7.6990 7.8061 7.8061 7.9880 7.9880 8.8083 8.8083 9.1531 9.1531 9.2882 9.2882 9.5099 9.5099 9.6745 9.6745 k = 0.0238 0.0337 0.6124 ( 9150 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9224 -5.9224 -5.7815 -5.7815 -5.7102 -5.7102 -5.6505 -5.6505 -5.4486 -5.4486 -5.4321 -5.4321 -5.3987 -5.3987 -5.3674 -5.3674 -5.2276 -5.2276 -5.1507 -5.1507 -3.3117 -3.3117 -3.2784 -3.2784 -3.2634 -3.2634 -3.2510 -3.2510 -3.2438 -3.2438 -3.2334 -3.2334 -3.1900 -3.1900 -3.1717 -3.1717 -3.1464 -3.1464 0.7298 0.7298 0.9325 0.9325 1.3878 1.3878 3.0345 3.0345 3.2828 3.2828 3.8548 3.8548 3.8934 3.8934 3.9528 3.9528 4.2217 4.2217 4.4423 4.4423 4.9662 4.9662 5.1426 5.1426 5.2294 5.2294 5.4765 5.4765 5.9982 5.9982 7.6873 7.6873 7.7956 7.7956 7.9834 7.9834 8.8309 8.8309 9.1495 9.1495 9.2877 9.2877 9.5023 9.5023 9.6701 9.6701 k = 0.0119 0.0168 0.6124 ( 9148 PWs) bands (ev): -48.7676 -48.7676 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9231 -5.9231 -5.7817 -5.7817 -5.7103 -5.7103 -5.6497 -5.6497 -5.4486 -5.4486 -5.4321 -5.4321 -5.3974 -5.3974 -5.3697 -5.3697 -5.2268 -5.2268 -5.1501 -5.1501 -3.3120 -3.3120 -3.2784 -3.2784 -3.2633 -3.2633 -3.2512 -3.2512 -3.2440 -3.2440 -3.2334 -3.2334 -3.1897 -3.1897 -3.1714 -3.1714 -3.1463 -3.1463 0.7280 0.7280 0.9316 0.9316 1.3922 1.3922 3.0304 3.0304 3.2819 3.2819 3.8552 3.8552 3.8961 3.8961 3.9653 3.9653 4.2163 4.2163 4.4383 4.4383 4.9574 4.9574 5.1436 5.1436 5.2295 5.2295 5.4804 5.4804 6.0022 6.0022 7.6800 7.6800 7.7893 7.7893 7.9807 7.9807 8.8461 8.8461 9.1459 9.1459 9.2873 9.2873 9.4971 9.4971 9.6680 9.6680 k = 0.0000 0.0000 0.6124 ( 9128 PWs) bands (ev): -48.7675 -48.7675 -26.3388 -26.3388 -24.2418 -24.2418 -24.2418 -24.2418 -5.9233 -5.9233 -5.7818 -5.7818 -5.7103 -5.7103 -5.6494 -5.6494 -5.4486 -5.4486 -5.4322 -5.4322 -5.3969 -5.3969 -5.3705 -5.3705 -5.2265 -5.2265 -5.1499 -5.1499 -3.3121 -3.3121 -3.2784 -3.2784 -3.2633 -3.2633 -3.2512 -3.2512 -3.2441 -3.2441 -3.2333 -3.2333 -3.1896 -3.1896 -3.1713 -3.1713 -3.1463 -3.1463 0.7273 0.7273 0.9312 0.9312 1.3937 1.3937 3.0291 3.0291 3.2815 3.2815 3.8550 3.8550 3.8968 3.8968 3.9703 3.9703 4.2141 4.2141 4.4370 4.4370 4.9545 4.9545 5.1439 5.1439 5.2295 5.2295 5.4817 5.4817 6.0035 6.0035 7.6775 7.6775 7.7873 7.7873 7.9798 7.9798 8.8515 8.8515 9.1444 9.1444 9.2871 9.2871 9.4953 9.4953 9.6675 9.6675 Writing output data file NbTl3Se4.save init_run : 3.55s CPU 13.56s WALL ( 1 calls) electrons : 1190.01s CPU 1199.49s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.38s CPU 1.55s WALL ( 1 calls) Called by electrons: c_bands : 1189.97s CPU 1199.27s WALL ( 1 calls) v_of_rho : 0.17s CPU 0.94s WALL ( 1 calls) v_h : 0.03s CPU 0.03s WALL ( 1 calls) v_xc : 0.13s CPU 0.58s WALL ( 1 calls) newd : 0.55s CPU 0.75s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.17s WALL ( 196 calls) cegterg : 1114.84s CPU 1122.04s WALL ( 331 calls) Called by sum_band: Called by *egterg: h_psi : 539.81s CPU 544.68s WALL ( 4675 calls) s_psi : 39.43s CPU 39.55s WALL ( 4675 calls) g_psi : 1.22s CPU 1.29s WALL ( 4148 calls) cdiaghg : 383.41s CPU 383.08s WALL ( 4344 calls) cegterg:over : 100.86s CPU 100.40s WALL ( 4148 calls) cegterg:upda : 38.64s CPU 39.44s WALL ( 4148 calls) cegterg:last : 30.51s CPU 30.78s WALL ( 919 calls) Called by h_psi: h_psi:vloc : 458.84s CPU 462.01s WALL ( 4675 calls) h_psi:vnl : 80.11s CPU 81.35s WALL ( 4675 calls) add_vuspsi : 31.52s CPU 32.94s WALL ( 4675 calls) General routines calbec : 48.55s CPU 48.36s WALL ( 4675 calls) fft : 0.62s CPU 1.36s WALL ( 19 calls) ffts : 0.04s CPU 0.04s WALL ( 4 calls) fftw : 429.97s CPU 436.31s WALL ( 1075064 calls) interpolate : 0.07s CPU 0.08s WALL ( 4 calls) davcio : 0.02s CPU 1.64s WALL ( 392 calls) Parallel routines fft_scatter : 236.19s CPU 241.91s WALL ( 1075087 calls) PWSCF : 21m 5.77s CPU 23m24.16s WALL This run was terminated on: 7:35:21 1Nov2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=