Program PWSCF v.5.1.1 starts on 28Oct2015 at 17:12:41 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: ./LiAsSe2.save/ 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 75 75 20 3409 3409 492 Max 76 76 21 3412 3412 498 Sum 3609 3609 997 163699 163699 23765 bravais-lattice index = 14 lattice parameter (alat) = 10.4894 a.u. unit-cell volume = 1163.8925 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 411.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.489359 celldm(2)= 1.004744 celldm(3)= 1.005325 celldm(4)= -0.047455 celldm(5)= -0.026456 celldm(6)= -0.014524 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.014593 1.004638 0.000000 ) a(3) = ( -0.026597 -0.048099 1.003822 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.014526 0.027192 ) b(2) = ( 0.000000 0.995384 0.047695 ) b(3) = ( 0.000000 0.000000 0.996193 ) PseudoPot. # 1 for As read from file: /home/autes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1209 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for 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 Li read from file: /home/autes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential As 5.00 74.92160 As( 1.00) Se 6.00 78.96000 Se( 1.00) Li 3.00 6.94100 Li( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 261 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 -0.4976919 -0.0238475), wk = 0.0038314 k( 2) = ( 0.0000000 -0.4805301 -0.0230251), wk = 0.0038314 k( 3) = ( 0.0000000 -0.4633684 -0.0222028), wk = 0.0038314 k( 4) = ( 0.0000000 -0.4462066 -0.0213805), wk = 0.0038314 k( 5) = ( 0.0000000 -0.4290448 -0.0205581), wk = 0.0038314 k( 6) = ( 0.0000000 -0.4118830 -0.0197358), wk = 0.0038314 k( 7) = ( 0.0000000 -0.3947212 -0.0189135), wk = 0.0038314 k( 8) = ( 0.0000000 -0.3775594 -0.0180912), wk = 0.0038314 k( 9) = ( 0.0000000 -0.3603976 -0.0172688), wk = 0.0038314 k( 10) = ( 0.0000000 -0.3432358 -0.0164465), wk = 0.0038314 k( 11) = ( 0.0000000 -0.3260740 -0.0156242), wk = 0.0038314 k( 12) = ( 0.0000000 -0.3089122 -0.0148019), wk = 0.0038314 k( 13) = ( 0.0000000 -0.2917504 -0.0139795), wk = 0.0038314 k( 14) = ( 0.0000000 -0.2745887 -0.0131572), wk = 0.0038314 k( 15) = ( 0.0000000 -0.2574269 -0.0123349), wk = 0.0038314 k( 16) = ( 0.0000000 -0.2402651 -0.0115126), wk = 0.0038314 k( 17) = ( 0.0000000 -0.2231033 -0.0106902), wk = 0.0038314 k( 18) = ( 0.0000000 -0.2059415 -0.0098679), wk = 0.0038314 k( 19) = ( 0.0000000 -0.1887797 -0.0090456), wk = 0.0038314 k( 20) = ( 0.0000000 -0.1716179 -0.0082233), wk = 0.0038314 k( 21) = ( 0.0000000 -0.1544561 -0.0074009), wk = 0.0038314 k( 22) = ( 0.0000000 -0.1372943 -0.0065786), wk = 0.0038314 k( 23) = ( 0.0000000 -0.1201325 -0.0057563), wk = 0.0038314 k( 24) = ( 0.0000000 -0.1029707 -0.0049340), wk = 0.0038314 k( 25) = ( 0.0000000 -0.0858090 -0.0041116), wk = 0.0038314 k( 26) = ( 0.0000000 -0.0686472 -0.0032893), wk = 0.0038314 k( 27) = ( 0.0000000 -0.0514854 -0.0024670), wk = 0.0038314 k( 28) = ( 0.0000000 -0.0343236 -0.0016447), wk = 0.0038314 k( 29) = ( 0.0000000 -0.0171618 -0.0008223), wk = 0.0038314 k( 30) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 31) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 32) = ( 0.0172414 0.0002504 0.0004688), wk = 0.0038314 k( 33) = ( 0.0344828 0.0005009 0.0009376), wk = 0.0038314 k( 34) = ( 0.0517241 0.0007513 0.0014065), wk = 0.0038314 k( 35) = ( 0.0689655 0.0010018 0.0018753), wk = 0.0038314 k( 36) = ( 0.0862069 0.0012522 0.0023441), wk = 0.0038314 k( 37) = ( 0.1034483 0.0015027 0.0028129), wk = 0.0038314 k( 38) = ( 0.1206897 0.0017531 0.0032818), wk = 0.0038314 k( 39) = ( 0.1379310 0.0020035 0.0037506), wk = 0.0038314 k( 40) = ( 0.1551724 0.0022540 0.0042194), wk = 0.0038314 k( 41) = ( 0.1724138 0.0025044 0.0046882), wk = 0.0038314 k( 42) = ( 0.1896552 0.0027549 0.0051571), wk = 0.0038314 k( 43) = ( 0.2068966 0.0030053 0.0056259), wk = 0.0038314 k( 44) = ( 0.2241379 0.0032557 0.0060947), wk = 0.0038314 k( 45) = ( 0.2413793 0.0035062 0.0065635), wk = 0.0038314 k( 46) = ( 0.2586207 0.0037566 0.0070323), wk = 0.0038314 k( 47) = ( 0.2758621 0.0040071 0.0075012), wk = 0.0038314 k( 48) = ( 0.2931034 0.0042575 0.0079700), wk = 0.0038314 k( 49) = ( 0.3103448 0.0045080 0.0084388), wk = 0.0038314 k( 50) = ( 0.3275862 0.0047584 0.0089076), wk = 0.0038314 k( 51) = ( 0.3448276 0.0050088 0.0093765), wk = 0.0038314 k( 52) = ( 0.3620690 0.0052593 0.0098453), wk = 0.0038314 k( 53) = ( 0.3793103 0.0055097 0.0103141), wk = 0.0038314 k( 54) = ( 0.3965517 0.0057602 0.0107829), wk = 0.0038314 k( 55) = ( 0.4137931 0.0060106 0.0112518), wk = 0.0038314 k( 56) = ( 0.4310345 0.0062611 0.0117206), wk = 0.0038314 k( 57) = ( 0.4482759 0.0065115 0.0121894), wk = 0.0038314 k( 58) = ( 0.4655172 0.0067619 0.0126582), wk = 0.0038314 k( 59) = ( 0.4827586 0.0070124 0.0131270), wk = 0.0038314 k( 60) = ( 0.5000000 0.0072628 0.0135959), wk = 0.0038314 k( 61) = ( 0.5000000 -0.4904291 -0.0102516), wk = 0.0038314 k( 62) = ( 0.4875000 -0.4781684 -0.0099953), wk = 0.0038314 k( 63) = ( 0.4750000 -0.4659077 -0.0097390), wk = 0.0038314 k( 64) = ( 0.4625000 -0.4536469 -0.0094827), wk = 0.0038314 k( 65) = ( 0.4500000 -0.4413862 -0.0092264), wk = 0.0038314 k( 66) = ( 0.4375000 -0.4291255 -0.0089701), wk = 0.0038314 k( 67) = ( 0.4250000 -0.4168647 -0.0087138), wk = 0.0038314 k( 68) = ( 0.4125000 -0.4046040 -0.0084576), wk = 0.0038314 k( 69) = ( 0.4000000 -0.3923433 -0.0082013), wk = 0.0038314 k( 70) = ( 0.3875000 -0.3800826 -0.0079450), wk = 0.0038314 k( 71) = ( 0.3750000 -0.3678218 -0.0076887), wk = 0.0038314 k( 72) = ( 0.3625000 -0.3555611 -0.0074324), wk = 0.0038314 k( 73) = ( 0.3500000 -0.3433004 -0.0071761), wk = 0.0038314 k( 74) = ( 0.3375000 -0.3310396 -0.0069198), wk = 0.0038314 k( 75) = ( 0.3250000 -0.3187789 -0.0066635), wk = 0.0038314 k( 76) = ( 0.3125000 -0.3065182 -0.0064072), wk = 0.0038314 k( 77) = ( 0.3000000 -0.2942575 -0.0061509), wk = 0.0038314 k( 78) = ( 0.2875000 -0.2819967 -0.0058947), wk = 0.0038314 k( 79) = ( 0.2750000 -0.2697360 -0.0056384), wk = 0.0038314 k( 80) = ( 0.2625000 -0.2574753 -0.0053821), wk = 0.0038314 k( 81) = ( 0.2500000 -0.2452146 -0.0051258), wk = 0.0038314 k( 82) = ( 0.2375000 -0.2329538 -0.0048695), wk = 0.0038314 k( 83) = ( 0.2250000 -0.2206931 -0.0046132), wk = 0.0038314 k( 84) = ( 0.2125000 -0.2084324 -0.0043569), wk = 0.0038314 k( 85) = ( 0.2000000 -0.1961716 -0.0041006), wk = 0.0038314 k( 86) = ( 0.1875000 -0.1839109 -0.0038443), wk = 0.0038314 k( 87) = ( 0.1750000 -0.1716502 -0.0035881), wk = 0.0038314 k( 88) = ( 0.1625000 -0.1593895 -0.0033318), wk = 0.0038314 k( 89) = ( 0.1500000 -0.1471287 -0.0030755), wk = 0.0038314 k( 90) = ( 0.1375000 -0.1348680 -0.0028192), wk = 0.0038314 k( 91) = ( 0.1250000 -0.1226073 -0.0025629), wk = 0.0038314 k( 92) = ( 0.1125000 -0.1103465 -0.0023066), wk = 0.0038314 k( 93) = ( 0.1000000 -0.0980858 -0.0020503), wk = 0.0038314 k( 94) = ( 0.0875000 -0.0858251 -0.0017940), wk = 0.0038314 k( 95) = ( 0.0750000 -0.0735644 -0.0015377), wk = 0.0038314 k( 96) = ( 0.0625000 -0.0613036 -0.0012814), wk = 0.0038314 k( 97) = ( 0.0500000 -0.0490429 -0.0010252), wk = 0.0038314 k( 98) = ( 0.0375000 -0.0367822 -0.0007689), wk = 0.0038314 k( 99) = ( 0.0250000 -0.0245215 -0.0005126), wk = 0.0038314 k( 100) = ( 0.0125000 -0.0122607 -0.0002563), wk = 0.0038314 k( 101) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 103) = ( -0.0125000 -0.0001816 0.0121125), wk = 0.0038314 k( 104) = ( -0.0250000 -0.0003631 0.0242250), wk = 0.0038314 k( 105) = ( -0.0375000 -0.0005447 0.0363375), wk = 0.0038314 k( 106) = ( -0.0500000 -0.0007263 0.0484500), wk = 0.0038314 k( 107) = ( -0.0625000 -0.0009079 0.0605626), wk = 0.0038314 k( 108) = ( -0.0750000 -0.0010894 0.0726751), wk = 0.0038314 k( 109) = ( -0.0875000 -0.0012710 0.0847876), wk = 0.0038314 k( 110) = ( -0.1000000 -0.0014526 0.0969001), wk = 0.0038314 k( 111) = ( -0.1125000 -0.0016341 0.1090126), wk = 0.0038314 k( 112) = ( -0.1250000 -0.0018157 0.1211251), wk = 0.0038314 k( 113) = ( -0.1375000 -0.0019973 0.1332376), wk = 0.0038314 k( 114) = ( -0.1500000 -0.0021788 0.1453501), wk = 0.0038314 k( 115) = ( -0.1625000 -0.0023604 0.1574627), wk = 0.0038314 k( 116) = ( -0.1750000 -0.0025420 0.1695752), wk = 0.0038314 k( 117) = ( -0.1875000 -0.0027236 0.1816877), wk = 0.0038314 k( 118) = ( -0.2000000 -0.0029051 0.1938002), wk = 0.0038314 k( 119) = ( -0.2125000 -0.0030867 0.2059127), wk = 0.0038314 k( 120) = ( -0.2250000 -0.0032683 0.2180252), wk = 0.0038314 k( 121) = ( -0.2375000 -0.0034498 0.2301377), wk = 0.0038314 k( 122) = ( -0.2500000 -0.0036314 0.2422502), wk = 0.0038314 k( 123) = ( -0.2625000 -0.0038130 0.2543628), wk = 0.0038314 k( 124) = ( -0.2750000 -0.0039946 0.2664753), wk = 0.0038314 k( 125) = ( -0.2875000 -0.0041761 0.2785878), wk = 0.0038314 k( 126) = ( -0.3000000 -0.0043577 0.2907003), wk = 0.0038314 k( 127) = ( -0.3125000 -0.0045393 0.3028128), wk = 0.0038314 k( 128) = ( -0.3250000 -0.0047208 0.3149253), wk = 0.0038314 k( 129) = ( -0.3375000 -0.0049024 0.3270378), wk = 0.0038314 k( 130) = ( -0.3500000 -0.0050840 0.3391503), wk = 0.0038314 k( 131) = ( -0.3625000 -0.0052655 0.3512629), wk = 0.0038314 k( 132) = ( -0.3750000 -0.0054471 0.3633754), wk = 0.0038314 k( 133) = ( -0.3875000 -0.0056287 0.3754879), wk = 0.0038314 k( 134) = ( -0.4000000 -0.0058103 0.3876004), wk = 0.0038314 k( 135) = ( -0.4125000 -0.0059918 0.3997129), wk = 0.0038314 k( 136) = ( -0.4250000 -0.0061734 0.4118254), wk = 0.0038314 k( 137) = ( -0.4375000 -0.0063550 0.4239379), wk = 0.0038314 k( 138) = ( -0.4500000 -0.0065365 0.4360504), wk = 0.0038314 k( 139) = ( -0.4625000 -0.0067181 0.4481629), wk = 0.0038314 k( 140) = ( -0.4750000 -0.0068997 0.4602755), wk = 0.0038314 k( 141) = ( -0.4875000 -0.0070813 0.4723880), wk = 0.0038314 k( 142) = ( -0.5000000 -0.0072628 0.4845005), wk = 0.0038314 k( 143) = ( -0.5000000 -0.5049548 0.4606530), wk = 0.0038314 k( 144) = ( -0.4895833 -0.4944349 0.4510561), wk = 0.0038314 k( 145) = ( -0.4791667 -0.4839150 0.4414592), wk = 0.0038314 k( 146) = ( -0.4687500 -0.4733951 0.4318622), wk = 0.0038314 k( 147) = ( -0.4583333 -0.4628752 0.4222653), wk = 0.0038314 k( 148) = ( -0.4479167 -0.4523553 0.4126683), wk = 0.0038314 k( 149) = ( -0.4375000 -0.4418354 0.4030714), wk = 0.0038314 k( 150) = ( -0.4270833 -0.4313155 0.3934745), wk = 0.0038314 k( 151) = ( -0.4166667 -0.4207956 0.3838775), wk = 0.0038314 k( 152) = ( -0.4062500 -0.4102757 0.3742806), wk = 0.0038314 k( 153) = ( -0.3958333 -0.3997558 0.3646836), wk = 0.0038314 k( 154) = ( -0.3854167 -0.3892360 0.3550867), wk = 0.0038314 k( 155) = ( -0.3750000 -0.3787161 0.3454898), wk = 0.0038314 k( 156) = ( -0.3645833 -0.3681962 0.3358928), wk = 0.0038314 k( 157) = ( -0.3541667 -0.3576763 0.3262959), wk = 0.0038314 k( 158) = ( -0.3437500 -0.3471564 0.3166990), wk = 0.0038314 k( 159) = ( -0.3333333 -0.3366365 0.3071020), wk = 0.0038314 k( 160) = ( -0.3229167 -0.3261166 0.2975051), wk = 0.0038314 k( 161) = ( -0.3125000 -0.3155967 0.2879081), wk = 0.0038314 k( 162) = ( -0.3020833 -0.3050768 0.2783112), wk = 0.0038314 k( 163) = ( -0.2916667 -0.2945569 0.2687143), wk = 0.0038314 k( 164) = ( -0.2812500 -0.2840371 0.2591173), wk = 0.0038314 k( 165) = ( -0.2708333 -0.2735172 0.2495204), wk = 0.0038314 k( 166) = ( -0.2604167 -0.2629973 0.2399235), wk = 0.0038314 k( 167) = ( -0.2500000 -0.2524774 0.2303265), wk = 0.0038314 k( 168) = ( -0.2395833 -0.2419575 0.2207296), wk = 0.0038314 k( 169) = ( -0.2291667 -0.2314376 0.2111326), wk = 0.0038314 k( 170) = ( -0.2187500 -0.2209177 0.2015357), wk = 0.0038314 k( 171) = ( -0.2083333 -0.2103978 0.1919388), wk = 0.0038314 k( 172) = ( -0.1979167 -0.1998779 0.1823418), wk = 0.0038314 k( 173) = ( -0.1875000 -0.1893580 0.1727449), wk = 0.0038314 k( 174) = ( -0.1770833 -0.1788381 0.1631479), wk = 0.0038314 k( 175) = ( -0.1666667 -0.1683183 0.1535510), wk = 0.0038314 k( 176) = ( -0.1562500 -0.1577984 0.1439541), wk = 0.0038314 k( 177) = ( -0.1458333 -0.1472785 0.1343571), wk = 0.0038314 k( 178) = ( -0.1354167 -0.1367586 0.1247602), wk = 0.0038314 k( 179) = ( -0.1250000 -0.1262387 0.1151633), wk = 0.0038314 k( 180) = ( -0.1145833 -0.1157188 0.1055663), wk = 0.0038314 k( 181) = ( -0.1041667 -0.1051989 0.0959694), wk = 0.0038314 k( 182) = ( -0.0937500 -0.0946790 0.0863724), wk = 0.0038314 k( 183) = ( -0.0833333 -0.0841591 0.0767755), wk = 0.0038314 k( 184) = ( -0.0729167 -0.0736392 0.0671786), wk = 0.0038314 k( 185) = ( -0.0625000 -0.0631193 0.0575816), wk = 0.0038314 k( 186) = ( -0.0520833 -0.0525995 0.0479847), wk = 0.0038314 k( 187) = ( -0.0416667 -0.0420796 0.0383878), wk = 0.0038314 k( 188) = ( -0.0312500 -0.0315597 0.0287908), wk = 0.0038314 k( 189) = ( -0.0208333 -0.0210398 0.0191939), wk = 0.0038314 k( 190) = ( -0.0104167 -0.0105199 0.0095969), wk = 0.0038314 k( 191) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 192) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 193) = ( 0.0000000 0.0000000 0.0171757), wk = 0.0038314 k( 194) = ( 0.0000000 0.0000000 0.0343515), wk = 0.0038314 k( 195) = ( 0.0000000 0.0000000 0.0515272), wk = 0.0038314 k( 196) = ( 0.0000000 0.0000000 0.0687029), wk = 0.0038314 k( 197) = ( 0.0000000 0.0000000 0.0858787), wk = 0.0038314 k( 198) = ( 0.0000000 0.0000000 0.1030544), wk = 0.0038314 k( 199) = ( 0.0000000 0.0000000 0.1202302), wk = 0.0038314 k( 200) = ( 0.0000000 0.0000000 0.1374059), wk = 0.0038314 k( 201) = ( 0.0000000 0.0000000 0.1545816), wk = 0.0038314 k( 202) = ( 0.0000000 0.0000000 0.1717574), wk = 0.0038314 k( 203) = ( 0.0000000 0.0000000 0.1889331), wk = 0.0038314 k( 204) = ( 0.0000000 0.0000000 0.2061088), wk = 0.0038314 k( 205) = ( 0.0000000 0.0000000 0.2232846), wk = 0.0038314 k( 206) = ( 0.0000000 0.0000000 0.2404603), wk = 0.0038314 k( 207) = ( 0.0000000 0.0000000 0.2576360), wk = 0.0038314 k( 208) = ( 0.0000000 0.0000000 0.2748118), wk = 0.0038314 k( 209) = ( 0.0000000 0.0000000 0.2919875), wk = 0.0038314 k( 210) = ( 0.0000000 0.0000000 0.3091633), wk = 0.0038314 k( 211) = ( 0.0000000 0.0000000 0.3263390), wk = 0.0038314 k( 212) = ( 0.0000000 0.0000000 0.3435147), wk = 0.0038314 k( 213) = ( 0.0000000 0.0000000 0.3606905), wk = 0.0038314 k( 214) = ( 0.0000000 0.0000000 0.3778662), wk = 0.0038314 k( 215) = ( 0.0000000 0.0000000 0.3950419), wk = 0.0038314 k( 216) = ( 0.0000000 0.0000000 0.4122177), wk = 0.0038314 k( 217) = ( 0.0000000 0.0000000 0.4293934), wk = 0.0038314 k( 218) = ( 0.0000000 0.0000000 0.4465691), wk = 0.0038314 k( 219) = ( 0.0000000 0.0000000 0.4637449), wk = 0.0038314 k( 220) = ( 0.0000000 0.0000000 0.4809206), wk = 0.0038314 k( 221) = ( 0.0000000 0.0000000 0.4980964), wk = 0.0038314 k( 222) = ( 0.0000000 -0.4976919 0.4742489), wk = 0.0038314 k( 223) = ( 0.0000000 -0.4849306 0.4620887), wk = 0.0038314 k( 224) = ( 0.0000000 -0.4721693 0.4499284), wk = 0.0038314 k( 225) = ( 0.0000000 -0.4594079 0.4377682), wk = 0.0038314 k( 226) = ( 0.0000000 -0.4466466 0.4256080), wk = 0.0038314 k( 227) = ( 0.0000000 -0.4338853 0.4134478), wk = 0.0038314 k( 228) = ( 0.0000000 -0.4211239 0.4012875), wk = 0.0038314 k( 229) = ( 0.0000000 -0.4083626 0.3891273), wk = 0.0038314 k( 230) = ( 0.0000000 -0.3956013 0.3769671), wk = 0.0038314 k( 231) = ( 0.0000000 -0.3828399 0.3648068), wk = 0.0038314 k( 232) = ( 0.0000000 -0.3700786 0.3526466), wk = 0.0038314 k( 233) = ( 0.0000000 -0.3573173 0.3404864), wk = 0.0038314 k( 234) = ( 0.0000000 -0.3445560 0.3283262), wk = 0.0038314 k( 235) = ( 0.0000000 -0.3317946 0.3161659), wk = 0.0038314 k( 236) = ( 0.0000000 -0.3190333 0.3040057), wk = 0.0038314 k( 237) = ( 0.0000000 -0.3062720 0.2918455), wk = 0.0038314 k( 238) = ( 0.0000000 -0.2935106 0.2796852), wk = 0.0038314 k( 239) = ( 0.0000000 -0.2807493 0.2675250), wk = 0.0038314 k( 240) = ( 0.0000000 -0.2679880 0.2553648), wk = 0.0038314 k( 241) = ( 0.0000000 -0.2552266 0.2432046), wk = 0.0038314 k( 242) = ( 0.0000000 -0.2424653 0.2310443), wk = 0.0038314 k( 243) = ( 0.0000000 -0.2297040 0.2188841), wk = 0.0038314 k( 244) = ( 0.0000000 -0.2169426 0.2067239), wk = 0.0038314 k( 245) = ( 0.0000000 -0.2041813 0.1945637), wk = 0.0038314 k( 246) = ( 0.0000000 -0.1914200 0.1824034), wk = 0.0038314 k( 247) = ( 0.0000000 -0.1786586 0.1702432), wk = 0.0038314 k( 248) = ( 0.0000000 -0.1658973 0.1580830), wk = 0.0038314 k( 249) = ( 0.0000000 -0.1531360 0.1459227), wk = 0.0038314 k( 250) = ( 0.0000000 -0.1403746 0.1337625), wk = 0.0038314 k( 251) = ( 0.0000000 -0.1276133 0.1216023), wk = 0.0038314 k( 252) = ( 0.0000000 -0.1148520 0.1094421), wk = 0.0038314 k( 253) = ( 0.0000000 -0.1020907 0.0972818), wk = 0.0038314 k( 254) = ( 0.0000000 -0.0893293 0.0851216), wk = 0.0038314 k( 255) = ( 0.0000000 -0.0765680 0.0729614), wk = 0.0038314 k( 256) = ( 0.0000000 -0.0638067 0.0608011), wk = 0.0038314 k( 257) = ( 0.0000000 -0.0510453 0.0486409), wk = 0.0038314 k( 258) = ( 0.0000000 -0.0382840 0.0364807), wk = 0.0038314 k( 259) = ( 0.0000000 -0.0255227 0.0243205), wk = 0.0038314 k( 260) = ( 0.0000000 -0.0127613 0.0121602), wk = 0.0038314 k( 261) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 cryst. coord. k( 1) = ( 0.0000000 -0.5000000 0.0000000), wk = 0.0038314 k( 2) = ( 0.0000000 -0.4827586 0.0000000), wk = 0.0038314 k( 3) = ( 0.0000000 -0.4655172 0.0000000), wk = 0.0038314 k( 4) = ( 0.0000000 -0.4482759 0.0000000), wk = 0.0038314 k( 5) = ( 0.0000000 -0.4310345 -0.0000000), wk = 0.0038314 k( 6) = ( 0.0000000 -0.4137931 0.0000000), wk = 0.0038314 k( 7) = ( 0.0000000 -0.3965517 0.0000000), wk = 0.0038314 k( 8) = ( 0.0000000 -0.3793103 0.0000000), wk = 0.0038314 k( 9) = ( 0.0000000 -0.3620690 0.0000000), wk = 0.0038314 k( 10) = ( 0.0000000 -0.3448276 0.0000000), wk = 0.0038314 k( 11) = ( 0.0000000 -0.3275862 0.0000000), wk = 0.0038314 k( 12) = ( 0.0000000 -0.3103448 0.0000000), wk = 0.0038314 k( 13) = ( 0.0000000 -0.2931034 -0.0000000), wk = 0.0038314 k( 14) = ( 0.0000000 -0.2758621 -0.0000000), wk = 0.0038314 k( 15) = ( 0.0000000 -0.2586207 -0.0000000), wk = 0.0038314 k( 16) = ( 0.0000000 -0.2413793 0.0000000), wk = 0.0038314 k( 17) = ( 0.0000000 -0.2241379 0.0000000), wk = 0.0038314 k( 18) = ( 0.0000000 -0.2068965 0.0000000), wk = 0.0038314 k( 19) = ( 0.0000000 -0.1896552 0.0000000), wk = 0.0038314 k( 20) = ( 0.0000000 -0.1724138 0.0000000), wk = 0.0038314 k( 21) = ( 0.0000000 -0.1551724 0.0000000), wk = 0.0038314 k( 22) = ( 0.0000000 -0.1379310 0.0000000), wk = 0.0038314 k( 23) = ( 0.0000000 -0.1206897 0.0000000), wk = 0.0038314 k( 24) = ( 0.0000000 -0.1034483 -0.0000000), wk = 0.0038314 k( 25) = ( 0.0000000 -0.0862069 0.0000000), wk = 0.0038314 k( 26) = ( 0.0000000 -0.0689655 0.0000000), wk = 0.0038314 k( 27) = ( 0.0000000 -0.0517241 -0.0000000), wk = 0.0038314 k( 28) = ( 0.0000000 -0.0344828 0.0000000), wk = 0.0038314 k( 29) = ( 0.0000000 -0.0172414 0.0000000), wk = 0.0038314 k( 30) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 31) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 32) = ( 0.0172414 0.0000000 -0.0000000), wk = 0.0038314 k( 33) = ( 0.0344828 0.0000000 -0.0000000), wk = 0.0038314 k( 34) = ( 0.0517241 0.0000000 -0.0000000), wk = 0.0038314 k( 35) = ( 0.0689655 0.0000000 -0.0000000), wk = 0.0038314 k( 36) = ( 0.0862069 0.0000000 -0.0000000), wk = 0.0038314 k( 37) = ( 0.1034483 0.0000000 -0.0000000), wk = 0.0038314 k( 38) = ( 0.1206897 0.0000000 -0.0000000), wk = 0.0038314 k( 39) = ( 0.1379310 -0.0000000 -0.0000000), wk = 0.0038314 k( 40) = ( 0.1551724 0.0000000 0.0000000), wk = 0.0038314 k( 41) = ( 0.1724138 0.0000000 0.0000000), wk = 0.0038314 k( 42) = ( 0.1896552 0.0000000 0.0000000), wk = 0.0038314 k( 43) = ( 0.2068966 -0.0000000 -0.0000000), wk = 0.0038314 k( 44) = ( 0.2241379 0.0000000 0.0000000), wk = 0.0038314 k( 45) = ( 0.2413793 0.0000000 -0.0000000), wk = 0.0038314 k( 46) = ( 0.2586207 0.0000000 0.0000000), wk = 0.0038314 k( 47) = ( 0.2758621 0.0000000 -0.0000000), wk = 0.0038314 k( 48) = ( 0.2931034 0.0000000 0.0000000), wk = 0.0038314 k( 49) = ( 0.3103448 0.0000000 0.0000000), wk = 0.0038314 k( 50) = ( 0.3275862 0.0000000 0.0000000), wk = 0.0038314 k( 51) = ( 0.3448276 0.0000000 0.0000000), wk = 0.0038314 k( 52) = ( 0.3620690 -0.0000000 -0.0000000), wk = 0.0038314 k( 53) = ( 0.3793103 0.0000000 0.0000000), wk = 0.0038314 k( 54) = ( 0.3965517 0.0000000 -0.0000000), wk = 0.0038314 k( 55) = ( 0.4137931 -0.0000000 -0.0000000), wk = 0.0038314 k( 56) = ( 0.4310345 0.0000000 0.0000000), wk = 0.0038314 k( 57) = ( 0.4482759 0.0000000 0.0000000), wk = 0.0038314 k( 58) = ( 0.4655172 0.0000000 -0.0000000), wk = 0.0038314 k( 59) = ( 0.4827586 0.0000000 -0.0000000), wk = 0.0038314 k( 60) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0038314 k( 61) = ( 0.5000000 -0.5000000 -0.0000000), wk = 0.0038314 k( 62) = ( 0.4875000 -0.4875000 -0.0000000), wk = 0.0038314 k( 63) = ( 0.4750000 -0.4750000 0.0000000), wk = 0.0038314 k( 64) = ( 0.4625000 -0.4625000 0.0000000), wk = 0.0038314 k( 65) = ( 0.4500000 -0.4500000 -0.0000000), wk = 0.0038314 k( 66) = ( 0.4375000 -0.4375000 -0.0000000), wk = 0.0038314 k( 67) = ( 0.4250000 -0.4250000 -0.0000000), wk = 0.0038314 k( 68) = ( 0.4125000 -0.4125000 -0.0000000), wk = 0.0038314 k( 69) = ( 0.4000000 -0.4000000 -0.0000000), wk = 0.0038314 k( 70) = ( 0.3875000 -0.3875000 -0.0000000), wk = 0.0038314 k( 71) = ( 0.3750000 -0.3750000 -0.0000000), wk = 0.0038314 k( 72) = ( 0.3625000 -0.3625000 -0.0000000), wk = 0.0038314 k( 73) = ( 0.3500000 -0.3500000 0.0000000), wk = 0.0038314 k( 74) = ( 0.3375000 -0.3375000 0.0000000), wk = 0.0038314 k( 75) = ( 0.3250000 -0.3250000 0.0000000), wk = 0.0038314 k( 76) = ( 0.3125000 -0.3125000 -0.0000000), wk = 0.0038314 k( 77) = ( 0.3000000 -0.3000000 -0.0000000), wk = 0.0038314 k( 78) = ( 0.2875000 -0.2875000 -0.0000000), wk = 0.0038314 k( 79) = ( 0.2750000 -0.2750000 -0.0000000), wk = 0.0038314 k( 80) = ( 0.2625000 -0.2625000 -0.0000000), wk = 0.0038314 k( 81) = ( 0.2500000 -0.2500000 -0.0000000), wk = 0.0038314 k( 82) = ( 0.2375000 -0.2375000 0.0000000), wk = 0.0038314 k( 83) = ( 0.2250000 -0.2250000 -0.0000000), wk = 0.0038314 k( 84) = ( 0.2125000 -0.2125000 -0.0000000), wk = 0.0038314 k( 85) = ( 0.2000000 -0.2000000 -0.0000000), wk = 0.0038314 k( 86) = ( 0.1875000 -0.1875000 -0.0000000), wk = 0.0038314 k( 87) = ( 0.1750000 -0.1750000 0.0000000), wk = 0.0038314 k( 88) = ( 0.1625000 -0.1625000 0.0000000), wk = 0.0038314 k( 89) = ( 0.1500000 -0.1500000 -0.0000000), wk = 0.0038314 k( 90) = ( 0.1375000 -0.1375000 -0.0000000), wk = 0.0038314 k( 91) = ( 0.1250000 -0.1250000 -0.0000000), wk = 0.0038314 k( 92) = ( 0.1125000 -0.1125000 -0.0000000), wk = 0.0038314 k( 93) = ( 0.1000000 -0.1000000 -0.0000000), wk = 0.0038314 k( 94) = ( 0.0875000 -0.0875000 0.0000000), wk = 0.0038314 k( 95) = ( 0.0750000 -0.0750000 -0.0000000), wk = 0.0038314 k( 96) = ( 0.0625000 -0.0625000 -0.0000000), wk = 0.0038314 k( 97) = ( 0.0500000 -0.0500000 -0.0000000), wk = 0.0038314 k( 98) = ( 0.0375000 -0.0375000 -0.0000000), wk = 0.0038314 k( 99) = ( 0.0250000 -0.0250000 -0.0000000), wk = 0.0038314 k( 100) = ( 0.0125000 -0.0125000 -0.0000000), wk = 0.0038314 k( 101) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 103) = ( -0.0125000 0.0000000 0.0125000), wk = 0.0038314 k( 104) = ( -0.0250000 0.0000000 0.0250000), wk = 0.0038314 k( 105) = ( -0.0375000 -0.0000000 0.0375000), wk = 0.0038314 k( 106) = ( -0.0500000 0.0000000 0.0500000), wk = 0.0038314 k( 107) = ( -0.0625000 0.0000000 0.0625000), wk = 0.0038314 k( 108) = ( -0.0750000 -0.0000000 0.0750000), wk = 0.0038314 k( 109) = ( -0.0875000 -0.0000000 0.0875000), wk = 0.0038314 k( 110) = ( -0.1000000 0.0000000 0.1000000), wk = 0.0038314 k( 111) = ( -0.1125000 0.0000000 0.1125000), wk = 0.0038314 k( 112) = ( -0.1250000 0.0000000 0.1250000), wk = 0.0038314 k( 113) = ( -0.1375000 0.0000000 0.1375000), wk = 0.0038314 k( 114) = ( -0.1500000 -0.0000000 0.1500000), wk = 0.0038314 k( 115) = ( -0.1625000 0.0000000 0.1625000), wk = 0.0038314 k( 116) = ( -0.1750000 -0.0000000 0.1750000), wk = 0.0038314 k( 117) = ( -0.1875000 0.0000000 0.1875000), wk = 0.0038314 k( 118) = ( -0.2000000 0.0000000 0.2000000), wk = 0.0038314 k( 119) = ( -0.2125000 0.0000000 0.2125000), wk = 0.0038314 k( 120) = ( -0.2250000 0.0000000 0.2250000), wk = 0.0038314 k( 121) = ( -0.2375000 0.0000000 0.2375000), wk = 0.0038314 k( 122) = ( -0.2500000 0.0000000 0.2500000), wk = 0.0038314 k( 123) = ( -0.2625000 -0.0000000 0.2625000), wk = 0.0038314 k( 124) = ( -0.2750000 0.0000000 0.2750000), wk = 0.0038314 k( 125) = ( -0.2875000 0.0000000 0.2875000), wk = 0.0038314 k( 126) = ( -0.3000000 -0.0000000 0.3000000), wk = 0.0038314 k( 127) = ( -0.3125000 0.0000000 0.3125000), wk = 0.0038314 k( 128) = ( -0.3250000 0.0000000 0.3250000), wk = 0.0038314 k( 129) = ( -0.3375000 0.0000000 0.3375000), wk = 0.0038314 k( 130) = ( -0.3500000 -0.0000000 0.3500000), wk = 0.0038314 k( 131) = ( -0.3625000 0.0000000 0.3625000), wk = 0.0038314 k( 132) = ( -0.3750000 0.0000000 0.3750000), wk = 0.0038314 k( 133) = ( -0.3875000 0.0000000 0.3875000), wk = 0.0038314 k( 134) = ( -0.4000000 0.0000000 0.4000000), wk = 0.0038314 k( 135) = ( -0.4125000 0.0000000 0.4125000), wk = 0.0038314 k( 136) = ( -0.4250000 0.0000000 0.4250000), wk = 0.0038314 k( 137) = ( -0.4375000 0.0000000 0.4375000), wk = 0.0038314 k( 138) = ( -0.4500000 0.0000000 0.4500000), wk = 0.0038314 k( 139) = ( -0.4625000 0.0000000 0.4625000), wk = 0.0038314 k( 140) = ( -0.4750000 0.0000000 0.4750000), wk = 0.0038314 k( 141) = ( -0.4875000 0.0000000 0.4875000), wk = 0.0038314 k( 142) = ( -0.5000000 0.0000000 0.5000000), wk = 0.0038314 k( 143) = ( -0.5000000 -0.5000000 0.5000000), wk = 0.0038314 k( 144) = ( -0.4895833 -0.4895833 0.4895833), wk = 0.0038314 k( 145) = ( -0.4791667 -0.4791667 0.4791667), wk = 0.0038314 k( 146) = ( -0.4687500 -0.4687500 0.4687500), wk = 0.0038314 k( 147) = ( -0.4583333 -0.4583333 0.4583333), wk = 0.0038314 k( 148) = ( -0.4479167 -0.4479167 0.4479167), wk = 0.0038314 k( 149) = ( -0.4375000 -0.4375000 0.4375000), wk = 0.0038314 k( 150) = ( -0.4270833 -0.4270833 0.4270833), wk = 0.0038314 k( 151) = ( -0.4166667 -0.4166667 0.4166667), wk = 0.0038314 k( 152) = ( -0.4062500 -0.4062500 0.4062500), wk = 0.0038314 k( 153) = ( -0.3958333 -0.3958333 0.3958333), wk = 0.0038314 k( 154) = ( -0.3854167 -0.3854167 0.3854167), wk = 0.0038314 k( 155) = ( -0.3750000 -0.3750000 0.3750000), wk = 0.0038314 k( 156) = ( -0.3645833 -0.3645833 0.3645833), wk = 0.0038314 k( 157) = ( -0.3541667 -0.3541667 0.3541667), wk = 0.0038314 k( 158) = ( -0.3437500 -0.3437500 0.3437500), wk = 0.0038314 k( 159) = ( -0.3333333 -0.3333333 0.3333333), wk = 0.0038314 k( 160) = ( -0.3229167 -0.3229167 0.3229167), wk = 0.0038314 k( 161) = ( -0.3125000 -0.3125000 0.3125000), wk = 0.0038314 k( 162) = ( -0.3020833 -0.3020833 0.3020833), wk = 0.0038314 k( 163) = ( -0.2916667 -0.2916667 0.2916667), wk = 0.0038314 k( 164) = ( -0.2812500 -0.2812500 0.2812500), wk = 0.0038314 k( 165) = ( -0.2708333 -0.2708333 0.2708333), wk = 0.0038314 k( 166) = ( -0.2604167 -0.2604167 0.2604167), wk = 0.0038314 k( 167) = ( -0.2500000 -0.2500000 0.2500000), wk = 0.0038314 k( 168) = ( -0.2395833 -0.2395833 0.2395833), wk = 0.0038314 k( 169) = ( -0.2291667 -0.2291667 0.2291667), wk = 0.0038314 k( 170) = ( -0.2187500 -0.2187500 0.2187500), wk = 0.0038314 k( 171) = ( -0.2083333 -0.2083333 0.2083333), wk = 0.0038314 k( 172) = ( -0.1979167 -0.1979167 0.1979167), wk = 0.0038314 k( 173) = ( -0.1875000 -0.1875000 0.1875000), wk = 0.0038314 k( 174) = ( -0.1770833 -0.1770833 0.1770833), wk = 0.0038314 k( 175) = ( -0.1666667 -0.1666667 0.1666667), wk = 0.0038314 k( 176) = ( -0.1562500 -0.1562500 0.1562500), wk = 0.0038314 k( 177) = ( -0.1458333 -0.1458333 0.1458333), wk = 0.0038314 k( 178) = ( -0.1354167 -0.1354167 0.1354167), wk = 0.0038314 k( 179) = ( -0.1250000 -0.1250000 0.1250000), wk = 0.0038314 k( 180) = ( -0.1145833 -0.1145833 0.1145833), wk = 0.0038314 k( 181) = ( -0.1041667 -0.1041667 0.1041667), wk = 0.0038314 k( 182) = ( -0.0937500 -0.0937500 0.0937500), wk = 0.0038314 k( 183) = ( -0.0833333 -0.0833333 0.0833333), wk = 0.0038314 k( 184) = ( -0.0729167 -0.0729167 0.0729167), wk = 0.0038314 k( 185) = ( -0.0625000 -0.0625000 0.0625000), wk = 0.0038314 k( 186) = ( -0.0520833 -0.0520833 0.0520833), wk = 0.0038314 k( 187) = ( -0.0416667 -0.0416667 0.0416667), wk = 0.0038314 k( 188) = ( -0.0312500 -0.0312500 0.0312500), wk = 0.0038314 k( 189) = ( -0.0208333 -0.0208333 0.0208333), wk = 0.0038314 k( 190) = ( -0.0104167 -0.0104167 0.0104167), wk = 0.0038314 k( 191) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 192) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 193) = ( 0.0000000 0.0000000 0.0172414), wk = 0.0038314 k( 194) = ( 0.0000000 0.0000000 0.0344828), wk = 0.0038314 k( 195) = ( 0.0000000 0.0000000 0.0517241), wk = 0.0038314 k( 196) = ( 0.0000000 0.0000000 0.0689655), wk = 0.0038314 k( 197) = ( 0.0000000 0.0000000 0.0862069), wk = 0.0038314 k( 198) = ( 0.0000000 0.0000000 0.1034483), wk = 0.0038314 k( 199) = ( 0.0000000 0.0000000 0.1206897), wk = 0.0038314 k( 200) = ( 0.0000000 0.0000000 0.1379310), wk = 0.0038314 k( 201) = ( 0.0000000 0.0000000 0.1551724), wk = 0.0038314 k( 202) = ( 0.0000000 0.0000000 0.1724138), wk = 0.0038314 k( 203) = ( 0.0000000 0.0000000 0.1896552), wk = 0.0038314 k( 204) = ( 0.0000000 0.0000000 0.2068966), wk = 0.0038314 k( 205) = ( 0.0000000 0.0000000 0.2241379), wk = 0.0038314 k( 206) = ( 0.0000000 0.0000000 0.2413793), wk = 0.0038314 k( 207) = ( 0.0000000 0.0000000 0.2586207), wk = 0.0038314 k( 208) = ( 0.0000000 0.0000000 0.2758621), wk = 0.0038314 k( 209) = ( 0.0000000 0.0000000 0.2931034), wk = 0.0038314 k( 210) = ( 0.0000000 0.0000000 0.3103448), wk = 0.0038314 k( 211) = ( 0.0000000 0.0000000 0.3275862), wk = 0.0038314 k( 212) = ( 0.0000000 0.0000000 0.3448276), wk = 0.0038314 k( 213) = ( 0.0000000 0.0000000 0.3620690), wk = 0.0038314 k( 214) = ( 0.0000000 0.0000000 0.3793103), wk = 0.0038314 k( 215) = ( 0.0000000 0.0000000 0.3965517), wk = 0.0038314 k( 216) = ( 0.0000000 0.0000000 0.4137931), wk = 0.0038314 k( 217) = ( 0.0000000 0.0000000 0.4310345), wk = 0.0038314 k( 218) = ( 0.0000000 0.0000000 0.4482759), wk = 0.0038314 k( 219) = ( 0.0000000 0.0000000 0.4655172), wk = 0.0038314 k( 220) = ( 0.0000000 0.0000000 0.4827586), wk = 0.0038314 k( 221) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038314 k( 222) = ( 0.0000000 -0.5000000 0.5000000), wk = 0.0038314 k( 223) = ( 0.0000000 -0.4871795 0.4871795), wk = 0.0038314 k( 224) = ( 0.0000000 -0.4743590 0.4743590), wk = 0.0038314 k( 225) = ( 0.0000000 -0.4615385 0.4615385), wk = 0.0038314 k( 226) = ( 0.0000000 -0.4487179 0.4487180), wk = 0.0038314 k( 227) = ( 0.0000000 -0.4358974 0.4358974), wk = 0.0038314 k( 228) = ( 0.0000000 -0.4230769 0.4230769), wk = 0.0038314 k( 229) = ( 0.0000000 -0.4102564 0.4102564), wk = 0.0038314 k( 230) = ( 0.0000000 -0.3974359 0.3974359), wk = 0.0038314 k( 231) = ( 0.0000000 -0.3846154 0.3846154), wk = 0.0038314 k( 232) = ( 0.0000000 -0.3717949 0.3717949), wk = 0.0038314 k( 233) = ( 0.0000000 -0.3589744 0.3589744), wk = 0.0038314 k( 234) = ( 0.0000000 -0.3461538 0.3461538), wk = 0.0038314 k( 235) = ( 0.0000000 -0.3333333 0.3333333), wk = 0.0038314 k( 236) = ( 0.0000000 -0.3205128 0.3205128), wk = 0.0038314 k( 237) = ( 0.0000000 -0.3076923 0.3076923), wk = 0.0038314 k( 238) = ( 0.0000000 -0.2948718 0.2948718), wk = 0.0038314 k( 239) = ( 0.0000000 -0.2820513 0.2820513), wk = 0.0038314 k( 240) = ( 0.0000000 -0.2692308 0.2692308), wk = 0.0038314 k( 241) = ( 0.0000000 -0.2564103 0.2564103), wk = 0.0038314 k( 242) = ( 0.0000000 -0.2435897 0.2435897), wk = 0.0038314 k( 243) = ( 0.0000000 -0.2307692 0.2307692), wk = 0.0038314 k( 244) = ( 0.0000000 -0.2179487 0.2179487), wk = 0.0038314 k( 245) = ( 0.0000000 -0.2051282 0.2051282), wk = 0.0038314 k( 246) = ( 0.0000000 -0.1923077 0.1923077), wk = 0.0038314 k( 247) = ( 0.0000000 -0.1794872 0.1794872), wk = 0.0038314 k( 248) = ( 0.0000000 -0.1666667 0.1666667), wk = 0.0038314 k( 249) = ( 0.0000000 -0.1538461 0.1538461), wk = 0.0038314 k( 250) = ( 0.0000000 -0.1410256 0.1410256), wk = 0.0038314 k( 251) = ( 0.0000000 -0.1282051 0.1282051), wk = 0.0038314 k( 252) = ( 0.0000000 -0.1153846 0.1153846), wk = 0.0038314 k( 253) = ( 0.0000000 -0.1025641 0.1025641), wk = 0.0038314 k( 254) = ( 0.0000000 -0.0897436 0.0897436), wk = 0.0038314 k( 255) = ( 0.0000000 -0.0769231 0.0769231), wk = 0.0038314 k( 256) = ( 0.0000000 -0.0641026 0.0641026), wk = 0.0038314 k( 257) = ( 0.0000000 -0.0512820 0.0512821), wk = 0.0038314 k( 258) = ( 0.0000000 -0.0384615 0.0384615), wk = 0.0038314 k( 259) = ( 0.0000000 -0.0256410 0.0256410), wk = 0.0038314 k( 260) = ( 0.0000000 -0.0128205 0.0128205), wk = 0.0038314 k( 261) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 Dense grid: 163699 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.63 Mb ( 864, 48) NL pseudopotentials 0.55 Mb ( 432, 84) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.03 Mb ( 3410) G-vector shells 0.03 Mb ( 3369) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.53 Mb ( 864, 192) Each subspace H/S matrix 0.56 Mb ( 192, 192) Each matrix 0.12 Mb ( 84, 2, 48) The potential is recalculated from file : ./LiAsSe2.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 41.0 secs Computing kpt #: 2 total cpu time spent up to now is 44.5 secs Computing kpt #: 3 total cpu time spent up to now is 48.0 secs Computing kpt #: 4 total cpu time spent up to now is 51.4 secs Computing kpt #: 5 total cpu time spent up to now is 54.9 secs Computing kpt #: 6 total cpu time spent up to now is 58.3 secs Computing kpt #: 7 total cpu time spent up to now is 62.0 secs Computing kpt #: 8 total cpu time spent up to now is 65.4 secs Computing kpt #: 9 total cpu time spent up to now is 68.9 secs Computing kpt #: 10 total cpu time spent up to now is 72.3 secs Computing kpt #: 11 total cpu time spent up to now is 75.8 secs Computing kpt #: 12 total cpu time spent up to now is 79.3 secs Computing kpt #: 13 total cpu time spent up to now is 82.9 secs Computing kpt #: 14 total cpu time spent up to now is 86.3 secs Computing kpt #: 15 total cpu time spent up to now is 89.9 secs Computing kpt #: 16 total cpu time spent up to now is 93.4 secs Computing kpt #: 17 total cpu time spent up to now is 96.9 secs Computing kpt #: 18 total cpu time spent up to now is 100.4 secs Computing kpt #: 19 total cpu time spent up to now is 104.5 secs Computing kpt #: 20 total cpu time spent up to now is 108.2 secs Computing kpt #: 21 total cpu time spent up to now is 111.8 secs Computing kpt #: 22 total cpu time spent up to now is 116.0 secs Computing kpt #: 23 total cpu time spent up to now is 120.2 secs Computing kpt #: 24 total cpu time spent up to now is 125.7 secs Computing kpt #: 25 total cpu time spent up to now is 130.7 secs Computing kpt #: 26 total cpu time spent up to now is 135.1 secs Computing kpt #: 27 total cpu time spent up to now is 139.3 secs Computing kpt #: 28 total cpu time spent up to now is 143.5 secs Computing kpt #: 29 total cpu time spent up to now is 147.5 secs Computing kpt #: 30 total cpu time spent up to now is 151.0 secs Computing kpt #: 31 total cpu time spent up to now is 154.6 secs Computing kpt #: 32 total cpu time spent up to now is 158.7 secs Computing kpt #: 33 total cpu time spent up to now is 162.7 secs Computing kpt #: 34 total cpu time spent up to now is 166.9 secs Computing kpt #: 35 total cpu time spent up to now is 171.3 secs Computing kpt #: 36 total cpu time spent up to now is 175.6 secs Computing kpt #: 37 total cpu time spent up to now is 179.8 secs Computing kpt #: 38 total cpu time spent up to now is 184.0 secs Computing kpt #: 39 total cpu time spent up to now is 187.5 secs Computing kpt #: 40 total cpu time spent up to now is 191.0 secs Computing kpt #: 41 total cpu time spent up to now is 194.7 secs Computing kpt #: 42 total cpu time spent up to now is 198.5 secs Computing kpt #: 43 total cpu time spent up to now is 202.5 secs Computing kpt #: 44 total cpu time spent up to now is 206.7 secs Computing kpt #: 45 total cpu time spent up to now is 210.8 secs Computing kpt #: 46 total cpu time spent up to now is 215.0 secs Computing kpt #: 47 total cpu time spent up to now is 219.3 secs Computing kpt #: 48 total cpu time spent up to now is 223.9 secs Computing kpt #: 49 total cpu time spent up to now is 228.0 secs Computing kpt #: 50 total cpu time spent up to now is 232.0 secs Computing kpt #: 51 total cpu time spent up to now is 235.9 secs Computing kpt #: 52 total cpu time spent up to now is 239.7 secs Computing kpt #: 53 total cpu time spent up to now is 243.0 secs Computing kpt #: 54 total cpu time spent up to now is 246.4 secs Computing kpt #: 55 total cpu time spent up to now is 249.5 secs Computing kpt #: 56 total cpu time spent up to now is 252.7 secs Computing kpt #: 57 total cpu time spent up to now is 255.9 secs Computing kpt #: 58 total cpu time spent up to now is 259.0 secs Computing kpt #: 59 total cpu time spent up to now is 262.1 secs Computing kpt #: 60 total cpu time spent up to now is 265.3 secs Computing kpt #: 61 total cpu time spent up to now is 267.9 secs Computing kpt #: 62 total cpu time spent up to now is 270.5 secs Computing kpt #: 63 total cpu time spent up to now is 273.2 secs Computing kpt #: 64 total cpu time spent up to now is 275.9 secs Computing kpt #: 65 total cpu time spent up to now is 278.4 secs Computing kpt #: 66 total cpu time spent up to now is 281.1 secs Computing kpt #: 67 total cpu time spent up to now is 283.7 secs Computing kpt #: 68 total cpu time spent up to now is 286.3 secs Computing kpt #: 69 total cpu time spent up to now is 289.1 secs Computing kpt #: 70 total cpu time spent up to now is 291.7 secs Computing kpt #: 71 total cpu time spent up to now is 294.7 secs Computing kpt #: 72 total cpu time spent up to now is 297.7 secs Computing kpt #: 73 total cpu time spent up to now is 301.1 secs Computing kpt #: 74 total cpu time spent up to now is 304.3 secs Computing kpt #: 75 total cpu time spent up to now is 307.9 secs Computing kpt #: 76 total cpu time spent up to now is 311.9 secs Computing kpt #: 77 total cpu time spent up to now is 315.4 secs Computing kpt #: 78 total cpu time spent up to now is 318.9 secs Computing kpt #: 79 total cpu time spent up to now is 322.3 secs Computing kpt #: 80 total cpu time spent up to now is 325.7 secs Computing kpt #: 81 total cpu time spent up to now is 329.5 secs Computing kpt #: 82 total cpu time spent up to now is 335.7 secs Computing kpt #: 83 total cpu time spent up to now is 339.9 secs Computing kpt #: 84 total cpu time spent up to now is 343.9 secs Computing kpt #: 85 total cpu time spent up to now is 348.1 secs Computing kpt #: 86 total cpu time spent up to now is 351.8 secs Computing kpt #: 87 total cpu time spent up to now is 355.6 secs Computing kpt #: 88 total cpu time spent up to now is 359.3 secs Computing kpt #: 89 total cpu time spent up to now is 362.8 secs Computing kpt #: 90 total cpu time spent up to now is 366.4 secs Computing kpt #: 91 total cpu time spent up to now is 369.9 secs Computing kpt #: 92 total cpu time spent up to now is 373.5 secs Computing kpt #: 93 total cpu time spent up to now is 377.3 secs Computing kpt #: 94 total cpu time spent up to now is 381.0 secs Computing kpt #: 95 total cpu time spent up to now is 385.2 secs Computing kpt #: 96 total cpu time spent up to now is 389.2 secs Computing kpt #: 97 total cpu time spent up to now is 393.4 secs Computing kpt #: 98 total cpu time spent up to now is 397.8 secs Computing kpt #: 99 total cpu time spent up to now is 401.8 secs Computing kpt #: 100 total cpu time spent up to now is 405.3 secs Computing kpt #: 101 total cpu time spent up to now is 408.7 secs Computing kpt #: 102 total cpu time spent up to now is 412.2 secs Computing kpt #: 103 total cpu time spent up to now is 416.2 secs Computing kpt #: 104 total cpu time spent up to now is 420.2 secs Computing kpt #: 105 total cpu time spent up to now is 424.3 secs Computing kpt #: 106 total cpu time spent up to now is 428.7 secs Computing kpt #: 107 total cpu time spent up to now is 433.4 secs Computing kpt #: 108 total cpu time spent up to now is 439.2 secs Computing kpt #: 109 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 446.0 secs Computing kpt #: 110 total cpu time spent up to now is 450.3 secs Computing kpt #: 111 total cpu time spent up to now is 454.7 secs Computing kpt #: 112 total cpu time spent up to now is 458.9 secs Computing kpt #: 113 total cpu time spent up to now is 463.1 secs Computing kpt #: 114 total cpu time spent up to now is 467.2 secs Computing kpt #: 115 total cpu time spent up to now is 471.2 secs Computing kpt #: 116 total cpu time spent up to now is 475.3 secs Computing kpt #: 117 total cpu time spent up to now is 479.3 secs Computing kpt #: 118 total cpu time spent up to now is 483.5 secs Computing kpt #: 119 total cpu time spent up to now is 487.5 secs Computing kpt #: 120 total cpu time spent up to now is 491.5 secs Computing kpt #: 121 total cpu time spent up to now is 494.9 secs Computing kpt #: 122 total cpu time spent up to now is 498.3 secs Computing kpt #: 123 total cpu time spent up to now is 501.4 secs Computing kpt #: 124 total cpu time spent up to now is 504.6 secs Computing kpt #: 125 total cpu time spent up to now is 507.6 secs Computing kpt #: 126 total cpu time spent up to now is 510.8 secs Computing kpt #: 127 total cpu time spent up to now is 513.8 secs Computing kpt #: 128 total cpu time spent up to now is 516.4 secs Computing kpt #: 129 total cpu time spent up to now is 519.0 secs Computing kpt #: 130 total cpu time spent up to now is 521.5 secs Computing kpt #: 131 total cpu time spent up to now is 524.4 secs Computing kpt #: 132 total cpu time spent up to now is 527.4 secs Computing kpt #: 133 total cpu time spent up to now is 529.9 secs Computing kpt #: 134 total cpu time spent up to now is 532.5 secs Computing kpt #: 135 total cpu time spent up to now is 535.0 secs Computing kpt #: 136 total cpu time spent up to now is 538.1 secs Computing kpt #: 137 total cpu time spent up to now is 540.9 secs Computing kpt #: 138 total cpu time spent up to now is 543.5 secs Computing kpt #: 139 total cpu time spent up to now is 546.2 secs Computing kpt #: 140 total cpu time spent up to now is 548.6 secs Computing kpt #: 141 total cpu time spent up to now is 551.5 secs Computing kpt #: 142 total cpu time spent up to now is 554.0 secs Computing kpt #: 143 total cpu time spent up to now is 557.4 secs Computing kpt #: 144 total cpu time spent up to now is 560.7 secs Computing kpt #: 145 total cpu time spent up to now is 564.1 secs Computing kpt #: 146 total cpu time spent up to now is 567.5 secs Computing kpt #: 147 total cpu time spent up to now is 570.9 secs Computing kpt #: 148 total cpu time spent up to now is 574.3 secs Computing kpt #: 149 total cpu time spent up to now is 577.7 secs Computing kpt #: 150 total cpu time spent up to now is 581.3 secs Computing kpt #: 151 total cpu time spent up to now is 584.7 secs Computing kpt #: 152 total cpu time spent up to now is 588.3 secs Computing kpt #: 153 total cpu time spent up to now is 591.8 secs Computing kpt #: 154 total cpu time spent up to now is 595.5 secs Computing kpt #: 155 total cpu time spent up to now is 599.1 secs Computing kpt #: 156 total cpu time spent up to now is 602.7 secs Computing kpt #: 157 total cpu time spent up to now is 606.5 secs Computing kpt #: 158 total cpu time spent up to now is 610.1 secs Computing kpt #: 159 total cpu time spent up to now is 613.7 secs Computing kpt #: 160 total cpu time spent up to now is 617.3 secs Computing kpt #: 161 total cpu time spent up to now is 620.9 secs Computing kpt #: 162 total cpu time spent up to now is 624.5 secs Computing kpt #: 163 total cpu time spent up to now is 628.1 secs Computing kpt #: 164 total cpu time spent up to now is 633.1 secs Computing kpt #: 165 total cpu time spent up to now is 637.8 secs Computing kpt #: 166 total cpu time spent up to now is 641.3 secs Computing kpt #: 167 total cpu time spent up to now is 644.8 secs Computing kpt #: 168 total cpu time spent up to now is 648.6 secs Computing kpt #: 169 total cpu time spent up to now is 652.2 secs Computing kpt #: 170 total cpu time spent up to now is 655.8 secs Computing kpt #: 171 total cpu time spent up to now is 659.6 secs Computing kpt #: 172 total cpu time spent up to now is 663.1 secs Computing kpt #: 173 total cpu time spent up to now is 666.7 secs Computing kpt #: 174 total cpu time spent up to now is 670.3 secs Computing kpt #: 175 total cpu time spent up to now is 673.7 secs Computing kpt #: 176 total cpu time spent up to now is 677.3 secs Computing kpt #: 177 total cpu time spent up to now is 680.6 secs Computing kpt #: 178 total cpu time spent up to now is 684.0 secs Computing kpt #: 179 total cpu time spent up to now is 687.8 secs Computing kpt #: 180 total cpu time spent up to now is 691.7 secs Computing kpt #: 181 total cpu time spent up to now is 695.6 secs Computing kpt #: 182 total cpu time spent up to now is 699.8 secs Computing kpt #: 183 total cpu time spent up to now is 704.2 secs Computing kpt #: 184 total cpu time spent up to now is 709.5 secs Computing kpt #: 185 total cpu time spent up to now is 713.9 secs Computing kpt #: 186 total cpu time spent up to now is 718.3 secs Computing kpt #: 187 total cpu time spent up to now is 722.6 secs Computing kpt #: 188 total cpu time spent up to now is 726.5 secs Computing kpt #: 189 total cpu time spent up to now is 730.5 secs Computing kpt #: 190 total cpu time spent up to now is 734.0 secs Computing kpt #: 191 total cpu time spent up to now is 737.3 secs Computing kpt #: 192 total cpu time spent up to now is 740.5 secs Computing kpt #: 193 total cpu time spent up to now is 744.1 secs Computing kpt #: 194 total cpu time spent up to now is 748.1 secs Computing kpt #: 195 total cpu time spent up to now is 752.1 secs Computing kpt #: 196 total cpu time spent up to now is 756.1 secs Computing kpt #: 197 total cpu time spent up to now is 760.0 secs Computing kpt #: 198 total cpu time spent up to now is 764.3 secs Computing kpt #: 199 total cpu time spent up to now is 768.5 secs Computing kpt #: 200 total cpu time spent up to now is 772.9 secs Computing kpt #: 201 total cpu time spent up to now is 777.7 secs Computing kpt #: 202 total cpu time spent up to now is 783.3 secs Computing kpt #: 203 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 789.7 secs Computing kpt #: 204 total cpu time spent up to now is 794.4 secs Computing kpt #: 205 total cpu time spent up to now is 798.6 secs Computing kpt #: 206 total cpu time spent up to now is 802.6 secs Computing kpt #: 207 total cpu time spent up to now is 806.5 secs Computing kpt #: 208 total cpu time spent up to now is 810.0 secs Computing kpt #: 209 total cpu time spent up to now is 813.7 secs Computing kpt #: 210 total cpu time spent up to now is 817.1 secs Computing kpt #: 211 total cpu time spent up to now is 821.3 secs Computing kpt #: 212 total cpu time spent up to now is 824.8 secs Computing kpt #: 213 total cpu time spent up to now is 828.1 secs Computing kpt #: 214 total cpu time spent up to now is 831.2 secs Computing kpt #: 215 total cpu time spent up to now is 834.6 secs Computing kpt #: 216 total cpu time spent up to now is 837.7 secs Computing kpt #: 217 total cpu time spent up to now is 840.9 secs Computing kpt #: 218 total cpu time spent up to now is 844.1 secs Computing kpt #: 219 total cpu time spent up to now is 847.2 secs Computing kpt #: 220 total cpu time spent up to now is 850.2 secs Computing kpt #: 221 total cpu time spent up to now is 853.2 secs Computing kpt #: 222 total cpu time spent up to now is 855.9 secs Computing kpt #: 223 total cpu time spent up to now is 858.5 secs Computing kpt #: 224 total cpu time spent up to now is 861.1 secs Computing kpt #: 225 total cpu time spent up to now is 863.7 secs Computing kpt #: 226 total cpu time spent up to now is 866.2 secs Computing kpt #: 227 total cpu time spent up to now is 868.7 secs Computing kpt #: 228 total cpu time spent up to now is 871.3 secs Computing kpt #: 229 total cpu time spent up to now is 873.9 secs Computing kpt #: 230 total cpu time spent up to now is 876.6 secs Computing kpt #: 231 total cpu time spent up to now is 879.1 secs Computing kpt #: 232 total cpu time spent up to now is 881.7 secs Computing kpt #: 233 total cpu time spent up to now is 884.3 secs Computing kpt #: 234 total cpu time spent up to now is 886.9 secs Computing kpt #: 235 total cpu time spent up to now is 889.6 secs Computing kpt #: 236 total cpu time spent up to now is 892.4 secs Computing kpt #: 237 total cpu time spent up to now is 895.0 secs Computing kpt #: 238 total cpu time spent up to now is 898.0 secs Computing kpt #: 239 total cpu time spent up to now is 901.0 secs Computing kpt #: 240 total cpu time spent up to now is 904.1 secs Computing kpt #: 241 total cpu time spent up to now is 907.1 secs Computing kpt #: 242 total cpu time spent up to now is 910.2 secs Computing kpt #: 243 total cpu time spent up to now is 913.3 secs Computing kpt #: 244 total cpu time spent up to now is 916.6 secs Computing kpt #: 245 total cpu time spent up to now is 919.8 secs Computing kpt #: 246 total cpu time spent up to now is 923.1 secs Computing kpt #: 247 total cpu time spent up to now is 926.5 secs Computing kpt #: 248 total cpu time spent up to now is 930.2 secs Computing kpt #: 249 total cpu time spent up to now is 936.0 secs Computing kpt #: 250 total cpu time spent up to now is 939.8 secs Computing kpt #: 251 total cpu time spent up to now is 943.9 secs Computing kpt #: 252 total cpu time spent up to now is 948.1 secs Computing kpt #: 253 total cpu time spent up to now is 952.3 secs Computing kpt #: 254 total cpu time spent up to now is 957.3 secs Computing kpt #: 255 total cpu time spent up to now is 961.6 secs Computing kpt #: 256 total cpu time spent up to now is 965.9 secs Computing kpt #: 257 total cpu time spent up to now is 970.0 secs Computing kpt #: 258 total cpu time spent up to now is 974.1 secs Computing kpt #: 259 total cpu time spent up to now is 977.9 secs Computing kpt #: 260 total cpu time spent up to now is 981.6 secs Computing kpt #: 261 total cpu time spent up to now is 985.1 secs ethr = 2.50E-11, avg # of iterations = 37.9 total cpu time spent up to now is 985.3 secs End of band structure calculation k = 0.0000-0.4977-0.0238 ( 20534 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5488 -9.5488 -7.7184 -7.7184 -7.4572 -7.4572 -6.7972 -6.7972 -5.2051 -5.2051 -3.5266 -3.5266 -0.7212 -0.7212 -0.5904 -0.5904 1.2053 1.2053 1.5944 1.5944 1.8174 1.8174 2.5124 2.5124 2.7876 2.7876 2.9772 2.9772 3.3231 3.3231 4.2323 4.2323 4.2456 4.2456 4.5340 4.5340 6.4569 6.4569 7.1866 7.1866 8.3931 8.3931 8.6526 8.6526 k = 0.0000-0.4805-0.0230 ( 20535 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5493 -9.5493 -7.7179 -7.7179 -7.4570 -7.4570 -6.7982 -6.7982 -5.2024 -5.2024 -3.5261 -3.5261 -0.7217 -0.7217 -0.5909 -0.5909 1.2052 1.2052 1.5931 1.5931 1.8149 1.8149 2.5105 2.5105 2.7839 2.7839 2.9778 2.9778 3.3256 3.3256 4.2170 4.2170 4.2520 4.2520 4.5359 4.5359 6.4715 6.4715 7.1948 7.1948 8.3929 8.3929 8.6519 8.6519 k = 0.0000-0.4634-0.0222 ( 20534 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5509 -9.5509 -7.7166 -7.7166 -7.4563 -7.4563 -6.8013 -6.8013 -5.1941 -5.1941 -3.5245 -3.5245 -0.7234 -0.7234 -0.5924 -0.5924 1.2049 1.2049 1.5890 1.5890 1.8073 1.8073 2.5050 2.5050 2.7736 2.7736 2.9796 2.9796 3.3320 3.3320 4.1848 4.1848 4.2590 4.2590 4.5413 4.5413 6.5140 6.5140 7.2192 7.2192 8.3922 8.3922 8.6501 8.6501 k = 0.0000-0.4462-0.0214 ( 20529 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5537 -9.5537 -7.7145 -7.7145 -7.4551 -7.4551 -6.8063 -6.8063 -5.1805 -5.1805 -3.5218 -3.5218 -0.7261 -0.7261 -0.5948 -0.5948 1.2045 1.2045 1.5810 1.5810 1.7953 1.7953 2.4955 2.4955 2.7598 2.7598 2.9822 2.9822 3.3398 3.3398 4.1409 4.1409 4.2657 4.2657 4.5496 4.5496 6.5818 6.5818 7.2593 7.2593 8.3913 8.3913 8.6470 8.6470 k = 0.0000-0.4290-0.0206 ( 20525 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5574 -9.5574 -7.7117 -7.7117 -7.4534 -7.4534 -6.8131 -6.8131 -5.1617 -5.1617 -3.5181 -3.5181 -0.7298 -0.7298 -0.5982 -0.5982 1.2038 1.2038 1.5674 1.5674 1.7802 1.7802 2.4821 2.4821 2.7456 2.7456 2.9851 2.9851 3.3455 3.3455 4.0898 4.0898 4.2732 4.2732 4.5602 4.5602 6.6710 6.6710 7.3143 7.3143 8.3901 8.3901 8.6428 8.6428 k = 0.0000-0.4119-0.0197 ( 20521 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5621 -9.5621 -7.7082 -7.7082 -7.4513 -7.4513 -6.8213 -6.8213 -5.1381 -5.1381 -3.5134 -3.5134 -0.7344 -0.7344 -0.6023 -0.6023 1.2029 1.2029 1.5455 1.5455 1.7640 1.7640 2.4652 2.4652 2.7335 2.7335 2.9882 2.9882 3.3455 3.3455 4.0371 4.0371 4.2821 4.2821 4.5728 4.5728 6.7775 6.7775 7.3830 7.3830 8.3889 8.3889 8.6375 8.6375 k = 0.0000-0.3947-0.0189 ( 20518 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5676 -9.5676 -7.7043 -7.7043 -7.4487 -7.4487 -6.8307 -6.8307 -5.1101 -5.1101 -3.5077 -3.5077 -0.7399 -0.7399 -0.6071 -0.6071 1.2015 1.2015 1.5128 1.5128 1.7490 1.7490 2.4454 2.4454 2.7249 2.7249 2.9910 2.9910 3.3368 3.3368 3.9888 3.9888 4.2924 4.2924 4.5871 4.5871 6.8972 6.8972 7.4639 7.4639 8.3881 8.3881 8.6313 8.6313 k = 0.0000-0.3776-0.0181 ( 20517 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5740 -9.5740 -7.7001 -7.7001 -7.4456 -7.4456 -6.8409 -6.8409 -5.0780 -5.0780 -3.5010 -3.5010 -0.7462 -0.7462 -0.6126 -0.6126 1.1995 1.1995 1.4679 1.4679 1.7372 1.7372 2.4232 2.4232 2.7201 2.7201 2.9930 2.9930 3.3182 3.3182 3.9492 3.9492 4.3042 4.3042 4.6030 4.6030 7.0262 7.0262 7.5551 7.5551 8.3882 8.3882 8.6243 8.6243 k = 0.0000-0.3604-0.0173 ( 20521 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5811 -9.5811 -7.6958 -7.6958 -7.4421 -7.4421 -6.8516 -6.8516 -5.0423 -5.0423 -3.4934 -3.4934 -0.7532 -0.7532 -0.6184 -0.6184 1.1967 1.1967 1.4111 1.4111 1.7287 1.7287 2.3989 2.3989 2.7187 2.7187 2.9933 2.9933 3.2910 3.2910 3.9209 3.9209 4.3174 4.3174 4.6203 4.6203 7.1612 7.1612 7.6544 7.6544 8.3900 8.3900 8.6166 8.6166 k = 0.0000-0.3432-0.0164 ( 20537 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5887 -9.5887 -7.6915 -7.6915 -7.4382 -7.4382 -6.8624 -6.8624 -5.0034 -5.0034 -3.4849 -3.4849 -0.7606 -0.7606 -0.6245 -0.6245 1.1919 1.1919 1.3450 1.3450 1.7231 1.7231 2.3716 2.3716 2.7200 2.7200 2.9909 2.9909 3.2597 3.2597 3.9034 3.9034 4.3319 4.3319 4.6390 4.6390 7.2987 7.2987 7.7589 7.7589 8.3951 8.3951 8.6083 8.6083 k = 0.0000-0.3261-0.0156 ( 20533 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.5969 -9.5969 -7.6874 -7.6874 -7.4339 -7.4339 -6.8731 -6.8731 -4.9619 -4.9619 -3.4755 -3.4755 -0.7686 -0.7686 -0.6308 -0.6308 1.1810 1.1810 1.2760 1.2760 1.7193 1.7193 2.3401 2.3401 2.7235 2.7235 2.9848 2.9848 3.2302 3.2302 3.8949 3.8949 4.3477 4.3477 4.6586 4.6586 7.4352 7.4352 7.8651 7.8651 8.4054 8.4054 8.5999 8.5999 k = 0.0000-0.3089-0.0148 ( 20530 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6054 -9.6054 -7.6835 -7.6835 -7.4294 -7.4294 -6.8833 -6.8833 -4.9181 -4.9181 -3.4654 -3.4654 -0.7768 -0.7768 -0.6369 -0.6369 1.1444 1.1444 1.2256 1.2256 1.7167 1.7167 2.3025 2.3025 2.7286 2.7286 2.9752 2.9752 3.2080 3.2080 3.8929 3.8929 4.3645 4.3645 4.6792 4.6792 7.5663 7.5663 7.9683 7.9683 8.4245 8.4245 8.5916 8.5916 k = 0.0000-0.2918-0.0140 ( 20523 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6141 -9.6141 -7.6802 -7.6802 -7.4248 -7.4248 -6.8928 -6.8928 -4.8726 -4.8726 -3.4545 -3.4545 -0.7852 -0.7852 -0.6428 -0.6428 1.0698 1.0698 1.2079 1.2079 1.7145 1.7145 2.2573 2.2573 2.7350 2.7350 2.9640 2.9640 3.1955 3.1955 3.8951 3.8951 4.3821 4.3821 4.7004 4.7004 7.6869 7.6869 8.0629 8.0629 8.4566 8.4566 8.5847 8.5847 k = 0.0000-0.2746-0.0132 ( 20528 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6230 -9.6230 -7.6773 -7.6773 -7.4201 -7.4201 -6.9013 -6.9013 -4.8259 -4.8259 -3.4430 -3.4430 -0.7937 -0.7937 -0.6482 -0.6482 0.9811 0.9811 1.2009 1.2009 1.7124 1.7124 2.2042 2.2042 2.7426 2.7426 2.9543 2.9543 3.1920 3.1920 3.8998 3.8998 4.4004 4.4004 4.7219 4.7219 7.7911 7.7911 8.1435 8.1435 8.5026 8.5026 8.5840 8.5840 k = 0.0000-0.2574-0.0123 ( 20532 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6320 -9.6320 -7.6749 -7.6749 -7.4155 -7.4155 -6.9088 -6.9088 -4.7784 -4.7784 -3.4310 -3.4310 -0.8022 -0.8022 -0.6530 -0.6530 0.8876 0.8876 1.1965 1.1965 1.7097 1.7097 2.1437 2.1437 2.7514 2.7514 2.9487 2.9487 3.1956 3.1956 3.9058 3.9058 4.4192 4.4192 4.7437 4.7437 7.8734 7.8734 8.2083 8.2083 8.5361 8.5361 8.6178 8.6178 k = 0.0000-0.2403-0.0115 ( 20534 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6409 -9.6409 -7.6731 -7.6731 -7.4111 -7.4111 -6.9150 -6.9150 -4.7306 -4.7306 -3.4186 -3.4186 -0.8105 -0.8105 -0.6568 -0.6568 0.7925 0.7925 1.1931 1.1931 1.7063 1.7063 2.0776 2.0776 2.7614 2.7614 2.9481 2.9481 3.2043 3.2043 3.9123 3.9123 4.4382 4.4382 4.7653 4.7653 7.9310 7.9310 8.2588 8.2588 8.5376 8.5376 8.7016 8.7016 k = 0.0000-0.2231-0.0107 ( 20537 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6496 -9.6496 -7.6718 -7.6718 -7.4070 -7.4070 -6.9199 -6.9199 -4.6831 -4.6831 -3.4059 -3.4059 -0.8186 -0.8186 -0.6596 -0.6596 0.6971 0.6971 1.1903 1.1903 1.7013 1.7013 2.0086 2.0086 2.7725 2.7725 2.9524 2.9524 3.2166 3.2166 3.9187 3.9187 4.4571 4.4571 4.7866 4.7866 7.9662 7.9662 8.2964 8.2964 8.5305 8.5305 8.8051 8.8051 k = 0.0000-0.2059-0.0099 ( 20539 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6580 -9.6580 -7.6711 -7.6711 -7.4033 -7.4033 -6.9235 -6.9235 -4.6363 -4.6363 -3.3930 -3.3930 -0.8264 -0.8264 -0.6610 -0.6610 0.6027 0.6027 1.1879 1.1879 1.6939 1.6939 1.9396 1.9396 2.7846 2.7846 2.9606 2.9606 3.2316 3.2316 3.9248 3.9248 4.4758 4.4758 4.8074 4.8074 7.9841 7.9841 8.3214 8.3214 8.5207 8.5207 8.9156 8.9156 k = 0.0000-0.1888-0.0090 ( 20539 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6661 -9.6661 -7.6707 -7.6707 -7.4000 -7.4000 -6.9260 -6.9260 -4.5907 -4.5907 -3.3802 -3.3802 -0.8337 -0.8337 -0.6610 -0.6610 0.5101 0.5101 1.1861 1.1861 1.6820 1.6820 1.8747 1.8747 2.7972 2.7972 2.9717 2.9717 3.2484 3.2484 3.9303 3.9303 4.4940 4.4940 4.8274 4.8274 7.9900 7.9900 8.3347 8.3347 8.5090 8.5090 9.0266 9.0266 k = 0.0000-0.1716-0.0082 ( 20542 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6738 -9.6738 -7.6708 -7.6708 -7.3972 -7.3972 -6.9273 -6.9273 -4.5468 -4.5468 -3.3675 -3.3675 -0.8407 -0.8407 -0.6592 -0.6592 0.4203 0.4203 1.1849 1.1849 1.6617 1.6617 1.8196 1.8196 2.8098 2.8098 2.9850 2.9850 3.2664 3.2664 3.9350 3.9350 4.5115 4.5115 4.8464 4.8464 7.9880 7.9880 8.3385 8.3385 8.4957 8.4957 9.1335 9.1335 k = 0.0000-0.1545-0.0074 ( 20538 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6809 -9.6809 -7.6712 -7.6712 -7.3949 -7.3949 -6.9276 -6.9276 -4.5051 -4.5051 -3.3552 -3.3552 -0.8471 -0.8471 -0.6556 -0.6556 0.3339 0.3339 1.1845 1.1845 1.6283 1.6283 1.7801 1.7801 2.8221 2.8221 2.9997 2.9997 3.2850 3.2850 3.9390 3.9390 4.5280 4.5280 4.8641 4.8641 7.9809 7.9809 8.3350 8.3350 8.4814 8.4814 9.2328 9.2328 k = 0.0000-0.1373-0.0066 ( 20536 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6875 -9.6875 -7.6718 -7.6718 -7.3930 -7.3930 -6.9273 -6.9273 -4.4662 -4.4662 -3.3434 -3.3434 -0.8529 -0.8529 -0.6501 -0.6501 0.2517 0.2517 1.1850 1.1850 1.5828 1.5828 1.7564 1.7564 2.8336 2.8336 3.0149 3.0149 3.3036 3.3036 3.9422 3.9422 4.5433 4.5433 4.8805 4.8805 7.9707 7.9707 8.3267 8.3267 8.4670 8.4670 9.3219 9.3219 k = 0.0000-0.1201-0.0058 ( 20539 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6935 -9.6935 -7.6726 -7.6726 -7.3915 -7.3915 -6.9263 -6.9263 -4.4305 -4.4305 -3.3324 -3.3324 -0.8581 -0.8581 -0.6426 -0.6426 0.1745 0.1745 1.1866 1.1866 1.5318 1.5318 1.7428 1.7428 2.8440 2.8440 3.0302 3.0302 3.3216 3.3216 3.9446 3.9446 4.5572 4.5572 4.8954 4.8954 7.9587 7.9587 8.3153 8.3153 8.4532 8.4532 9.3979 9.3979 k = 0.0000-0.1030-0.0049 ( 20531 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6987 -9.6987 -7.6734 -7.6734 -7.3904 -7.3904 -6.9249 -6.9249 -4.3984 -4.3984 -3.3224 -3.3224 -0.8627 -0.8627 -0.6332 -0.6332 0.1031 0.1031 1.1896 1.1896 1.4809 1.4809 1.7344 1.7344 2.8532 2.8532 3.0449 3.0449 3.3387 3.3387 3.9464 3.9464 4.5696 4.5696 4.9086 4.9086 7.9461 7.9461 8.3024 8.3024 8.4407 8.4407 9.4467 9.4467 k = 0.0000-0.0858-0.0041 ( 20528 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7032 -9.7032 -7.6743 -7.6743 -7.3895 -7.3895 -6.9234 -6.9234 -4.3705 -4.3705 -3.3135 -3.3135 -0.8667 -0.8667 -0.6223 -0.6223 0.0385 0.0385 1.1943 1.1943 1.4329 1.4329 1.7288 1.7288 2.8611 2.8611 3.0583 3.0583 3.3541 3.3541 3.9476 3.9476 4.5804 4.5804 4.9199 4.9199 7.9339 7.9339 8.2894 8.2894 8.4298 8.4298 9.4389 9.4389 k = 0.0000-0.0686-0.0033 ( 20526 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7070 -9.7070 -7.6751 -7.6751 -7.3889 -7.3889 -6.9219 -6.9219 -4.3471 -4.3471 -3.3059 -3.3059 -0.8699 -0.8699 -0.6105 -0.6105 -0.0181 -0.0181 1.2010 1.2010 1.3894 1.3894 1.7249 1.7249 2.8676 2.8676 3.0701 3.0701 3.3675 3.3675 3.9483 3.9483 4.5893 4.5893 4.9293 4.9293 7.9227 7.9227 8.2774 8.2774 8.4209 8.4209 9.4203 9.4203 k = 0.0000-0.0515-0.0025 ( 20529 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7100 -9.7100 -7.6757 -7.6757 -7.3885 -7.3885 -6.9206 -6.9206 -4.3284 -4.3284 -3.2999 -3.2999 -0.8725 -0.8725 -0.5987 -0.5987 -0.0652 -0.0652 1.2098 1.2098 1.3510 1.3510 1.7222 1.7222 2.8726 2.8726 3.0798 3.0798 3.3785 3.3785 3.9488 3.9488 4.5964 4.5964 4.9367 4.9367 7.9134 7.9134 8.2671 8.2671 8.4139 8.4139 9.4041 9.4041 k = 0.0000-0.0343-0.0016 ( 20520 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7121 -9.7121 -7.6762 -7.6762 -7.3882 -7.3882 -6.9195 -6.9195 -4.3149 -4.3149 -3.2954 -3.2954 -0.8743 -0.8743 -0.5883 -0.5883 -0.1011 -0.1011 1.2210 1.2210 1.3183 1.3183 1.7204 1.7204 2.8762 2.8762 3.0870 3.0870 3.3865 3.3865 3.9490 3.9490 4.6015 4.6015 4.9421 4.9421 7.9063 7.9063 8.2594 8.2594 8.4089 8.4089 9.3920 9.3920 k = 0.0000-0.0172-0.0008 ( 20513 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7134 -9.7134 -7.6766 -7.6766 -7.3881 -7.3881 -6.9189 -6.9189 -4.3068 -4.3068 -3.2927 -3.2927 -0.8754 -0.8754 -0.5811 -0.5811 -0.1238 -0.1238 1.2337 1.2337 1.2926 1.2926 1.7193 1.7193 2.8783 2.8783 3.0914 3.0914 3.3915 3.3915 3.9490 3.9490 4.6045 4.6045 4.9453 4.9453 7.9019 7.9019 8.2546 8.2546 8.4059 8.4059 9.3845 9.3845 k = 0.0000 0.0000 0.0000 ( 20519 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7138 -9.7138 -7.6767 -7.6767 -7.3880 -7.3880 -6.9186 -6.9186 -4.3040 -4.3040 -3.2918 -3.2918 -0.8758 -0.8758 -0.5785 -0.5785 -0.1315 -0.1315 1.2415 1.2415 1.2804 1.2804 1.7190 1.7190 2.8790 2.8790 3.0929 3.0929 3.3932 3.3932 3.9491 3.9491 4.6056 4.6056 4.9464 4.9464 7.9004 7.9004 8.2529 8.2529 8.4049 8.4049 9.3820 9.3820 k = 0.0000 0.0000 0.0000 ( 20519 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7138 -9.7138 -7.6767 -7.6767 -7.3880 -7.3880 -6.9186 -6.9186 -4.3040 -4.3040 -3.2918 -3.2918 -0.8758 -0.8758 -0.5785 -0.5785 -0.1315 -0.1315 1.2415 1.2415 1.2804 1.2804 1.7190 1.7190 2.8790 2.8790 3.0929 3.0929 3.3932 3.3932 3.9491 3.9491 4.6056 4.6056 4.9464 4.9464 7.9004 7.9004 8.2529 8.2529 8.4049 8.4049 9.3820 9.3820 k = 0.0172 0.0003 0.0005 ( 20516 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7130 -9.7130 -7.6762 -7.6762 -7.3900 -7.3900 -6.9185 -6.9185 -4.3054 -4.3054 -3.2936 -3.2936 -0.8750 -0.8750 -0.5752 -0.5752 -0.1293 -0.1293 1.2296 1.2296 1.2952 1.2952 1.7186 1.7186 2.8791 2.8791 3.0938 3.0938 3.3926 3.3926 3.9477 3.9477 4.6041 4.6041 4.9447 4.9447 7.9011 7.9011 8.2540 8.2540 8.4087 8.4087 9.3853 9.3853 k = 0.0345 0.0005 0.0009 ( 20523 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7105 -9.7105 -7.6747 -7.6747 -7.3958 -7.3958 -6.9182 -6.9182 -4.3094 -4.3094 -3.2990 -3.2990 -0.8724 -0.8724 -0.5652 -0.5652 -0.1225 -0.1225 1.2104 1.2104 1.3223 1.3223 1.7179 1.7179 2.8793 2.8793 3.0963 3.0963 3.3909 3.3909 3.9435 3.9435 4.5998 4.5998 4.9397 4.9397 7.9031 7.9031 8.2573 8.2573 8.4202 8.4202 9.3950 9.3950 k = 0.0517 0.0008 0.0014 ( 20514 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7064 -9.7064 -7.6723 -7.6723 -7.4054 -7.4054 -6.9178 -6.9178 -4.3160 -4.3160 -3.3078 -3.3078 -0.8682 -0.8682 -0.5489 -0.5489 -0.1109 -0.1109 1.1921 1.1921 1.3522 1.3522 1.7182 1.7182 2.8795 2.8795 3.1006 3.1006 3.3883 3.3883 3.9367 3.9367 4.5926 4.5926 4.9315 4.9315 7.9062 7.9062 8.2625 8.2625 8.4389 8.4389 9.4095 9.4095 k = 0.0690 0.0010 0.0019 ( 20519 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7006 -9.7006 -7.6690 -7.6690 -7.4187 -7.4187 -6.9172 -6.9172 -4.3251 -4.3251 -3.3201 -3.3201 -0.8623 -0.8623 -0.5269 -0.5269 -0.0941 -0.0941 1.1756 1.1756 1.3810 1.3810 1.7223 1.7223 2.8796 2.8796 3.1065 3.1065 3.3851 3.3851 3.9272 3.9272 4.5824 4.5824 4.9199 4.9199 7.9098 7.9098 8.2691 8.2691 8.4643 8.4643 9.4233 9.4233 k = 0.0862 0.0013 0.0023 ( 20525 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6932 -9.6932 -7.6648 -7.6648 -7.4354 -7.4354 -6.9165 -6.9165 -4.3363 -4.3363 -3.3356 -3.3356 -0.8547 -0.8547 -0.5000 -0.5000 -0.0716 -0.0716 1.1609 1.1609 1.4047 1.4047 1.7341 1.7341 2.8796 2.8796 3.1141 3.1141 3.3818 3.3818 3.9153 3.9153 4.5694 4.5694 4.9051 4.9051 7.9131 7.9131 8.2758 8.2758 8.4958 8.4958 9.4145 9.4145 k = 0.1034 0.0015 0.0028 ( 20523 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6843 -9.6843 -7.6599 -7.6599 -7.4552 -7.4552 -6.9159 -6.9159 -4.3496 -4.3496 -3.3541 -3.3541 -0.8454 -0.8454 -0.4691 -0.4691 -0.0428 -0.0428 1.1476 1.1476 1.4188 1.4188 1.7582 1.7582 2.8792 2.8792 3.1234 3.1234 3.3787 3.3787 3.9011 3.9011 4.5536 4.5536 4.8872 4.8872 7.9149 7.9149 8.2809 8.2809 8.5324 8.5324 9.3552 9.3552 k = 0.1207 0.0018 0.0033 ( 20515 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6739 -9.6739 -7.6543 -7.6543 -7.4778 -7.4778 -6.9154 -6.9154 -4.3645 -4.3645 -3.3753 -3.3753 -0.8344 -0.8344 -0.4354 -0.4354 -0.0067 -0.0067 1.1355 1.1355 1.4204 1.4204 1.7972 1.7972 2.8784 2.8784 3.1342 3.1342 3.3763 3.3763 3.8848 3.8848 4.5348 4.5348 4.8662 4.8662 7.9134 7.9134 8.2813 8.2813 8.5730 8.5730 9.2701 9.2701 k = 0.1379 0.0020 0.0038 ( 20522 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6619 -9.6619 -7.6485 -7.6485 -7.5028 -7.5028 -6.9150 -6.9150 -4.3808 -4.3808 -3.3990 -3.3990 -0.8218 -0.8218 -0.4002 -0.4002 0.0371 0.0371 1.1243 1.1243 1.4100 1.4100 1.8506 1.8506 2.8772 2.8772 3.1467 3.1467 3.3750 3.3750 3.8669 3.8669 4.5132 4.5132 4.8422 4.8422 7.9055 7.9055 8.2735 8.2735 8.6163 8.6163 9.1855 9.1855 k = 0.1552 0.0023 0.0042 ( 20525 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6485 -9.6485 -7.6429 -7.6429 -7.5292 -7.5292 -6.9149 -6.9149 -4.3983 -4.3983 -3.4248 -3.4248 -0.8076 -0.8076 -0.3644 -0.3644 0.0892 0.0892 1.1140 1.1140 1.3898 1.3898 1.9160 1.9160 2.8759 2.8759 3.1607 3.1607 3.3750 3.3750 3.8476 3.8476 4.4887 4.4887 4.8154 4.8154 7.8861 7.8861 8.2551 8.2551 8.6604 8.6604 9.1174 9.1174 k = 0.1724 0.0025 0.0047 ( 20531 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6338 -9.6338 -7.6393 -7.6393 -7.5552 -7.5552 -6.9149 -6.9149 -4.4166 -4.4166 -3.4523 -3.4523 -0.7918 -0.7918 -0.3290 -0.3290 0.1495 0.1495 1.1044 1.1044 1.3623 1.3623 1.9906 1.9906 2.8747 2.8747 3.1760 3.1760 3.3765 3.3765 3.8276 3.8276 4.4614 4.4614 4.7860 4.7860 7.8473 7.8473 8.2283 8.2283 8.7030 8.7030 9.0757 9.0757 k = 0.1897 0.0028 0.0052 ( 20528 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.6178 -9.6178 -7.6422 -7.6422 -7.5760 -7.5760 -6.9153 -6.9153 -4.4354 -4.4354 -3.4812 -3.4812 -0.7746 -0.7746 -0.2943 -0.2943 0.2175 0.2175 1.0959 1.0959 1.3295 1.3295 2.0717 2.0717 2.8742 2.8742 3.1926 3.1926 3.3794 3.3794 3.8075 3.8075 4.4313 4.4313 4.7542 4.7542 7.7804 7.7804 8.2011 8.2011 8.7411 8.7411 9.0638 9.0638 k = 0.2069 0.0030 0.0056 ( 20521 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.6007 -9.6007 -7.6586 -7.6586 -7.5844 -7.5844 -6.9160 -6.9160 -4.4546 -4.4546 -3.5111 -3.5111 -0.7559 -0.7559 -0.2606 -0.2606 0.2920 0.2920 1.0888 1.0888 1.2929 1.2929 2.1571 2.1571 2.8753 2.8753 3.2101 3.2101 3.3834 3.3834 3.7879 3.7879 4.3983 4.3983 4.7202 4.7202 7.6821 7.6821 8.1817 8.1817 8.7709 8.7709 9.0781 9.0781 k = 0.2241 0.0033 0.0061 ( 20525 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5824 -9.5824 -7.6867 -7.6867 -7.5818 -7.5818 -6.9169 -6.9169 -4.4739 -4.4739 -3.5415 -3.5415 -0.7359 -0.7359 -0.2277 -0.2277 0.3710 0.3710 1.0841 1.0841 1.2539 1.2539 2.2445 2.2445 2.8790 2.8790 3.2281 3.2281 3.3882 3.3882 3.7701 3.7701 4.3626 4.3626 4.6843 4.6843 7.5571 7.5571 8.1720 8.1720 8.7865 8.7865 9.1118 9.1118 k = 0.2414 0.0035 0.0066 ( 20522 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5633 -9.5633 -7.7204 -7.7204 -7.5744 -7.5744 -6.9182 -6.9182 -4.4930 -4.4930 -3.5720 -3.5720 -0.7147 -0.7147 -0.1955 -0.1955 0.4514 0.4514 1.0831 1.0831 1.2141 1.2141 2.3315 2.3315 2.8868 2.8868 3.2461 3.2461 3.3935 3.3935 3.7551 3.7551 4.3241 4.3241 4.6469 4.6469 7.4138 7.4138 8.1702 8.1702 8.7790 8.7790 9.1582 9.1582 k = 0.2586 0.0038 0.0070 ( 20522 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5433 -9.5433 -7.7563 -7.7563 -7.5650 -7.5650 -6.9198 -6.9198 -4.5118 -4.5118 -3.6024 -3.6024 -0.6925 -0.6925 -0.1638 -0.1638 0.5290 0.5290 1.0862 1.0862 1.1770 1.1770 2.4149 2.4149 2.9005 2.9005 3.2632 3.2632 3.3991 3.3991 3.7443 3.7443 4.2829 4.2829 4.6082 4.6082 7.2600 7.2600 8.1737 8.1737 8.7377 8.7377 9.2120 9.2120 k = 0.2759 0.0040 0.0075 ( 20534 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5228 -9.5228 -7.7934 -7.7934 -7.5546 -7.5546 -6.9217 -6.9217 -4.5301 -4.5301 -3.6322 -3.6322 -0.6694 -0.6694 -0.1322 -0.1322 0.5979 0.5979 1.0845 1.0845 1.1572 1.1572 2.4914 2.4914 2.9222 2.9222 3.2782 3.2782 3.4051 3.4051 3.7390 3.7390 4.2391 4.2391 4.5685 4.5685 7.1016 7.1016 8.1805 8.1805 8.6587 8.6587 9.2676 9.2676 k = 0.2931 0.0043 0.0080 ( 20536 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5018 -9.5018 -7.8308 -7.8308 -7.5438 -7.5438 -6.9239 -6.9239 -4.5478 -4.5478 -3.6610 -3.6610 -0.6456 -0.6456 -0.1008 -0.1008 0.6517 0.6517 1.0581 1.0581 1.1806 1.1806 2.5575 2.5575 2.9532 2.9532 3.2898 3.2898 3.4122 3.4122 3.7403 3.7403 4.1930 4.1930 4.5284 4.5284 6.9428 6.9428 8.1892 8.1892 8.5488 8.5488 9.3078 9.3078 k = 0.3103 0.0045 0.0084 ( 20542 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4806 -9.4806 -7.8679 -7.8679 -7.5328 -7.5328 -6.9263 -6.9263 -4.5646 -4.5646 -3.6886 -3.6886 -0.6214 -0.6214 -0.0695 -0.0695 0.6863 0.6863 1.0189 1.0189 1.2391 1.2391 2.6115 2.6115 2.9927 2.9927 3.2974 3.2974 3.4214 3.4214 3.7489 3.7489 4.1450 4.1450 4.4882 4.4882 6.7871 6.7871 8.1981 8.1981 8.4199 8.4199 9.3247 9.3247 k = 0.3276 0.0048 0.0089 ( 20541 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4594 -9.4594 -7.9043 -7.9043 -7.5218 -7.5218 -6.9289 -6.9289 -4.5804 -4.5804 -3.7147 -3.7147 -0.5970 -0.5970 -0.0383 -0.0383 0.7028 0.7028 0.9770 0.9770 1.3214 1.3214 2.6539 2.6539 3.0359 3.0359 3.3025 3.3025 3.4326 3.4326 3.7648 3.7648 4.0959 4.0959 4.4483 4.4483 6.6374 6.6374 8.1999 8.1999 8.2882 8.2882 9.3384 9.3384 k = 0.3448 0.0050 0.0094 ( 20539 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.4386 -9.4386 -7.9394 -7.9394 -7.5112 -7.5112 -6.9316 -6.9316 -4.5951 -4.5951 -3.7391 -3.7391 -0.5728 -0.5728 -0.0073 -0.0073 0.7053 0.7053 0.9352 0.9352 1.4201 1.4201 2.6877 2.6877 3.0742 3.0742 3.3091 3.3091 3.4449 3.4449 3.7876 3.7876 4.0473 4.0473 4.4092 4.4092 6.4961 6.4961 8.1176 8.1176 8.2368 8.2368 9.3507 9.3507 k = 0.3621 0.0053 0.0098 ( 20526 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.4185 -9.4185 -7.9727 -7.9727 -7.5010 -7.5010 -6.9343 -6.9343 -4.6087 -4.6087 -3.7614 -3.7614 -0.5491 -0.5491 0.0234 0.0234 0.6985 0.6985 0.8944 0.8944 1.5294 1.5294 2.7160 2.7160 3.0987 3.0987 3.3208 3.3208 3.4572 3.4572 3.8155 3.8155 4.0018 4.0018 4.3714 4.3714 6.3655 6.3655 7.9784 7.9784 8.2429 8.2429 9.3604 9.3604 k = 0.3793 0.0055 0.0103 ( 20526 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.3994 -9.3994 -8.0038 -8.0038 -7.4914 -7.4914 -6.9370 -6.9370 -4.6209 -4.6209 -3.7816 -3.7816 -0.5264 -0.5264 0.0533 0.0533 0.6861 0.6861 0.8555 0.8555 1.6442 1.6442 2.7415 2.7415 3.1059 3.1059 3.3349 3.3349 3.4700 3.4700 3.8443 3.8443 3.9649 3.9649 4.3355 4.3355 6.2477 6.2477 7.8395 7.8395 8.2529 8.2529 9.3672 9.3672 k = 0.3966 0.0058 0.0108 ( 20524 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.3817 -9.3817 -8.0322 -8.0322 -7.4827 -7.4827 -6.9396 -6.9396 -4.6317 -4.6317 -3.7994 -3.7994 -0.5051 -0.5051 0.0821 0.0821 0.6707 0.6707 0.8191 0.8191 1.7607 1.7607 2.7661 2.7661 3.0991 3.0991 3.3401 3.3401 3.4862 3.4862 3.8619 3.8619 3.9495 3.9495 4.3021 4.3021 6.1445 6.1445 7.7077 7.7077 8.2630 8.2630 9.3712 9.3712 k = 0.4138 0.0060 0.0113 ( 20522 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.3658 -9.3658 -8.0573 -8.0573 -7.4750 -7.4750 -6.9420 -6.9420 -4.6410 -4.6410 -3.8147 -3.8147 -0.4858 -0.4858 0.1092 0.1092 0.6543 0.6543 0.7858 0.7858 1.8750 1.8750 2.7910 2.7910 3.0838 3.0838 3.3266 3.3266 3.5080 3.5080 3.8568 3.8568 3.9662 3.9662 4.2721 4.2721 6.0572 6.0572 7.5869 7.5869 8.2724 8.2724 9.3730 9.3730 k = 0.4310 0.0063 0.0117 ( 20518 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.3520 -9.3520 -8.0787 -8.0787 -7.4685 -7.4685 -6.9442 -6.9442 -4.6487 -4.6487 -3.8274 -3.8274 -0.4690 -0.4690 0.1337 0.1337 0.6385 0.6385 0.7565 0.7565 1.9828 1.9828 2.8171 2.8171 3.0642 3.0642 3.2941 3.2941 3.5327 3.5327 3.8447 3.8447 3.9969 3.9969 4.2461 4.2461 5.9867 5.9867 7.4808 7.4808 8.2806 8.2806 9.3733 9.3733 k = 0.4483 0.0065 0.0122 ( 20516 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.3409 -9.3409 -8.0959 -8.0959 -7.4632 -7.4632 -6.9459 -6.9459 -4.6548 -4.6548 -3.8373 -3.8373 -0.4552 -0.4552 0.1547 0.1547 0.6246 0.6246 0.7321 0.7321 2.0790 2.0790 2.8450 2.8450 3.0427 3.0427 3.2494 3.2494 3.5560 3.5560 3.8355 3.8355 4.0267 4.0267 4.2252 4.2252 5.9332 5.9332 7.3930 7.3930 8.2873 8.2873 9.3728 9.3728 k = 0.4655 0.0068 0.0127 ( 20522 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.3326 -9.3326 -8.1084 -8.1084 -7.4593 -7.4593 -6.9472 -6.9472 -4.6591 -4.6591 -3.8445 -3.8445 -0.4450 -0.4450 0.1710 0.1710 0.6137 0.6137 0.7137 0.7137 2.1567 2.1567 2.8747 2.8747 3.0206 3.0206 3.2021 3.2021 3.5747 3.5747 3.8300 3.8300 4.0503 4.0503 4.2100 4.2100 5.8960 5.8960 7.3271 7.3271 8.2922 8.2922 9.3720 9.3720 k = 0.4828 0.0070 0.0131 ( 20523 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.3276 -9.3276 -8.1161 -8.1161 -7.4570 -7.4570 -6.9480 -6.9480 -4.6618 -4.6618 -3.8488 -3.8488 -0.4386 -0.4386 0.1814 0.1814 0.6067 0.6067 0.7021 0.7021 2.2082 2.2082 2.9039 2.9039 2.9988 2.9988 3.1650 3.1650 3.5868 3.5868 3.8271 3.8271 4.0649 4.0649 4.2010 4.2010 5.8743 5.8743 7.2861 7.2861 8.2953 8.2953 9.3714 9.3714 k = 0.5000 0.0073 0.0136 ( 20528 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.3259 -9.3259 -8.1187 -8.1187 -7.4562 -7.4562 -6.9483 -6.9483 -4.6627 -4.6627 -3.8502 -3.8502 -0.4365 -0.4365 0.1850 0.1850 0.6043 0.6043 0.6982 0.6982 2.2263 2.2263 2.9196 2.9196 2.9863 2.9863 3.1506 3.1506 3.5910 3.5910 3.8263 3.8263 4.0699 4.0699 4.1980 4.1980 5.8672 5.8672 7.2722 7.2722 8.2963 8.2963 9.3711 9.3711 k = 0.5000-0.4904-0.0103 ( 20536 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.1912 -9.1912 -7.9138 -7.9138 -7.4089 -7.4089 -7.1263 -7.1263 -5.3893 -5.3893 -4.3802 -4.3802 -0.3035 -0.3035 0.9200 0.9200 1.5312 1.5312 1.7139 1.7139 2.0627 2.0627 2.8585 2.8585 3.1704 3.1704 3.3599 3.3599 3.5861 3.5861 4.0008 4.0008 4.7293 4.7293 4.7675 4.7675 5.4831 5.4831 6.3598 6.3598 6.6865 6.6865 7.1222 7.1222 k = 0.4875-0.4782-0.0100 ( 20546 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.1922 -9.1922 -7.9134 -7.9134 -7.4107 -7.4107 -7.1239 -7.1239 -5.3888 -5.3888 -4.3778 -4.3778 -0.3047 -0.3047 0.9208 0.9208 1.5196 1.5196 1.7176 1.7176 2.0649 2.0649 2.8536 2.8536 3.1683 3.1683 3.3613 3.3613 3.5812 3.5812 4.0031 4.0031 4.7062 4.7062 4.7874 4.7874 5.4835 5.4835 6.3659 6.3659 6.6955 6.6955 7.1327 7.1327 k = 0.4750-0.4659-0.0097 ( 20546 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.1950 -9.1950 -7.9120 -7.9120 -7.4158 -7.4158 -7.1170 -7.1170 -5.3874 -5.3874 -4.3708 -4.3708 -0.3081 -0.3081 0.9231 0.9231 1.4875 1.4875 1.7263 1.7263 2.0714 2.0714 2.8389 2.8389 3.1619 3.1619 3.3651 3.3651 3.5677 3.5677 4.0092 4.0092 4.6683 4.6683 4.8152 4.8152 5.4858 5.4858 6.3844 6.3844 6.7220 6.7220 7.1638 7.1638 k = 0.4625-0.4536-0.0095 ( 20540 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.1998 -9.1998 -7.9097 -7.9097 -7.4237 -7.4237 -7.1062 -7.1062 -5.3848 -5.3848 -4.3591 -4.3591 -0.3137 -0.3137 0.9270 0.9270 1.4398 1.4398 1.7359 1.7359 2.0819 2.0819 2.8148 2.8148 3.1509 3.1509 3.3695 3.3695 3.5492 3.5492 4.0172 4.0172 4.6261 4.6261 4.8395 4.8395 5.4926 5.4926 6.4157 6.4157 6.7650 6.7650 7.2137 7.2137 k = 0.4500-0.4414-0.0092 ( 20548 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.2064 -9.2064 -7.9065 -7.9065 -7.4335 -7.4335 -7.0924 -7.0924 -5.3809 -5.3809 -4.3431 -4.3431 -0.3215 -0.3215 0.9323 0.9323 1.3804 1.3804 1.7444 1.7444 2.0959 2.0959 2.7814 2.7814 3.1349 3.1349 3.3706 3.3706 3.5322 3.5322 4.0244 4.0244 4.5804 4.5804 4.8586 4.8586 5.5078 5.5078 6.4599 6.4599 6.8227 6.8227 7.2801 7.2801 k = 0.4375-0.4291-0.0090 ( 20545 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.2148 -9.2148 -7.9024 -7.9024 -7.4447 -7.4447 -7.0765 -7.0765 -5.3754 -5.3754 -4.3229 -4.3229 -0.3314 -0.3314 0.9390 0.9390 1.3116 1.3116 1.7508 1.7508 2.1126 2.1126 2.7394 2.7394 3.1137 3.1137 3.3627 3.3627 3.5248 3.5248 4.0282 4.0282 4.5310 4.5310 4.8723 4.8723 5.5349 5.5349 6.5170 6.5170 6.8934 6.8934 7.3605 7.3605 k = 0.4250-0.4169-0.0087 ( 20538 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.2248 -9.2248 -7.8972 -7.8972 -7.4565 -7.4565 -7.0593 -7.0593 -5.3681 -5.3681 -4.2989 -4.2989 -0.3432 -0.3432 0.9471 0.9471 1.2354 1.2354 1.7552 1.7552 2.1315 2.1315 2.6892 2.6892 3.0870 3.0870 3.3437 3.3437 3.5317 3.5317 4.0266 4.0266 4.4775 4.4775 4.8811 4.8811 5.5765 5.5765 6.5864 6.5864 6.9750 6.9750 7.4525 7.4525 k = 0.4125-0.4046-0.0085 ( 20535 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.2365 -9.2365 -7.8911 -7.8911 -7.4685 -7.4685 -7.0415 -7.0415 -5.3586 -5.3586 -4.2714 -4.2714 -0.3569 -0.3569 0.9562 0.9562 1.1535 1.1535 1.7574 1.7574 2.1517 2.1517 2.6317 2.6317 3.0547 3.0547 3.3182 3.3182 3.5503 3.5503 4.0177 4.0177 4.4205 4.4205 4.8863 4.8863 5.6338 5.6338 6.6669 6.6669 7.0660 7.0660 7.5538 7.5538 k = 0.4000-0.3923-0.0082 ( 20522 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.2497 -9.2497 -7.8840 -7.8840 -7.4804 -7.4804 -7.0237 -7.0237 -5.3467 -5.3467 -4.2407 -4.2407 -0.3723 -0.3723 0.9651 0.9651 1.0685 1.0685 1.7574 1.7574 2.1724 2.1724 2.5676 2.5676 3.0171 3.0171 3.2922 3.2922 3.5759 3.5759 4.0005 4.0005 4.3610 4.3610 4.8890 4.8890 5.7066 5.7066 6.7572 6.7572 7.1648 7.1648 7.6625 7.6625 k = 0.3875-0.3801-0.0079 ( 20516 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.2643 -9.2643 -7.8758 -7.8758 -7.4919 -7.4919 -7.0063 -7.0063 -5.3321 -5.3321 -4.2072 -4.2072 -0.3892 -0.3892 0.9554 0.9554 0.9999 0.9999 1.7550 1.7550 2.1927 2.1927 2.4983 2.4983 2.9758 2.9758 3.2691 3.2691 3.6051 3.6051 3.9748 3.9748 4.3010 4.3010 4.8904 4.8904 5.7936 5.7936 6.8559 6.8559 7.2700 7.2700 7.7768 7.7768 k = 0.3750-0.3678-0.0077 ( 20521 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.2801 -9.2801 -7.8666 -7.8666 -7.5029 -7.5029 -6.9898 -6.9898 -5.3145 -5.3145 -4.1713 -4.1713 -0.4074 -0.4074 0.8754 0.8754 1.0003 1.0003 1.7495 1.7495 2.2112 2.2112 2.4248 2.4248 2.9335 2.9335 3.2500 3.2500 3.6343 3.6343 3.9413 3.9413 4.2426 4.2426 4.8913 4.8913 5.8934 5.8934 6.9614 6.9614 7.3804 7.3804 7.8953 7.8953 k = 0.3625-0.3556-0.0074 ( 20520 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.2971 -9.2971 -7.8563 -7.8563 -7.5133 -7.5133 -6.9742 -6.9742 -5.2939 -5.2939 -4.1333 -4.1333 -0.4269 -0.4269 0.7823 0.7823 1.0135 1.0135 1.7400 1.7400 2.2262 2.2262 2.3489 2.3489 2.8937 2.8937 3.2348 3.2348 3.6586 3.6586 3.9040 3.9040 4.1879 4.1879 4.8919 4.8919 6.0042 6.0042 7.0722 7.0722 7.4947 7.4947 8.0164 8.0164 k = 0.3500-0.3433-0.0072 ( 20528 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.3150 -9.3150 -7.8450 -7.8450 -7.5231 -7.5231 -6.9600 -6.9600 -5.2700 -5.2700 -4.0935 -4.0935 -0.4473 -0.4473 0.6873 0.6873 1.0290 1.0290 1.7252 1.7252 2.2311 2.2311 2.2775 2.2775 2.8599 2.8599 3.2225 3.2225 3.6686 3.6686 3.8722 3.8722 4.1385 4.1385 4.8926 4.8926 6.1244 6.1244 7.1869 7.1869 7.6118 7.6118 8.1382 8.1382 k = 0.3375-0.3310-0.0069 ( 20527 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.3338 -9.3338 -7.8327 -7.8327 -7.5322 -7.5322 -6.9471 -6.9471 -5.2430 -5.2430 -4.0523 -4.0523 -0.4686 -0.4686 0.5921 0.5921 1.0457 1.0457 1.7036 1.7036 2.1802 2.1802 2.2568 2.2568 2.8352 2.8352 3.2119 3.2119 3.6509 3.6509 3.8600 3.8600 4.0954 4.0954 4.8932 4.8932 6.2523 6.2523 7.3042 7.3042 7.7302 7.7302 8.2581 8.2581 k = 0.3250-0.3188-0.0067 ( 20529 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.3533 -9.3533 -7.8194 -7.8194 -7.5407 -7.5407 -6.9357 -6.9357 -5.2128 -5.2128 -4.0100 -4.0100 -0.4906 -0.4906 0.4975 0.4975 1.0634 1.0634 1.6736 1.6736 2.1031 2.1031 2.2586 2.2586 2.8212 2.8212 3.2017 3.2017 3.6055 3.6055 3.8677 3.8677 4.0605 4.0605 4.8938 4.8938 6.3864 6.3864 7.4228 7.4228 7.8480 7.8480 8.3706 8.3706 k = 0.3125-0.3065-0.0064 ( 20523 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3732 -9.3732 -7.8052 -7.8052 -7.5486 -7.5486 -6.9258 -6.9258 -5.1796 -5.1796 -3.9669 -3.9669 -0.5131 -0.5131 0.4043 0.4043 1.0817 1.0817 1.6340 1.6340 2.0252 2.0252 2.2598 2.2598 2.8184 2.8184 3.1898 3.1898 3.5462 3.5462 3.8799 3.8799 4.0385 4.0385 4.8943 4.8943 6.5256 6.5256 7.5412 7.5412 7.9627 7.9627 8.4615 8.4615 k = 0.3000-0.2943-0.0062 ( 20526 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3936 -9.3936 -7.7901 -7.7901 -7.5560 -7.5560 -6.9173 -6.9173 -5.1435 -5.1435 -3.9233 -3.9233 -0.5360 -0.5360 0.3130 0.3130 1.1003 1.1003 1.5842 1.5842 1.9490 1.9490 2.2604 2.2604 2.8253 2.8253 3.1733 3.1733 3.4850 3.4850 3.8808 3.8808 4.0367 4.0367 4.8947 4.8947 6.6684 6.6684 7.6582 7.6582 8.0701 8.0701 8.5142 8.5142 k = 0.2875-0.2820-0.0059 ( 20526 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4142 -9.4142 -7.7742 -7.7742 -7.5627 -7.5627 -6.9102 -6.9102 -5.1048 -5.1048 -3.8795 -3.8795 -0.5590 -0.5590 0.2241 0.2241 1.1189 1.1189 1.5246 1.5246 1.8757 1.8757 2.2616 2.2616 2.8399 2.8399 3.1480 3.1480 3.4310 3.4310 3.8665 3.8665 4.0555 4.0555 4.8950 4.8950 6.8138 6.8138 7.7719 7.7719 8.1639 8.1639 8.5504 8.5504 k = 0.2750-0.2697-0.0056 ( 20517 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4349 -9.4349 -7.7577 -7.7577 -7.5689 -7.5689 -6.9043 -6.9043 -5.0637 -5.0637 -3.8358 -3.8358 -0.5820 -0.5820 0.1382 0.1382 1.1366 1.1366 1.4567 1.4567 1.8058 1.8058 2.2643 2.2643 2.8594 2.8594 3.1105 3.1105 3.3909 3.3909 3.8438 3.8438 4.0864 4.0864 4.8953 4.8953 6.9604 6.9604 7.8802 7.8802 8.2368 8.2368 8.5979 8.5979 k = 0.2625-0.2575-0.0054 ( 20525 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4555 -9.4555 -7.7407 -7.7407 -7.5744 -7.5744 -6.8996 -6.8996 -5.0206 -5.0206 -3.7925 -3.7925 -0.6050 -0.6050 0.0555 0.0555 1.1519 1.1519 1.3833 1.3833 1.7397 1.7397 2.2682 2.2682 2.8800 2.8800 3.0621 3.0621 3.3666 3.3666 3.8186 3.8186 4.1226 4.1226 4.8956 4.8956 7.1069 7.1069 7.9798 7.9798 8.2877 8.2877 8.6658 8.6658 k = 0.2500-0.2452-0.0051 ( 20525 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4760 -9.4760 -7.7235 -7.7235 -7.5791 -7.5791 -6.8960 -6.8960 -4.9757 -4.9757 -3.7497 -3.7497 -0.6276 -0.6276 -0.0234 -0.0234 1.1604 1.1604 1.3100 1.3100 1.6783 1.6783 2.2725 2.2725 2.8945 2.8945 3.0130 3.0130 3.3554 3.3554 3.7941 3.7941 4.1609 4.1609 4.8959 4.8959 7.2518 7.2518 8.0661 8.0661 8.3258 8.3258 8.7481 8.7481 k = 0.2375-0.2330-0.0049 ( 20522 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4962 -9.4962 -7.7065 -7.7065 -7.5828 -7.5828 -6.8933 -6.8933 -4.9296 -4.9296 -3.7079 -3.7079 -0.6499 -0.6499 -0.0982 -0.0982 1.1452 1.1452 1.2544 1.2544 1.6222 1.6222 2.2753 2.2753 2.8832 2.8832 2.9873 2.9873 3.3530 3.3530 3.7720 3.7720 4.1995 4.1995 4.8964 4.8964 7.3928 7.3928 8.1333 8.1333 8.3650 8.3650 8.8307 8.8307 k = 0.2250-0.2207-0.0046 ( 20535 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5159 -9.5159 -7.6903 -7.6903 -7.5851 -7.5851 -6.8915 -6.8915 -4.8825 -4.8825 -3.6672 -3.6672 -0.6716 -0.6716 -0.1686 -0.1686 1.0856 1.0856 1.2372 1.2372 1.5730 1.5730 2.2742 2.2742 2.8411 2.8411 2.9941 2.9941 3.3563 3.3563 3.7535 3.7535 4.2375 4.2375 4.8972 4.8972 7.5271 7.5271 8.1794 8.1794 8.4136 8.4136 8.8894 8.8894 k = 0.2125-0.2084-0.0044 ( 20541 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5352 -9.5352 -7.6757 -7.6757 -7.5850 -7.5850 -6.8904 -6.8904 -4.8348 -4.8348 -3.6279 -3.6279 -0.6927 -0.6927 -0.2342 -0.2342 1.0035 1.0035 1.2362 1.2362 1.5325 1.5325 2.2660 2.2660 2.7941 2.7941 3.0114 3.0114 3.3628 3.3628 3.7396 3.7396 4.2744 4.2744 4.8983 4.8983 7.6503 7.6503 8.2114 8.2114 8.4698 8.4698 8.9025 8.9025 k = 0.2000-0.1962-0.0041 ( 20540 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5539 -9.5539 -7.6640 -7.6640 -7.5816 -7.5816 -6.8900 -6.8900 -4.7869 -4.7869 -3.5901 -3.5901 -0.7131 -0.7131 -0.2949 -0.2949 0.9149 0.9149 1.2341 1.2341 1.5027 1.5027 2.2475 2.2475 2.7556 2.7556 3.0292 3.0292 3.3709 3.3709 3.7312 3.7312 4.3097 4.3097 4.8998 4.8998 7.7565 7.7565 8.2407 8.2407 8.5275 8.5275 8.8866 8.8866 k = 0.1875-0.1839-0.0038 ( 20542 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5718 -9.5718 -7.6563 -7.6563 -7.5738 -7.5738 -6.8902 -6.8902 -4.7393 -4.7393 -3.5541 -3.5541 -0.7325 -0.7325 -0.3504 -0.3504 0.8245 0.8245 1.2260 1.2260 1.4849 1.4849 2.2166 2.2166 2.7302 2.7302 3.0449 3.0449 3.3789 3.3789 3.7291 3.7291 4.3433 4.3433 4.9017 4.9017 7.8389 7.8389 8.2757 8.2757 8.5835 8.5835 8.8605 8.8605 k = 0.1750-0.1717-0.0036 ( 20540 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.5890 -9.5890 -7.6527 -7.6527 -7.5618 -7.5618 -6.8910 -6.8910 -4.6923 -4.6923 -3.5201 -3.5201 -0.7509 -0.7509 -0.4004 -0.4004 0.7338 0.7338 1.2118 1.2118 1.4781 1.4781 2.1737 2.1737 2.7187 2.7187 3.0578 3.0578 3.3858 3.3858 3.7335 3.7335 4.3750 4.3750 4.9042 4.9042 7.8942 7.8942 8.3168 8.3168 8.6366 8.6366 8.8350 8.8350 k = 0.1625-0.1594-0.0033 ( 20546 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6052 -9.6052 -7.6520 -7.6520 -7.5467 -7.5467 -6.8922 -6.8922 -4.6463 -4.6463 -3.4882 -3.4882 -0.7682 -0.7682 -0.4448 -0.4448 0.6440 0.6440 1.1937 1.1937 1.4796 1.4796 2.1214 2.1214 2.7190 2.7190 3.0676 3.0676 3.3910 3.3910 3.7440 3.7440 4.4047 4.4047 4.9071 4.9071 7.9257 7.9257 8.3560 8.3560 8.6786 8.6786 8.8267 8.8267 k = 0.1500-0.1471-0.0031 ( 20547 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6206 -9.6206 -7.6531 -7.6531 -7.5299 -7.5299 -6.8938 -6.8938 -4.6018 -4.6018 -3.4585 -3.4585 -0.7844 -0.7844 -0.4836 -0.4836 0.5556 0.5556 1.1746 1.1746 1.4861 1.4861 2.0630 2.0630 2.7278 2.7278 3.0748 3.0748 3.3942 3.3942 3.7598 3.7598 4.4324 4.4324 4.9105 4.9105 7.9407 7.9407 8.3835 8.3835 8.6852 8.6852 8.8649 8.8649 k = 0.1375-0.1349-0.0028 ( 20546 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6349 -9.6349 -7.6553 -7.6553 -7.5123 -7.5123 -6.8958 -6.8958 -4.5591 -4.5591 -3.4313 -3.4313 -0.7992 -0.7992 -0.5165 -0.5165 0.4693 0.4693 1.1569 1.1569 1.4946 1.4946 2.0020 2.0020 2.7424 2.7424 3.0796 3.0796 3.3959 3.3959 3.7795 3.7795 4.4582 4.4582 4.9142 4.9142 7.9456 7.9456 8.3954 8.3954 8.6623 8.6623 8.9434 8.9434 k = 0.1250-0.1226-0.0026 ( 20542 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6482 -9.6482 -7.6580 -7.6580 -7.4946 -7.4946 -6.8981 -6.8981 -4.5186 -4.5186 -3.4064 -3.4064 -0.8127 -0.8127 -0.5437 -0.5437 0.3857 0.3857 1.1421 1.1421 1.5028 1.5028 1.9412 1.9412 2.7602 2.7602 3.0827 3.0827 3.3963 3.3963 3.8017 3.8017 4.4820 4.4820 4.9181 4.9181 7.9447 7.9447 8.3937 8.3937 8.6299 8.6299 9.0380 9.0380 k = 0.1125-0.1103-0.0023 ( 20526 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6604 -9.6604 -7.6609 -7.6609 -7.4773 -7.4773 -6.9007 -6.9007 -4.4806 -4.4806 -3.3841 -3.3841 -0.8249 -0.8249 -0.5651 -0.5651 0.3053 0.3053 1.1314 1.1314 1.5083 1.5083 1.8834 1.8834 2.7794 2.7794 3.0845 3.0845 3.3961 3.3961 3.8250 3.8250 4.5039 4.5039 4.9222 4.9222 7.9408 7.9408 8.3822 8.3822 8.5953 8.5953 9.1363 9.1363 k = 0.1000-0.0981-0.0021 ( 20528 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6714 -9.6714 -7.6638 -7.6638 -7.4607 -7.4607 -6.9034 -6.9034 -4.4456 -4.4456 -3.3642 -3.3642 -0.8356 -0.8356 -0.5808 -0.5808 0.2287 0.2287 1.1253 1.1253 1.5085 1.5085 1.8315 1.8315 2.7987 2.7987 3.0856 3.0856 3.3955 3.3955 3.8480 3.8480 4.5239 4.5239 4.9264 4.9264 7.9353 7.9353 8.3647 8.3647 8.5609 8.5609 9.2312 9.2312 k = 0.0875-0.0858-0.0018 ( 20536 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6812 -9.6812 -7.6665 -7.6665 -7.4452 -7.4452 -6.9062 -6.9062 -4.4138 -4.4138 -3.3469 -3.3469 -0.8451 -0.8451 -0.5912 -0.5912 0.1565 0.1565 1.1242 1.1242 1.5007 1.5007 1.7886 1.7886 2.8170 2.8170 3.0864 3.0864 3.3948 3.3948 3.8700 3.8700 4.5420 4.5420 4.9304 4.9304 7.9291 7.9291 8.3441 8.3441 8.5283 8.5283 9.3165 9.3165 k = 0.0750-0.0736-0.0015 ( 20534 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6897 -9.6897 -7.6690 -7.6690 -7.4311 -7.4311 -6.9089 -6.9089 -4.3856 -4.3856 -3.3320 -3.3320 -0.8532 -0.8532 -0.5965 -0.5965 0.0896 0.0896 1.1283 1.1283 1.4827 1.4827 1.7572 1.7572 2.8335 2.8335 3.0872 3.0872 3.3942 3.3942 3.8900 3.8900 4.5581 4.5581 4.9342 4.9342 7.9228 7.9228 8.3228 8.3228 8.4982 8.4982 9.3843 9.3843 k = 0.0625-0.0613-0.0013 ( 20527 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6970 -9.6970 -7.6713 -7.6713 -7.4185 -7.4185 -6.9115 -6.9115 -4.3612 -4.3612 -3.3195 -3.3195 -0.8601 -0.8601 -0.5974 -0.5974 0.0289 0.0289 1.1377 1.1377 1.4545 1.4545 1.7373 1.7373 2.8476 2.8476 3.0882 3.0882 3.3938 3.3938 3.9076 3.9076 4.5722 4.5722 4.9376 4.9376 7.9168 7.9168 8.3028 8.3028 8.4714 8.4714 9.4222 9.4222 k = 0.0500-0.0490-0.0010 ( 20522 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7030 -9.7030 -7.6732 -7.6732 -7.4079 -7.4079 -6.9139 -6.9139 -4.3409 -4.3409 -3.3095 -3.3095 -0.8658 -0.8658 -0.5948 -0.5948 -0.0245 -0.0245 1.1522 1.1522 1.4190 1.4190 1.7265 1.7265 2.8592 2.8592 3.0893 3.0893 3.3935 3.3935 3.9223 3.9223 4.5839 4.5839 4.9406 4.9406 7.9114 7.9114 8.2854 8.2854 8.4484 8.4484 9.4249 9.4249 k = 0.0375-0.0368-0.0008 ( 20515 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7077 -9.7077 -7.6747 -7.6747 -7.3994 -7.3994 -6.9159 -6.9159 -4.3249 -4.3249 -3.3017 -3.3017 -0.8701 -0.8701 -0.5899 -0.5899 -0.0690 -0.0690 1.1716 1.1716 1.3797 1.3797 1.7216 1.7216 2.8680 2.8680 3.0906 3.0906 3.3933 3.3933 3.9339 3.9339 4.5933 4.5933 4.9431 4.9431 7.9068 7.9068 8.2713 8.2713 8.4298 8.4298 9.4110 9.4110 k = 0.0250-0.0245-0.0005 ( 20516 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7111 -9.7111 -7.6758 -7.6758 -7.3931 -7.3931 -6.9174 -6.9174 -4.3133 -4.3133 -3.2962 -3.2962 -0.8733 -0.8733 -0.5844 -0.5844 -0.1028 -0.1028 1.1955 1.1955 1.3399 1.3399 1.7196 1.7196 2.8742 2.8742 3.0918 3.0918 3.3932 3.3932 3.9423 3.9423 4.6001 4.6001 4.9449 4.9449 7.9033 7.9033 8.2611 8.2611 8.4161 8.4161 9.3960 9.3960 k = 0.0125-0.0123-0.0003 ( 20511 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7131 -9.7131 -7.6765 -7.6765 -7.3893 -7.3893 -6.9183 -6.9183 -4.3063 -4.3063 -3.2929 -3.2929 -0.8752 -0.8752 -0.5802 -0.5802 -0.1242 -0.1242 1.2225 1.2225 1.3029 1.3029 1.7191 1.7191 2.8778 2.8778 3.0926 3.0926 3.3932 3.3932 3.9474 3.9474 4.6042 4.6042 4.9460 4.9460 7.9011 7.9011 8.2550 8.2550 8.4077 8.4077 9.3856 9.3856 k = 0.0000 0.0000 0.0000 ( 20519 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7138 -9.7138 -7.6767 -7.6767 -7.3880 -7.3880 -6.9186 -6.9186 -4.3040 -4.3040 -3.2918 -3.2918 -0.8758 -0.8758 -0.5785 -0.5785 -0.1315 -0.1315 1.2415 1.2415 1.2804 1.2804 1.7190 1.7190 2.8790 2.8790 3.0929 3.0929 3.3932 3.3932 3.9491 3.9491 4.6056 4.6056 4.9464 4.9464 7.9004 7.9004 8.2529 8.2529 8.4049 8.4049 9.3820 9.3820 k = 0.0000 0.0000 0.0000 ( 20519 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7138 -9.7138 -7.6767 -7.6767 -7.3880 -7.3880 -6.9186 -6.9186 -4.3040 -4.3040 -3.2918 -3.2918 -0.8758 -0.8758 -0.5785 -0.5785 -0.1315 -0.1315 1.2415 1.2415 1.2804 1.2804 1.7190 1.7190 2.8790 2.8790 3.0929 3.0929 3.3932 3.3932 3.9491 3.9491 4.6056 4.6056 4.9464 4.9464 7.9004 7.9004 8.2529 8.2529 8.4049 8.4049 9.3820 9.3820 k =-0.0125-0.0002 0.0121 ( 20513 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7129 -9.7129 -7.6774 -7.6774 -7.3888 -7.3888 -6.9187 -6.9187 -4.3051 -4.3051 -3.2941 -3.2941 -0.8732 -0.8732 -0.5767 -0.5767 -0.1294 -0.1294 1.2277 1.2277 1.2958 1.2958 1.7206 1.7206 2.8797 2.8797 3.0925 3.0925 3.3936 3.3936 3.9480 3.9480 4.6027 4.6027 4.9457 4.9457 7.8999 7.8999 8.2509 8.2509 8.4084 8.4084 9.3847 9.3847 k =-0.0250-0.0004 0.0242 ( 20525 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7101 -9.7101 -7.6795 -7.6795 -7.3911 -7.3911 -6.9187 -6.9187 -4.3084 -4.3084 -3.3009 -3.3009 -0.8653 -0.8653 -0.5713 -0.5713 -0.1230 -0.1230 1.2048 1.2048 1.3234 1.3234 1.7255 1.7255 2.8817 2.8817 3.0914 3.0914 3.3949 3.3949 3.9449 3.9449 4.5940 4.5940 4.9439 4.9439 7.8982 7.8982 8.2454 8.2454 8.4185 8.4185 9.3925 9.3925 k =-0.0375-0.0005 0.0363 ( 20531 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7054 -9.7054 -7.6831 -7.6831 -7.3950 -7.3950 -6.9188 -6.9188 -4.3139 -4.3139 -3.3121 -3.3121 -0.8521 -0.8521 -0.5623 -0.5623 -0.1122 -0.1122 1.1816 1.1816 1.3543 1.3543 1.7336 1.7336 2.8847 2.8847 3.0896 3.0896 3.3973 3.3973 3.9397 3.9397 4.5797 4.5797 4.9411 4.9411 7.8946 7.8946 8.2375 8.2375 8.4340 8.4340 9.4049 9.4049 k =-0.0500-0.0007 0.0485 ( 20530 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6989 -9.6989 -7.6880 -7.6880 -7.4004 -7.4004 -6.9189 -6.9189 -4.3215 -4.3215 -3.3278 -3.3278 -0.8338 -0.8338 -0.5497 -0.5497 -0.0970 -0.0970 1.1592 1.1592 1.3872 1.3872 1.7451 1.7451 2.8885 2.8885 3.0870 3.0870 3.4012 3.4012 3.9324 3.9324 4.5597 4.5597 4.9375 4.9375 7.8877 7.8877 8.2287 8.2287 8.4534 8.4534 9.4207 9.4207 k =-0.0625-0.0009 0.0606 ( 20532 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6905 -9.6905 -7.6943 -7.6943 -7.4071 -7.4071 -6.9193 -6.9193 -4.3310 -4.3310 -3.3477 -3.3477 -0.8104 -0.8104 -0.5338 -0.5338 -0.0772 -0.0772 1.1377 1.1377 1.4218 1.4218 1.7599 1.7599 2.8926 2.8926 3.0837 3.0837 3.4068 3.4068 3.9230 3.9230 4.5344 4.5344 4.9334 4.9334 7.8757 7.8757 8.2201 8.2201 8.4757 8.4757 9.4385 9.4385 k =-0.0750-0.0011 0.0727 ( 20533 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6803 -9.6803 -7.7019 -7.7019 -7.4152 -7.4152 -6.9198 -6.9198 -4.3425 -4.3425 -3.3718 -3.3718 -0.7820 -0.7820 -0.5145 -0.5145 -0.0527 -0.0527 1.1171 1.1171 1.4578 1.4578 1.7781 1.7781 2.8967 2.8967 3.0796 3.0796 3.4146 3.4146 3.9115 3.9115 4.5039 4.5039 4.9292 4.9292 7.8566 7.8566 8.2129 8.2129 8.4994 8.4994 9.4542 9.4542 k =-0.0875-0.0013 0.0848 ( 20533 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6682 -9.6682 -7.7108 -7.7108 -7.4245 -7.4245 -6.9206 -6.9206 -4.3557 -4.3557 -3.3998 -3.3998 -0.7487 -0.7487 -0.4920 -0.4920 -0.0233 -0.0233 1.0974 1.0974 1.4949 1.4949 1.7997 1.7997 2.9000 2.9000 3.0748 3.0748 3.4251 3.4251 3.8979 3.8979 4.4689 4.4689 4.9251 4.9251 7.8283 7.8283 8.2077 8.2077 8.5232 8.5232 9.4415 9.4415 k =-0.1000-0.0015 0.0969 ( 20533 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6544 -9.6544 -7.7209 -7.7209 -7.4349 -7.4349 -6.9217 -6.9217 -4.3705 -4.3705 -3.4316 -3.4316 -0.7107 -0.7107 -0.4665 -0.4665 0.0112 0.0112 1.0785 1.0785 1.5328 1.5328 1.8247 1.8247 2.9022 2.9022 3.0693 3.0693 3.4384 3.4384 3.8825 3.8825 4.4298 4.4298 4.9212 4.9212 7.7893 7.7893 8.2044 8.2044 8.5455 8.5455 9.3917 9.3917 k =-0.1125-0.0016 0.1090 ( 20527 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6388 -9.6388 -7.7321 -7.7321 -7.4463 -7.4463 -6.9233 -6.9233 -4.3868 -4.3868 -3.4669 -3.4669 -0.6682 -0.6682 -0.4380 -0.4380 0.0508 0.0508 1.0603 1.0603 1.5713 1.5713 1.8531 1.8531 2.9028 2.9028 3.0632 3.0632 3.4543 3.4543 3.8657 3.8657 4.3875 4.3875 4.9177 4.9177 7.7390 7.7390 8.2017 8.2017 8.5644 8.5644 9.3336 9.3336 k =-0.1250-0.0018 0.1211 ( 20528 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6215 -9.6215 -7.7444 -7.7444 -7.4586 -7.4586 -6.9254 -6.9254 -4.4043 -4.4043 -3.5053 -3.5053 -0.6216 -0.6216 -0.4065 -0.4065 0.0958 0.0958 1.0428 1.0428 1.6103 1.6103 1.8847 1.8847 2.9015 2.9015 3.0565 3.0565 3.4724 3.4724 3.8483 3.8483 4.3427 4.3427 4.9146 4.9146 7.6774 7.6774 8.1975 8.1975 8.5777 8.5777 9.2742 9.2742 k =-0.1375-0.0020 0.1332 ( 20519 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6025 -9.6025 -7.7577 -7.7577 -7.4716 -7.4716 -6.9281 -6.9281 -4.4230 -4.4230 -3.5466 -3.5466 -0.5714 -0.5714 -0.3720 -0.3720 0.1461 0.1461 1.0262 1.0262 1.6497 1.6497 1.9192 1.9192 2.8982 2.8982 3.0494 3.0494 3.4912 3.4912 3.8315 3.8315 4.2965 4.2965 4.9119 4.9119 7.6054 7.6054 8.1887 8.1887 8.5833 8.5833 9.2177 9.2177 k =-0.1500-0.0022 0.1454 ( 20521 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5817 -9.5817 -7.7720 -7.7720 -7.4852 -7.4852 -6.9315 -6.9315 -4.4427 -4.4427 -3.5904 -3.5904 -0.5184 -0.5184 -0.3340 -0.3340 0.2016 0.2016 1.0103 1.0103 1.6892 1.6892 1.9564 1.9564 2.8930 2.8930 3.0420 3.0420 3.5082 3.5082 3.8173 3.8173 4.2498 4.2498 4.9095 4.9095 7.5239 7.5239 8.1718 8.1718 8.5789 8.5789 9.1680 9.1680 k =-0.1625-0.0024 0.1575 ( 20524 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5594 -9.5594 -7.7871 -7.7871 -7.4993 -7.4993 -6.9358 -6.9358 -4.4632 -4.4632 -3.6363 -3.6363 -0.4636 -0.4636 -0.2918 -0.2918 0.2621 0.2621 0.9956 0.9956 1.7290 1.7290 1.9957 1.9957 2.8858 2.8858 3.0344 3.0344 3.5199 3.5199 3.8089 3.8089 4.2042 4.2042 4.9074 4.9074 7.4342 7.4342 8.1432 8.1432 8.5629 8.5629 9.1283 9.1283 k =-0.1750-0.0025 0.1696 ( 20523 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5355 -9.5355 -7.8030 -7.8030 -7.5138 -7.5138 -6.9409 -6.9409 -4.4843 -4.4843 -3.6839 -3.6839 -0.4086 -0.4086 -0.2441 -0.2441 0.3270 0.3270 0.9823 0.9823 1.7690 1.7690 2.0366 2.0366 2.8771 2.8771 3.0267 3.0267 3.5221 3.5221 3.8089 3.8089 4.1615 4.1615 4.9054 4.9054 7.3375 7.3375 8.1006 8.1006 8.5338 8.5338 9.1005 9.1005 k =-0.1875-0.0027 0.1817 ( 20521 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5100 -9.5100 -7.8196 -7.8196 -7.5285 -7.5285 -6.9470 -6.9470 -4.5059 -4.5059 -3.7329 -3.7329 -0.3550 -0.3550 -0.1896 -0.1896 0.3957 0.3957 0.9710 0.9710 1.8093 1.8093 2.0785 2.0785 2.8671 2.8671 3.0193 3.0193 3.5122 3.5122 3.8178 3.8178 4.1245 4.1245 4.9034 4.9034 7.2351 7.2351 8.0431 8.0431 8.4905 8.4905 9.0843 9.0843 k =-0.2000-0.0029 0.1938 ( 20527 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4831 -9.4831 -7.8369 -7.8369 -7.5433 -7.5433 -6.9542 -6.9542 -4.5278 -4.5278 -3.7827 -3.7827 -0.3041 -0.3041 -0.1273 -0.1273 0.4669 0.4669 0.9627 0.9627 1.8499 1.8499 2.1206 2.1206 2.8561 2.8561 3.0121 3.0121 3.4908 3.4908 3.8309 3.8309 4.0978 4.0978 4.9011 4.9011 7.1282 7.1282 7.9717 7.9717 8.4322 8.4322 9.0750 9.0750 k =-0.2125-0.0031 0.2059 ( 20538 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4547 -9.4547 -7.8546 -7.8546 -7.5581 -7.5581 -6.9625 -6.9625 -4.5498 -4.5498 -3.8330 -3.8330 -0.2561 -0.2561 -0.0571 -0.0571 0.5383 0.5383 0.9595 0.9595 1.8908 1.8908 2.1622 2.1622 2.8446 2.8446 3.0053 3.0053 3.4604 3.4604 3.8398 3.8398 4.0881 4.0881 4.8983 4.8983 7.0178 7.0178 7.8884 7.8884 8.3587 8.3587 9.0504 9.0504 k =-0.2250-0.0033 0.2180 ( 20545 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4251 -9.4251 -7.8729 -7.8729 -7.5728 -7.5728 -6.9721 -6.9721 -4.5719 -4.5719 -3.8835 -3.8835 -0.2107 -0.2107 0.0201 0.0201 0.6063 0.6063 0.9647 0.9647 1.9319 1.9319 2.2024 2.2024 2.8330 2.8330 2.9991 2.9991 3.4235 3.4235 3.8374 3.8374 4.1006 4.1006 4.8947 4.8947 6.9049 6.9049 7.7958 7.7958 8.2711 8.2711 8.9675 8.9675 k =-0.2375-0.0034 0.2301 ( 20548 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3941 -9.3941 -7.8915 -7.8915 -7.5872 -7.5872 -6.9829 -6.9829 -4.5939 -4.5939 -3.9337 -3.9337 -0.1671 -0.1671 0.1033 0.1033 0.6647 0.6647 0.9841 0.9841 1.9730 1.9730 2.2406 2.2406 2.8216 2.8216 2.9937 2.9937 3.3823 3.3823 3.8240 3.8240 4.1336 4.1336 4.8900 4.8900 6.7905 6.7905 7.6962 7.6962 8.1709 8.1709 8.8450 8.8450 k =-0.2500-0.0036 0.2423 ( 20549 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.3621 -9.3621 -7.9105 -7.9105 -7.6013 -7.6013 -6.9950 -6.9950 -4.6156 -4.6156 -3.9834 -3.9834 -0.1246 -0.1246 0.1917 0.1917 0.7069 0.7069 1.0241 1.0241 2.0139 2.0139 2.2758 2.2758 2.8109 2.8109 2.9891 2.9891 3.3384 3.3384 3.8051 3.8051 4.1807 4.1807 4.8838 4.8838 6.6754 6.6754 7.5917 7.5917 8.0602 8.0602 8.7075 8.7075 k =-0.2625-0.0038 0.2544 ( 20547 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.3289 -9.3289 -7.9297 -7.9297 -7.6150 -7.6150 -7.0084 -7.0084 -4.6369 -4.6369 -4.0321 -4.0321 -0.0828 -0.0828 0.2842 0.2842 0.7306 0.7306 1.0864 1.0864 2.0542 2.0542 2.3072 2.3072 2.8012 2.8012 2.9854 2.9854 3.2931 3.2931 3.7859 3.7859 4.2363 4.2363 4.8758 4.8758 6.5605 6.5605 7.4839 7.4839 7.9413 7.9413 8.5623 8.5623 k =-0.2750-0.0040 0.2665 ( 20545 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.2948 -9.2948 -7.9491 -7.9491 -7.6281 -7.6281 -7.0232 -7.0232 -4.6578 -4.6578 -4.0795 -4.0795 -0.0414 -0.0414 0.3803 0.3803 0.7401 0.7401 1.1665 1.1665 2.0935 2.0935 2.3343 2.3343 2.7926 2.7926 2.9825 2.9825 3.2477 3.2477 3.7697 3.7697 4.2968 4.2968 4.8655 4.8655 6.4465 6.4465 7.3741 7.3741 7.8162 7.8162 8.4127 8.4127 k =-0.2875-0.0042 0.2786 ( 20550 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.2599 -9.2599 -7.9686 -7.9686 -7.6406 -7.6406 -7.0392 -7.0392 -4.6780 -4.6780 -4.1255 -4.1255 -0.0002 -0.0002 0.4793 0.4793 0.7410 0.7410 1.2583 1.2583 2.1312 2.1312 2.3567 2.3567 2.7856 2.7856 2.9803 2.9803 3.2034 3.2034 3.7586 3.7586 4.3597 4.3597 4.8527 4.8527 6.3341 6.3341 7.2632 7.2632 7.6873 7.6873 8.2605 8.2605 k =-0.3000-0.0044 0.2907 ( 20559 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.2243 -9.2243 -7.9882 -7.9882 -7.6525 -7.6525 -7.0565 -7.0565 -4.6975 -4.6975 -4.1696 -4.1696 0.0408 0.0408 0.5805 0.5805 0.7372 0.7372 1.3573 1.3573 2.1665 2.1665 2.3740 2.3740 2.7800 2.7800 2.9781 2.9781 3.1622 3.1622 3.7540 3.7540 4.4230 4.4230 4.8368 4.8368 6.2241 6.2241 7.1520 7.1520 7.5565 7.5565 8.1074 8.1074 k =-0.3125-0.0045 0.3028 ( 20562 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.1881 -9.1881 -8.0078 -8.0078 -7.6636 -7.6636 -7.0749 -7.0749 -4.7162 -4.7162 -4.2119 -4.2119 0.0815 0.0815 0.6820 0.6820 0.7325 0.7325 1.4607 1.4607 2.1988 2.1988 2.3864 2.3864 2.7759 2.7759 2.9746 2.9746 3.1264 3.1264 3.7567 3.7567 4.4849 4.4849 4.8179 4.8179 6.1173 6.1173 7.0411 7.0411 7.4258 7.4258 7.9546 7.9546 k =-0.3250-0.0047 0.3149 ( 20560 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.1516 -9.1516 -8.0273 -8.0273 -7.6738 -7.6738 -7.0943 -7.0943 -4.7339 -4.7339 -4.2519 -4.2519 0.1218 0.1218 0.7198 0.7198 0.7914 0.7914 1.5663 1.5663 2.2270 2.2270 2.3943 2.3943 2.7731 2.7731 2.9675 2.9675 3.0998 3.0998 3.7670 3.7670 4.5432 4.5432 4.7961 4.7961 6.0146 6.0146 6.9308 6.9308 7.2972 7.2972 7.8036 7.8036 k =-0.3375-0.0049 0.3270 ( 20551 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.1150 -9.1150 -8.0468 -8.0468 -7.6831 -7.6831 -7.1146 -7.1146 -4.7507 -4.7507 -4.2896 -4.2896 0.1617 0.1617 0.7123 0.7123 0.8958 0.8958 1.6721 1.6721 2.2507 2.2507 2.3981 2.3981 2.7712 2.7712 2.9549 2.9549 3.0862 3.0862 3.7848 3.7848 4.5943 4.5943 4.7729 4.7729 5.9167 5.9167 6.8217 6.8217 7.1726 7.1726 7.6555 7.6555 k =-0.3500-0.0051 0.3392 ( 20552 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.0784 -9.0784 -8.0661 -8.0661 -7.6916 -7.6916 -7.1356 -7.1356 -4.7663 -4.7663 -4.3249 -4.3249 0.2008 0.2008 0.7037 0.7037 1.0012 1.0012 1.7764 1.7764 2.2691 2.2691 2.3987 2.3987 2.7699 2.7699 2.9380 2.9380 3.0864 3.0864 3.8095 3.8095 4.6306 4.6306 4.7539 4.7539 5.8248 5.8248 6.7141 6.7141 7.0536 7.0536 7.5117 7.5117 k =-0.3625-0.0053 0.3513 ( 20555 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.0422 -9.0422 -8.0852 -8.0852 -7.6990 -7.6990 -7.1569 -7.1569 -4.7809 -4.7809 -4.3576 -4.3576 0.2390 0.2390 0.6951 0.6951 1.1062 1.1062 1.8767 1.8767 2.2820 2.2820 2.3964 2.3964 2.7693 2.7693 2.9209 2.9209 3.0981 3.0981 3.8401 3.8401 4.6366 4.6366 4.7525 4.7525 5.7399 5.7399 6.6088 6.6088 6.9414 6.9414 7.3737 7.3737 k =-0.3750-0.0054 0.3634 ( 20560 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.0066 -9.0066 -8.1039 -8.1039 -7.7055 -7.7055 -7.1784 -7.1784 -4.7942 -4.7942 -4.3877 -4.3877 0.2759 0.2759 0.6868 0.6868 1.2099 1.2099 1.9702 1.9702 2.2896 2.2896 2.3921 2.3921 2.7699 2.7699 2.9079 2.9079 3.1188 3.1188 3.8755 3.8755 4.6106 4.6106 4.7685 4.7685 5.6630 5.6630 6.5073 6.5073 6.8366 6.8366 7.2430 7.2430 k =-0.3875-0.0056 0.3755 ( 20558 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.9719 -8.9719 -8.1223 -8.1223 -7.7110 -7.7110 -7.1997 -7.1997 -4.8063 -4.8063 -4.4151 -4.4151 0.3113 0.3113 0.6790 0.6790 1.3115 1.3115 2.0535 2.0535 2.2921 2.2921 2.3861 2.3861 2.7725 2.7725 2.9026 2.9026 3.1467 3.1467 3.9139 3.9139 4.5686 4.5686 4.7845 4.7845 5.5947 5.5947 6.4115 6.4115 6.7394 6.7394 7.1216 7.1216 k =-0.4000-0.0058 0.3876 ( 20560 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.9386 -8.9386 -8.1401 -8.1401 -7.7156 -7.7156 -7.2204 -7.2204 -4.8171 -4.8171 -4.4397 -4.4397 0.3447 0.3447 0.6717 0.6717 1.4101 1.4101 2.1232 2.1232 2.2900 2.2900 2.3792 2.3792 2.7768 2.7768 2.9086 2.9086 3.1805 3.1805 3.9536 3.9536 4.5188 4.5188 4.7920 4.7920 5.5352 5.5352 6.3237 6.3237 6.6492 6.6492 7.0113 7.0113 k =-0.4125-0.0060 0.3997 ( 20553 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.9071 -8.9071 -8.1571 -8.1571 -7.7192 -7.7192 -7.2401 -7.2401 -4.8266 -4.8266 -4.4615 -4.4615 0.3758 0.3758 0.6650 0.6650 1.5045 1.5045 2.1767 2.1767 2.2839 2.2839 2.3721 2.3721 2.7802 2.7802 2.9303 2.9303 3.2189 3.2189 3.9920 3.9920 4.4650 4.4650 4.7891 4.7891 5.4836 5.4836 6.2464 6.2464 6.5654 6.5654 6.9137 6.9137 k =-0.4250-0.0062 0.4118 ( 20544 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.8779 -8.8779 -8.1731 -8.1731 -7.7221 -7.7221 -7.2584 -7.2584 -4.8348 -4.8348 -4.4804 -4.4804 0.4041 0.4041 0.6590 0.6590 1.5935 1.5935 2.2135 2.2135 2.2747 2.2747 2.3653 2.3653 2.7807 2.7807 2.9688 2.9688 3.2610 3.2610 4.0255 4.0255 4.4106 4.4106 4.7768 4.7768 5.4382 5.4382 6.1819 6.1819 6.4877 6.4877 6.8304 6.8304 k =-0.4375-0.0064 0.4239 ( 20546 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.8515 -8.8515 -8.1877 -8.1877 -7.7241 -7.7241 -7.2749 -7.2749 -4.8418 -4.8418 -4.4965 -4.4965 0.4291 0.4291 0.6538 0.6538 1.6757 1.6757 2.2335 2.2335 2.2653 2.2653 2.3595 2.3595 2.7782 2.7782 3.0196 3.0196 3.3063 3.3063 4.0486 4.0486 4.3609 4.3609 4.7580 4.7580 5.3973 5.3973 6.1313 6.1313 6.4166 6.4166 6.7618 6.7618 k =-0.4500-0.0065 0.4361 ( 20545 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.8286 -8.8286 -8.2007 -8.2007 -7.7256 -7.7256 -7.2892 -7.2892 -4.8474 -4.8474 -4.5097 -4.5097 0.4504 0.4504 0.6494 0.6494 1.7494 1.7494 2.2331 2.2331 2.2638 2.2638 2.3547 2.3547 2.7740 2.7740 3.0748 3.0748 3.3543 3.3543 4.0534 4.0534 4.3240 4.3240 4.7364 4.7364 5.3603 5.3603 6.0943 6.0943 6.3536 6.3536 6.7076 6.7076 k =-0.4625-0.0067 0.4482 ( 20533 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.8099 -8.8099 -8.2114 -8.2114 -7.7265 -7.7265 -7.3008 -7.3008 -4.8518 -4.8518 -4.5199 -4.5199 0.4676 0.4676 0.6459 0.6459 1.8127 1.8127 2.2200 2.2200 2.2677 2.2677 2.3508 2.3508 2.7693 2.7693 3.1259 3.1259 3.4043 3.4043 4.0349 4.0349 4.3060 4.3060 4.7155 4.7155 5.3280 5.3280 6.0694 6.0694 6.3009 6.3009 6.6671 6.6671 k =-0.4750-0.0069 0.4603 ( 20537 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.7959 -8.7959 -8.2196 -8.2196 -7.7271 -7.7271 -7.3094 -7.3094 -4.8549 -4.8549 -4.5273 -4.5273 0.4802 0.4802 0.6433 0.6433 1.8626 1.8626 2.2052 2.2052 2.2705 2.2705 2.3479 2.3479 2.7651 2.7651 3.1661 3.1661 3.4527 3.4527 4.0005 4.0005 4.3032 4.3032 4.6983 4.6983 5.3024 5.3024 6.0542 6.0542 6.2608 6.2608 6.6390 6.6390 k =-0.4875-0.0071 0.4724 ( 20542 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.7873 -8.7873 -8.2247 -8.2247 -7.7274 -7.7274 -7.3146 -7.3146 -4.8568 -4.8568 -4.5317 -4.5317 0.4879 0.4879 0.6417 0.6417 1.8955 1.8955 2.1936 2.1936 2.2719 2.2719 2.3460 2.3460 2.7623 2.7623 3.1912 3.1912 3.4909 3.4909 3.9673 3.9673 4.3061 4.3061 4.6872 4.6872 5.2858 5.2858 6.0464 6.0464 6.2357 6.2357 6.6225 6.6225 k =-0.5000-0.0073 0.4845 ( 20552 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.7844 -8.7844 -8.2264 -8.2264 -7.7275 -7.7275 -7.3164 -7.3164 -4.8574 -4.8574 -4.5332 -4.5332 0.4905 0.4905 0.6412 0.6412 1.9071 1.9071 2.1891 2.1891 2.2723 2.2723 2.3453 2.3453 2.7613 2.7613 3.1997 3.1997 3.5061 3.5061 3.9534 3.9534 4.3078 4.3078 4.6833 4.6833 5.2801 5.2801 6.0440 6.0440 6.2271 6.2271 6.6171 6.6171 k =-0.5000-0.5050 0.4607 ( 20568 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.6750 -8.6750 -8.1096 -8.1096 -7.5104 -7.5104 -7.2637 -7.2637 -5.6437 -5.6437 -5.2737 -5.2737 1.0735 1.0735 1.0979 1.0979 2.1274 2.1274 2.4919 2.4919 2.7637 2.7637 3.1900 3.1900 3.6757 3.6757 3.9288 3.9288 4.4175 4.4175 4.4265 4.4265 4.7740 4.7740 4.8017 4.8017 4.9553 4.9553 5.6217 5.6217 5.7252 5.7252 6.0382 6.0382 k =-0.4896-0.4944 0.4511 ( 20575 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.6769 -8.6769 -8.1087 -8.1087 -7.5107 -7.5107 -7.2631 -7.2631 -5.6424 -5.6424 -5.2714 -5.2714 1.0700 1.0700 1.1027 1.1027 2.1226 2.1226 2.4893 2.4893 2.7529 2.7529 3.1855 3.1855 3.6716 3.6716 3.9358 3.9358 4.4133 4.4133 4.4267 4.4267 4.7552 4.7552 4.8168 4.8168 4.9510 4.9510 5.6296 5.6296 5.7265 5.7265 6.0518 6.0518 k =-0.4792-0.4839 0.4415 ( 20574 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.6828 -8.6828 -8.1060 -8.1060 -7.5114 -7.5114 -7.2616 -7.2616 -5.6385 -5.6385 -5.2647 -5.2647 1.0633 1.0633 1.1136 1.1136 2.1081 2.1081 2.4814 2.4814 2.7221 2.7221 3.1718 3.1718 3.6593 3.6593 3.9560 3.9560 4.4029 4.4029 4.4249 4.4249 4.7231 4.7231 4.8356 4.8356 4.9415 4.9415 5.6526 5.6526 5.7323 5.7323 6.0902 6.0902 k =-0.4688-0.4734 0.4319 ( 20576 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.6924 -8.6924 -8.1016 -8.1016 -7.5125 -7.5125 -7.2590 -7.2590 -5.6319 -5.6319 -5.2534 -5.2534 1.0562 1.0562 1.1272 1.1272 2.0845 2.0845 2.4682 2.4682 2.6748 2.6748 3.1481 3.1481 3.6385 3.6385 3.9876 3.9876 4.3880 4.3880 4.4201 4.4201 4.6849 4.6849 4.8424 4.8424 4.9379 4.9379 5.6878 5.6878 5.7469 5.7469 6.1486 6.1486 k =-0.4583-0.4629 0.4223 ( 20583 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.7055 -8.7055 -8.0956 -8.0956 -7.5140 -7.5140 -7.2554 -7.2554 -5.6228 -5.6228 -5.2378 -5.2378 1.0492 1.0492 1.1429 1.1429 2.0523 2.0523 2.4495 2.4495 2.6152 2.6152 3.1145 3.1145 3.6094 3.6094 4.0275 4.0275 4.3688 4.3688 4.4125 4.4125 4.6409 4.6409 4.8290 4.8290 4.9522 4.9522 5.7304 5.7304 5.7759 5.7759 6.2220 6.2220 k =-0.4479-0.4524 0.4127 ( 20585 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.7219 -8.7219 -8.0882 -8.0882 -7.5158 -7.5158 -7.2510 -7.2510 -5.6111 -5.6111 -5.2179 -5.2179 1.0422 1.0422 1.1601 1.1601 2.0124 2.0124 2.4250 2.4250 2.5475 2.5475 3.0722 3.0722 3.5721 3.5721 4.0713 4.0713 4.3457 4.3457 4.4025 4.4025 4.5920 4.5920 4.8019 4.8019 4.9811 4.9811 5.7753 5.7753 5.8238 5.8238 6.3068 6.3068 k =-0.4375-0.4418 0.4031 ( 20584 PWs) bands (ev): -40.3133 -40.3133 -40.3129 -40.3129 -8.7412 -8.7412 -8.0797 -8.0797 -7.5179 -7.5179 -7.2457 -7.2457 -5.5970 -5.5970 -5.1938 -5.1938 1.0346 1.0346 1.1787 1.1787 1.9658 1.9658 2.3937 2.3937 2.4758 2.4758 3.0228 3.0228 3.5273 3.5273 4.1139 4.1139 4.3188 4.3188 4.3909 4.3909 4.5412 4.5412 4.7694 4.7694 5.0186 5.0186 5.8238 5.8238 5.8877 5.8877 6.4001 6.4001 k =-0.4271-0.4313 0.3935 ( 20579 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.7632 -8.7632 -8.0702 -8.0702 -7.5202 -7.5202 -7.2396 -7.2396 -5.5804 -5.5804 -5.1657 -5.1657 1.0258 1.0258 1.1984 1.1984 1.9137 1.9137 2.3516 2.3516 2.4066 2.4066 2.9680 2.9680 3.4761 3.4761 4.1489 4.1489 4.2879 4.2879 4.3767 4.3767 4.4947 4.4947 4.7351 4.7351 5.0625 5.0625 5.8793 5.8793 5.9626 5.9626 6.5002 6.5002 k =-0.4167-0.4208 0.3839 ( 20571 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.7874 -8.7874 -8.0598 -8.0598 -7.5225 -7.5225 -7.2328 -7.2328 -5.5614 -5.5614 -5.1338 -5.1338 1.0148 1.0148 1.2185 1.2185 1.8576 1.8576 2.2911 2.2911 2.3499 2.3499 2.9093 2.9093 3.4196 3.4196 4.1692 4.1692 4.2524 4.2524 4.3545 4.3545 4.4653 4.4653 4.7009 4.7009 5.1127 5.1127 5.9426 5.9426 6.0457 6.0457 6.6055 6.6055 k =-0.4062-0.4103 0.3743 ( 20563 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.8137 -8.8137 -8.0487 -8.0487 -7.5249 -7.5249 -7.2254 -7.2254 -5.5401 -5.5401 -5.0983 -5.0983 1.0007 1.0007 1.2386 1.2386 1.7988 1.7988 2.2174 2.2174 2.3025 2.3025 2.8482 2.8482 3.3591 3.3591 4.1697 4.1697 4.2113 4.2113 4.3209 4.3209 4.4615 4.4615 4.6679 4.6679 5.1692 5.1692 6.0129 6.0129 6.1359 6.1359 6.7148 6.7148 k =-0.3958-0.3998 0.3647 ( 20563 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.8418 -8.8418 -8.0371 -8.0371 -7.5272 -7.5272 -7.2174 -7.2174 -5.5166 -5.5166 -5.0593 -5.0593 0.9821 0.9821 1.2575 1.2575 1.7391 1.7391 2.1409 2.1409 2.2561 2.2561 2.7856 2.7856 3.2957 3.2957 4.1451 4.1451 4.1698 4.1698 4.2842 4.2842 4.4736 4.4736 4.6384 4.6384 5.2323 5.2323 6.0892 6.0892 6.2323 6.2323 6.8269 6.8269 k =-0.3854-0.3892 0.3551 ( 20560 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.8713 -8.8713 -8.0250 -8.0250 -7.5294 -7.5294 -7.2090 -7.2090 -5.4909 -5.4909 -5.0171 -5.0171 0.9579 0.9579 1.2737 1.2737 1.6802 1.6802 2.0661 2.0661 2.2089 2.2089 2.7224 2.7224 3.2306 3.2306 4.0926 4.0926 4.1374 4.1374 4.2498 4.2498 4.4869 4.4869 4.6164 4.6164 5.3023 5.3023 6.1705 6.1705 6.3342 6.3342 6.9403 6.9403 k =-0.3750-0.3787 0.3455 ( 20563 PWs) bands (ev): -40.3133 -40.3133 -40.3128 -40.3128 -8.9020 -8.9020 -8.0126 -8.0126 -7.5313 -7.5313 -7.2001 -7.2001 -5.4632 -5.4632 -4.9719 -4.9719 0.9268 0.9268 1.2848 1.2848 1.6238 1.6238 1.9955 1.9955 2.1612 2.1612 2.6592 2.6592 3.1649 3.1649 4.0302 4.0302 4.1033 4.1033 4.2173 4.2173 4.4888 4.4888 4.6084 4.6084 5.3788 5.3788 6.2559 6.2559 6.4409 6.4409 7.0520 7.0520 k =-0.3646-0.3682 0.3359 ( 20559 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -8.9338 -8.9338 -7.9998 -7.9998 -7.5330 -7.5330 -7.1908 -7.1908 -5.4336 -5.4336 -4.9240 -4.9240 0.8879 0.8879 1.2870 1.2870 1.5724 1.5724 1.9313 1.9313 2.1140 2.1140 2.5965 2.5965 3.0993 3.0993 3.9651 3.9651 4.0659 4.0659 4.1853 4.1853 4.4759 4.4759 4.6156 4.6156 5.4614 5.4614 6.3445 6.3445 6.5515 6.5515 7.1591 7.1591 k =-0.3542-0.3577 0.3263 ( 20567 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -8.9663 -8.9663 -7.9868 -7.9868 -7.5343 -7.5343 -7.1812 -7.1812 -5.4021 -5.4021 -4.8734 -4.8734 0.8409 0.8409 1.2751 1.2751 1.5286 1.5286 1.8758 1.8758 2.0688 2.0688 2.5348 2.5348 3.0347 3.0347 3.8999 3.8999 4.0260 4.0260 4.1529 4.1529 4.4545 4.4545 4.6308 4.6308 5.5494 5.5494 6.4357 6.4357 6.6655 6.6655 7.2617 7.2617 k =-0.3438-0.3472 0.3167 ( 20562 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -8.9994 -8.9994 -7.9737 -7.9737 -7.5352 -7.5352 -7.1713 -7.1713 -5.3689 -5.3689 -4.8206 -4.8206 0.7862 0.7862 1.2449 1.2449 1.4933 1.4933 1.8306 1.8306 2.0273 2.0273 2.4744 2.4744 2.9719 2.9719 3.8360 3.8360 3.9843 3.9843 4.1196 4.1196 4.4305 4.4305 4.6481 4.6481 5.6421 5.6421 6.5290 6.5290 6.7821 6.7821 7.3619 7.3619 k =-0.3333-0.3366 0.3071 ( 20558 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.0329 -9.0329 -7.9603 -7.9603 -7.5357 -7.5357 -7.1612 -7.1612 -5.3342 -5.3342 -4.7657 -4.7657 0.7244 0.7244 1.1963 1.1963 1.4630 1.4630 1.7971 1.7971 1.9911 1.9911 2.4158 2.4158 2.9115 2.9115 3.7746 3.7746 3.9411 3.9411 4.0855 4.0855 4.4067 4.4067 4.6650 4.6650 5.7387 5.7387 6.6240 6.6240 6.9007 6.9007 7.4613 7.4613 k =-0.3229-0.3261 0.2975 ( 20560 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.0667 -9.0667 -7.9469 -7.9469 -7.5357 -7.5357 -7.1509 -7.1509 -5.2979 -5.2979 -4.7089 -4.7089 0.6569 0.6569 1.1337 1.1337 1.4310 1.4310 1.7757 1.7757 1.9609 1.9609 2.3596 2.3596 2.8540 2.8540 3.7165 3.7165 3.8969 3.8969 4.0505 4.0505 4.3844 4.3844 4.6808 4.6808 5.8386 5.8386 6.7202 6.7202 7.0204 7.0204 7.5603 7.5603 k =-0.3125-0.3156 0.2879 ( 20570 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.1005 -9.1005 -7.9334 -7.9334 -7.5352 -7.5352 -7.1404 -7.1404 -5.2603 -5.2603 -4.6504 -4.6504 0.5849 0.5849 1.0615 1.0615 1.3920 1.3920 1.7654 1.7654 1.9368 1.9368 2.3064 2.3064 2.8000 2.8000 3.6625 3.6625 3.8519 3.8519 4.0149 4.0149 4.3640 4.3640 4.6953 4.6953 5.9410 5.9410 6.8173 6.8173 7.1408 7.1408 7.6589 7.6589 k =-0.3021-0.3051 0.2783 ( 20558 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.1343 -9.1343 -7.9199 -7.9199 -7.5341 -7.5341 -7.1298 -7.1298 -5.2215 -5.2215 -4.5906 -4.5906 0.5096 0.5096 0.9832 0.9832 1.3446 1.3446 1.7633 1.7633 1.9174 1.9174 2.2573 2.2573 2.7499 2.7499 3.6136 3.6136 3.8064 3.8064 3.9788 3.9788 4.3456 4.3456 4.7086 4.7086 6.0454 6.0454 6.9150 6.9150 7.2611 7.2611 7.7570 7.7570 k =-0.2917-0.2946 0.2687 ( 20562 PWs) bands (ev): -40.3134 -40.3134 -40.3128 -40.3128 -9.1679 -9.1679 -7.9064 -7.9064 -7.5325 -7.5325 -7.1192 -7.1192 -5.1817 -5.1817 -4.5295 -4.5295 0.4323 0.4323 0.9011 0.9011 1.2893 1.2893 1.7657 1.7657 1.9011 1.9011 2.2133 2.2133 2.7042 2.7042 3.5704 3.5704 3.7608 3.7608 3.9425 3.9425 4.3294 4.3294 4.7208 4.7208 6.1514 6.1514 7.0128 7.0128 7.3808 7.3808 7.8544 7.8544 k =-0.2812-0.2840 0.2591 ( 20554 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.2012 -9.2012 -7.8930 -7.8930 -7.5302 -7.5302 -7.1084 -7.1084 -5.1409 -5.1409 -4.4676 -4.4676 0.3537 0.3537 0.8169 0.8169 1.2278 1.2278 1.7688 1.7688 1.8861 1.8861 2.1756 2.1756 2.6632 2.6632 3.5336 3.5336 3.7153 3.7153 3.9063 3.9063 4.3153 4.3153 4.7321 4.7321 6.2584 6.2584 7.1105 7.1105 7.4993 7.4993 7.9508 7.9508 k =-0.2708-0.2735 0.2495 ( 20560 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.2341 -9.2341 -7.8797 -7.8797 -7.5274 -7.5274 -7.0977 -7.0977 -5.0993 -5.0993 -4.4048 -4.4048 0.2749 0.2749 0.7316 0.7316 1.1618 1.1618 1.7683 1.7683 1.8717 1.8717 2.1454 2.1454 2.6272 2.6272 3.5040 3.5040 3.6703 3.6703 3.8705 3.8705 4.3032 4.3032 4.7426 4.7426 6.3660 6.3660 7.2076 7.2076 7.6161 7.6161 8.0457 8.0457 k =-0.2604-0.2630 0.2399 ( 20567 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.2665 -9.2665 -7.8665 -7.8665 -7.5240 -7.5240 -7.0870 -7.0870 -5.0570 -5.0570 -4.3417 -4.3417 0.1964 0.1964 0.6462 0.6462 1.0927 1.0927 1.7601 1.7601 1.8581 1.8581 2.1232 2.1232 2.5964 2.5964 3.4820 3.4820 3.6262 3.6262 3.8353 3.8353 4.2931 4.2931 4.7526 4.7526 6.4738 6.4738 7.3036 7.3036 7.7305 7.7305 8.1386 8.1386 k =-0.2500-0.2525 0.2303 ( 20564 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.2982 -9.2982 -7.8534 -7.8534 -7.5200 -7.5200 -7.0763 -7.0763 -5.0143 -5.0143 -4.2782 -4.2782 0.1187 0.1187 0.5613 0.5613 1.0217 1.0217 1.7422 1.7422 1.8455 1.8455 2.1083 2.1083 2.5711 2.5711 3.4673 3.4673 3.5837 3.5837 3.8010 3.8010 4.2849 4.2849 4.7620 4.7620 6.5815 6.5815 7.3981 7.3981 7.8422 7.8422 8.2289 8.2289 k =-0.2396-0.2420 0.2207 ( 20559 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3292 -9.3292 -7.8407 -7.8407 -7.5155 -7.5155 -7.0657 -7.0657 -4.9713 -4.9713 -4.2147 -4.2147 0.0425 0.0425 0.4774 0.4774 0.9495 0.9495 1.7157 1.7157 1.8322 1.8322 2.0993 2.0993 2.5516 2.5516 3.4586 3.4586 3.5445 3.5445 3.7680 3.7680 4.2785 4.2785 4.7711 4.7711 6.6887 6.6887 7.4905 7.4905 7.9503 7.9503 8.3160 8.3160 k =-0.2292-0.2314 0.2111 ( 20555 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3594 -9.3594 -7.8281 -7.8281 -7.5104 -7.5104 -7.0553 -7.0553 -4.9281 -4.9281 -4.1514 -4.1514 -0.0320 -0.0320 0.3950 0.3950 0.8769 0.8769 1.6835 1.6835 1.8163 1.8163 2.0936 2.0936 2.5385 2.5385 3.4501 3.4501 3.5140 3.5140 3.7368 3.7368 4.2741 4.2741 4.7799 4.7799 6.7949 6.7949 7.5801 7.5801 8.0545 8.0545 8.3990 8.3990 k =-0.2188-0.2209 0.2015 ( 20556 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3887 -9.3887 -7.8159 -7.8159 -7.5048 -7.5048 -7.0449 -7.0449 -4.8850 -4.8850 -4.0886 -4.0886 -0.1044 -0.1044 0.3144 0.3144 0.8045 0.8045 1.6482 1.6482 1.7968 1.7968 2.0884 2.0884 2.5324 2.5324 3.4296 3.4296 3.5034 3.5034 3.7081 3.7081 4.2716 4.2716 4.7884 4.7884 6.8997 6.8997 7.6663 7.6663 8.1538 8.1538 8.4773 8.4773 k =-0.2083-0.2104 0.1919 ( 20557 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4171 -9.4171 -7.8040 -7.8040 -7.4987 -7.4987 -7.0348 -7.0348 -4.8420 -4.8420 -4.0265 -4.0265 -0.1744 -0.1744 0.2359 0.2359 0.7327 0.7327 1.6114 1.6114 1.7739 1.7739 2.0812 2.0812 2.5338 2.5338 3.3975 3.3975 3.5105 3.5105 3.6832 3.6832 4.2711 4.2711 4.7968 4.7968 7.0026 7.0026 7.7481 7.7481 8.2474 8.2474 8.5504 8.5504 k =-0.1979-0.1999 0.1823 ( 20557 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4445 -9.4445 -7.7925 -7.7925 -7.4922 -7.4922 -7.0249 -7.0249 -4.7994 -4.7994 -3.9653 -3.9653 -0.2417 -0.2417 0.1599 0.1599 0.6620 0.6620 1.5743 1.5743 1.7481 1.7481 2.0702 2.0702 2.5428 2.5428 3.3622 3.3622 3.5230 3.5230 3.6651 3.6651 4.2728 4.2728 4.8051 4.8051 7.1031 7.1031 7.8248 7.8248 8.3338 8.3338 8.6184 8.6184 k =-0.1875-0.1894 0.1727 ( 20555 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4708 -9.4708 -7.7814 -7.7814 -7.4853 -7.4853 -7.0152 -7.0152 -4.7573 -4.7573 -3.9053 -3.9053 -0.3061 -0.3061 0.0866 0.0866 0.5926 0.5926 1.5378 1.5378 1.7200 1.7200 2.0548 2.0548 2.5589 2.5589 3.3271 3.3271 3.5314 3.5314 3.6588 3.6588 4.2769 4.2769 4.8132 4.8132 7.2007 7.2007 7.8955 7.8955 8.4108 8.4108 8.6824 8.6824 k =-0.1771-0.1788 0.1631 ( 20560 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4959 -9.4959 -7.7708 -7.7708 -7.4781 -7.4781 -7.0058 -7.0058 -4.7159 -4.7159 -3.8468 -3.8468 -0.3674 -0.3674 0.0163 0.0163 0.5250 0.5250 1.5023 1.5023 1.6904 1.6904 2.0353 2.0353 2.5810 2.5810 3.2930 3.2930 3.5292 3.5292 3.6688 3.6688 4.2835 4.2835 4.8213 4.8213 7.2947 7.2947 7.9592 7.9592 8.4758 8.4758 8.7447 8.7447 k =-0.1667-0.1683 0.1536 ( 20565 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5199 -9.5199 -7.7606 -7.7606 -7.4707 -7.4707 -6.9967 -6.9967 -4.6755 -4.6755 -3.7899 -3.7899 -0.4256 -0.4256 -0.0508 -0.0508 0.4594 0.4594 1.4683 1.4683 1.6596 1.6596 2.0123 2.0123 2.6078 2.6078 3.2607 3.2607 3.5176 3.5176 3.6921 3.6921 4.2930 4.2930 4.8294 4.8294 7.3845 7.3845 8.0154 8.0154 8.5258 8.5258 8.8081 8.8081 k =-0.1562-0.1578 0.1440 ( 20563 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5427 -9.5427 -7.7509 -7.7509 -7.4632 -7.4632 -6.9880 -6.9880 -4.6361 -4.6361 -3.7350 -3.7350 -0.4804 -0.4804 -0.1146 -0.1146 0.3960 0.3960 1.4361 1.4361 1.6283 1.6283 1.9868 1.9868 2.6379 2.6379 3.2302 3.2302 3.5016 3.5016 3.7223 3.7223 4.3056 4.3056 4.8375 4.8375 7.4692 7.4692 8.0636 8.0636 8.5595 8.5595 8.8747 8.8747 k =-0.1458-0.1473 0.1344 ( 20555 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5641 -9.5641 -7.7417 -7.7417 -7.4556 -7.4556 -6.9797 -6.9797 -4.5981 -4.5981 -3.6823 -3.6823 -0.5317 -0.5317 -0.1747 -0.1747 0.3351 0.3351 1.4058 1.4058 1.5967 1.5967 1.9599 1.9599 2.6699 2.6699 3.2020 3.2020 3.4843 3.4843 3.7547 3.7547 4.3215 4.3215 4.8457 4.8457 7.5481 7.5481 8.1036 8.1036 8.5778 8.5778 8.9449 8.9449 k =-0.1354-0.1368 0.1248 ( 20549 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.5843 -9.5843 -7.7331 -7.7331 -7.4480 -7.4480 -6.9718 -6.9718 -4.5615 -4.5615 -3.6321 -3.6321 -0.5794 -0.5794 -0.2311 -0.2311 0.2769 0.2769 1.3778 1.3778 1.5653 1.5653 1.9323 1.9323 2.7027 2.7027 3.1762 3.1762 3.4674 3.4674 3.7866 3.7866 4.3408 4.3408 4.8539 4.8539 7.6203 7.6203 8.1358 8.1358 8.5834 8.5834 9.0176 9.0176 k =-0.1250-0.1262 0.1152 ( 20553 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6031 -9.6031 -7.7250 -7.7250 -7.4405 -7.4405 -6.9643 -6.9643 -4.5266 -4.5266 -3.5846 -3.5846 -0.6236 -0.6236 -0.2835 -0.2835 0.2216 0.2216 1.3520 1.3520 1.5341 1.5341 1.9047 1.9047 2.7349 2.7349 3.1532 3.1532 3.4516 3.4516 3.8164 3.8164 4.3634 4.3634 4.8622 4.8622 7.6850 7.6850 8.1609 8.1609 8.5791 8.5791 9.0911 9.0911 k =-0.1146-0.1157 0.1056 ( 20543 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6205 -9.6205 -7.7175 -7.7175 -7.4332 -7.4332 -6.9573 -6.9573 -4.4936 -4.4936 -3.5400 -3.5400 -0.6642 -0.6642 -0.3318 -0.3318 0.1695 0.1695 1.3287 1.3287 1.5036 1.5036 1.8779 1.8779 2.7656 2.7656 3.1331 3.1331 3.4375 3.4375 3.8432 3.8432 4.3888 4.3888 4.8707 4.8707 7.7413 7.7413 8.1800 8.1800 8.5678 8.5678 9.1642 9.1642 k =-0.1042-0.1052 0.0960 ( 20538 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6364 -9.6364 -7.7106 -7.7106 -7.4262 -7.4262 -6.9508 -6.9508 -4.4627 -4.4627 -3.4985 -3.4985 -0.7012 -0.7012 -0.3758 -0.3758 0.1207 0.1207 1.3080 1.3080 1.4738 1.4738 1.8523 1.8523 2.7936 2.7936 3.1163 3.1163 3.4252 3.4252 3.8664 3.8664 4.4164 4.4164 4.8793 4.8793 7.7887 7.7887 8.1943 8.1943 8.5517 8.5517 9.2355 9.2355 k =-0.0938-0.0947 0.0864 ( 20528 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6510 -9.6510 -7.7042 -7.7042 -7.4196 -7.4196 -6.9449 -6.9449 -4.4341 -4.4341 -3.4604 -3.4604 -0.7345 -0.7345 -0.4155 -0.4155 0.0755 0.0755 1.2899 1.2899 1.4451 1.4451 1.8283 1.8283 2.8182 2.8182 3.1031 3.1031 3.4149 3.4149 3.8859 3.8859 4.4451 4.4451 4.8881 4.8881 7.8269 7.8269 8.2053 8.2053 8.5327 8.5327 9.3035 9.3035 k =-0.0833-0.0842 0.0768 ( 20523 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6641 -9.6641 -7.6985 -7.6985 -7.4134 -7.4134 -6.9395 -6.9395 -4.4079 -4.4079 -3.4258 -3.4258 -0.7643 -0.7643 -0.4507 -0.4507 0.0342 0.0342 1.2745 1.2745 1.4176 1.4176 1.8062 1.8062 2.8384 2.8384 3.0936 3.0936 3.4067 3.4067 3.9021 3.9021 4.4740 4.4740 4.8970 4.8970 7.8558 7.8558 8.2142 8.2142 8.5123 8.5123 9.3659 9.3659 k =-0.0729-0.0736 0.0672 ( 20521 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6756 -9.6756 -7.6935 -7.6935 -7.4078 -7.4078 -6.9347 -6.9347 -4.3843 -4.3843 -3.3949 -3.3949 -0.7904 -0.7904 -0.4815 -0.4815 -0.0032 -0.0032 1.2619 1.2619 1.3917 1.3917 1.7863 1.7863 2.8540 2.8540 3.0879 3.0879 3.4006 3.4006 3.9151 3.9151 4.5019 4.5019 4.9059 4.9059 7.8763 7.8763 8.2219 8.2219 8.4916 8.4916 9.4147 9.4147 k =-0.0625-0.0631 0.0576 ( 20516 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6857 -9.6857 -7.6891 -7.6891 -7.4027 -7.4027 -6.9305 -6.9305 -4.3635 -4.3635 -3.3679 -3.3679 -0.8131 -0.8131 -0.5079 -0.5079 -0.0362 -0.0362 1.2521 1.2521 1.3674 1.3674 1.7687 1.7687 2.8650 2.8650 3.0855 3.0855 3.3965 3.3965 3.9254 3.9254 4.5277 4.5277 4.9146 4.9146 7.8895 7.8895 8.2289 8.2289 8.4716 8.4716 9.4272 9.4272 k =-0.0521-0.0526 0.0480 ( 20515 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6943 -9.6943 -7.6853 -7.6853 -7.3984 -7.3984 -6.9269 -6.9269 -4.3456 -4.3456 -3.3448 -3.3448 -0.8323 -0.8323 -0.5299 -0.5299 -0.0647 -0.0647 1.2451 1.2451 1.3451 1.3451 1.7537 1.7537 2.8720 2.8720 3.0855 3.0855 3.3940 3.3940 3.9334 3.9334 4.5507 4.5507 4.9230 4.9230 7.8969 7.8969 8.2353 8.2353 8.4532 8.4532 9.4201 9.4201 k =-0.0417-0.0421 0.0384 ( 20521 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7013 -9.7013 -7.6822 -7.6822 -7.3947 -7.3947 -6.9239 -6.9239 -4.3308 -4.3308 -3.3259 -3.3259 -0.8479 -0.8479 -0.5477 -0.5477 -0.0884 -0.0884 1.2408 1.2408 1.3252 1.3252 1.7413 1.7413 2.8760 2.8760 3.0871 3.0871 3.3928 3.3928 3.9394 3.9394 4.5701 4.5701 4.9306 4.9306 7.9004 7.9004 8.2411 8.2411 8.4369 8.4369 9.4094 9.4094 k =-0.0312-0.0316 0.0288 ( 20520 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7068 -9.7068 -7.6798 -7.6798 -7.3918 -7.3918 -6.9216 -6.9216 -4.3191 -4.3191 -3.3110 -3.3110 -0.8601 -0.8601 -0.5613 -0.5613 -0.1071 -0.1071 1.2390 1.2390 1.3078 1.3078 1.7316 1.7316 2.8780 2.8780 3.0892 3.0892 3.3925 3.3925 3.9438 3.9438 4.5855 4.5855 4.9371 4.9371 7.9013 7.9013 8.2460 8.2460 8.4234 8.4234 9.3987 9.3987 k =-0.0208-0.0210 0.0192 ( 20522 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7107 -9.7107 -7.6781 -7.6781 -7.3897 -7.3897 -6.9200 -6.9200 -4.3108 -4.3108 -3.3004 -3.3004 -0.8688 -0.8688 -0.5709 -0.5709 -0.1206 -0.1206 1.2392 1.2392 1.2938 1.2938 1.7246 1.7246 2.8788 2.8788 3.0911 3.0911 3.3928 3.3928 3.9468 3.9468 4.5966 4.5966 4.9421 4.9421 7.9011 7.9011 8.2497 8.2497 8.4133 8.4133 9.3898 9.3898 k =-0.0104-0.0105 0.0096 ( 20520 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7130 -9.7130 -7.6770 -7.6770 -7.3884 -7.3884 -6.9190 -6.9190 -4.3057 -4.3057 -3.2940 -3.2940 -0.8741 -0.8741 -0.5766 -0.5766 -0.1288 -0.1288 1.2406 1.2406 1.2841 1.2841 1.7204 1.7204 2.8790 2.8790 3.0924 3.0924 3.3931 3.3931 3.9485 3.9485 4.6033 4.6033 4.9453 4.9453 7.9006 7.9006 8.2521 8.2521 8.4070 8.4070 9.3840 9.3840 k = 0.0000 0.0000 0.0000 ( 20519 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7138 -9.7138 -7.6767 -7.6767 -7.3880 -7.3880 -6.9186 -6.9186 -4.3040 -4.3040 -3.2918 -3.2918 -0.8758 -0.8758 -0.5785 -0.5785 -0.1315 -0.1315 1.2415 1.2415 1.2804 1.2804 1.7190 1.7190 2.8790 2.8790 3.0929 3.0929 3.3932 3.3932 3.9491 3.9491 4.6056 4.6056 4.9464 4.9464 7.9004 7.9004 8.2529 8.2529 8.4049 8.4049 9.3820 9.3820 k = 0.0000 0.0000 0.0000 ( 20519 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7138 -9.7138 -7.6767 -7.6767 -7.3880 -7.3880 -6.9186 -6.9186 -4.3040 -4.3040 -3.2918 -3.2918 -0.8758 -0.8758 -0.5785 -0.5785 -0.1315 -0.1315 1.2415 1.2415 1.2804 1.2804 1.7190 1.7190 2.8790 2.8790 3.0929 3.0929 3.3932 3.3932 3.9491 3.9491 4.6056 4.6056 4.9464 4.9464 7.9004 7.9004 8.2529 8.2529 8.4049 8.4049 9.3820 9.3820 k = 0.0000 0.0000 0.0172 ( 20513 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7128 -9.7128 -7.6786 -7.6786 -7.3876 -7.3876 -6.9187 -6.9187 -4.3049 -4.3049 -3.2940 -3.2940 -0.8714 -0.8714 -0.5781 -0.5781 -0.1299 -0.1299 1.2359 1.2359 1.2845 1.2845 1.7232 1.7232 2.8795 2.8795 3.0934 3.0934 3.3933 3.3933 3.9477 3.9477 4.6042 4.6042 4.9446 4.9446 7.8984 7.8984 8.2483 8.2483 8.4085 8.4085 9.3831 9.3831 k = 0.0000 0.0000 0.0344 ( 20518 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7099 -9.7099 -7.6844 -7.6844 -7.3864 -7.3864 -6.9190 -6.9190 -4.3076 -4.3076 -3.3004 -3.3004 -0.8581 -0.8581 -0.5769 -0.5769 -0.1249 -0.1249 1.2235 1.2235 1.2917 1.2917 1.7363 1.7363 2.8807 2.8807 3.0951 3.0951 3.3936 3.3936 3.9436 3.9436 4.6002 4.6002 4.9394 4.9394 7.8921 7.8921 8.2348 8.2348 8.4187 8.4187 9.3862 9.3862 k = 0.0000 0.0000 0.0515 ( 20529 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7049 -9.7049 -7.6940 -7.6940 -7.3844 -7.3844 -6.9194 -6.9194 -4.3120 -4.3120 -3.3110 -3.3110 -0.8363 -0.8363 -0.5747 -0.5747 -0.1164 -0.1164 1.2089 1.2089 1.2970 1.2970 1.7586 1.7586 2.8826 2.8826 3.0979 3.0979 3.3942 3.3942 3.9367 3.9367 4.5935 4.5935 4.9306 4.9306 7.8798 7.8798 8.2141 8.2141 8.4342 8.4342 9.3908 9.3908 k = 0.0000 0.0000 0.0687 ( 20531 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6981 -9.6981 -7.7074 -7.7074 -7.3815 -7.3815 -6.9200 -6.9200 -4.3180 -4.3180 -3.3257 -3.3257 -0.8065 -0.8065 -0.5713 -0.5713 -0.1042 -0.1042 1.1936 1.1936 1.2979 1.2979 1.7907 1.7907 2.8851 2.8851 3.1021 3.1021 3.3954 3.3954 3.9273 3.9273 4.5842 4.5842 4.9185 4.9185 7.8584 7.8584 8.1883 8.1883 8.4537 8.4537 9.3961 9.3961 k = 0.0000 0.0000 0.0859 ( 20538 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6892 -9.6892 -7.7244 -7.7244 -7.3777 -7.3777 -6.9207 -6.9207 -4.3252 -4.3252 -3.3442 -3.3442 -0.7695 -0.7695 -0.5665 -0.5665 -0.0881 -0.0881 1.1781 1.1781 1.2934 1.2934 1.8328 1.8328 2.8880 2.8880 3.1077 3.1077 3.3974 3.3974 3.9152 3.9152 4.5723 4.5723 4.9030 4.9030 7.8232 7.8232 8.1611 8.1611 8.4756 8.4756 9.4025 9.4025 k = 0.0000 0.0000 0.1031 ( 20536 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6785 -9.6785 -7.7451 -7.7451 -7.3731 -7.3731 -6.9217 -6.9217 -4.3337 -4.3337 -3.3664 -3.3664 -0.7262 -0.7262 -0.5596 -0.5596 -0.0678 -0.0678 1.1625 1.1625 1.2832 1.2832 1.8846 1.8846 2.8913 2.8913 3.1150 3.1150 3.4006 3.4006 3.9008 3.9008 4.5578 4.5578 4.8842 4.8842 7.7688 7.7688 8.1371 8.1371 8.4987 8.4987 9.4110 9.4110 k = 0.0000 0.0000 0.1202 ( 20539 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6659 -9.6659 -7.7693 -7.7693 -7.3676 -7.3676 -6.9228 -6.9228 -4.3430 -4.3430 -3.3920 -3.3920 -0.6787 -0.6787 -0.5498 -0.5498 -0.0425 -0.0425 1.1465 1.1465 1.2676 1.2676 1.9452 1.9452 2.8948 2.8948 3.1242 3.1242 3.4052 3.4052 3.8840 3.8840 4.5408 4.5408 4.8623 4.8623 7.6912 7.6912 8.1198 8.1198 8.5209 8.5209 9.4241 9.4241 k = 0.0000 0.0000 0.1374 ( 20536 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6513 -9.6513 -7.7967 -7.7967 -7.3612 -7.3612 -6.9242 -6.9242 -4.3529 -4.3529 -3.4206 -3.4206 -0.6304 -0.6304 -0.5344 -0.5344 -0.0118 -0.0118 1.1302 1.1302 1.2472 1.2472 2.0137 2.0137 2.8986 2.8986 3.1356 3.1356 3.4116 3.4116 3.8651 3.8651 4.5215 4.5215 4.8375 4.8375 7.5905 7.5905 8.1100 8.1100 8.5399 8.5399 9.4441 9.4441 k = 0.0000 0.0000 0.1546 ( 20529 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6350 -9.6350 -7.8272 -7.8272 -7.3540 -7.3540 -6.9258 -6.9258 -4.3632 -4.3632 -3.4520 -3.4520 -0.5882 -0.5882 -0.5080 -0.5080 0.0253 0.0253 1.1133 1.1133 1.2227 1.2227 2.0886 2.0886 2.9029 2.9029 3.1492 3.1492 3.4199 3.4199 3.8443 3.8443 4.4999 4.4999 4.8098 4.8098 7.4690 7.4690 8.1069 8.1069 8.5530 8.5530 9.4726 9.4726 k = 0.0000 0.0000 0.1718 ( 20528 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6168 -9.6168 -7.8605 -7.8605 -7.3460 -7.3460 -6.9276 -6.9276 -4.3736 -4.3736 -3.4856 -3.4856 -0.5586 -0.5586 -0.4657 -0.4657 0.0697 0.0697 1.0957 1.0957 1.1948 1.1948 2.1685 2.1685 2.9080 2.9080 3.1652 3.1652 3.4304 3.4304 3.8219 3.8219 4.4762 4.4762 4.7794 4.7794 7.3304 7.3304 8.1088 8.1088 8.5569 8.5569 9.5096 9.5096 k = 0.0000 0.0000 0.1889 ( 20530 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.5969 -9.5969 -7.8965 -7.8965 -7.3373 -7.3373 -6.9297 -6.9297 -4.3838 -4.3838 -3.5212 -3.5212 -0.5374 -0.5374 -0.4132 -0.4132 0.1220 0.1220 1.0773 1.0773 1.1644 1.1644 2.2516 2.2516 2.9147 2.9147 3.1836 3.1836 3.4432 3.4432 3.7982 3.7982 4.4506 4.4506 4.7467 4.7467 7.1785 7.1785 8.1141 8.1141 8.5481 8.5481 9.5474 9.5474 k = 0.0000 0.0000 0.2061 ( 20521 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.5753 -9.5753 -7.9348 -7.9348 -7.3279 -7.3279 -6.9321 -6.9321 -4.3937 -4.3937 -3.5584 -3.5584 -0.5187 -0.5187 -0.3579 -0.3579 0.1829 0.1829 1.0581 1.0581 1.1323 1.1323 2.3359 2.3359 2.9241 2.9241 3.2044 3.2044 3.4583 3.4583 3.7735 3.7735 4.4233 4.4233 4.7117 4.7117 7.0168 7.0168 8.1211 8.1211 8.5238 8.5238 9.5401 9.5401 k = 0.0000 0.0000 0.2233 ( 20512 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5521 -9.5521 -7.9752 -7.9752 -7.3179 -7.3179 -6.9347 -6.9347 -4.4031 -4.4031 -3.5967 -3.5967 -0.4999 -0.4999 -0.3036 -0.3036 0.2517 0.2517 1.0383 1.0383 1.0997 1.0997 2.4188 2.4188 2.9375 2.9375 3.2273 3.2273 3.4759 3.4759 3.7483 3.7483 4.3946 4.3946 4.6749 4.6749 6.8481 6.8481 8.1277 8.1277 8.4828 8.4828 9.5055 9.5055 k = 0.0000 0.0000 0.2405 ( 20505 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5273 -9.5273 -8.0173 -8.0173 -7.3074 -7.3074 -6.9376 -6.9376 -4.4117 -4.4117 -3.6358 -3.6358 -0.4801 -0.4801 -0.2516 -0.2516 0.3269 0.3269 1.0178 1.0178 1.0689 1.0689 2.4972 2.4972 2.9566 2.9566 3.2521 3.2521 3.4958 3.4958 3.7233 3.7233 4.3650 4.3650 4.6365 4.6365 6.6754 6.6754 8.1293 8.1293 8.4278 8.4278 9.4648 9.4648 k = 0.0000 0.0000 0.2576 ( 20504 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5010 -9.5010 -8.0609 -8.0609 -7.2965 -7.2965 -6.9408 -6.9408 -4.4194 -4.4194 -3.6752 -3.6752 -0.4589 -0.4589 -0.2025 -0.2025 0.4048 0.4048 0.9954 0.9954 1.0444 1.0444 2.5676 2.5676 2.9832 2.9832 3.2784 3.2784 3.5178 3.5178 3.6992 3.6992 4.3350 4.3350 4.5969 4.5969 6.5011 6.5011 8.1159 8.1159 8.3694 8.3694 9.4214 9.4214 k = 0.0000 0.0000 0.2748 ( 20505 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4734 -9.4734 -8.1056 -8.1056 -7.2852 -7.2852 -6.9443 -6.9443 -4.4261 -4.4261 -3.7145 -3.7145 -0.4362 -0.4362 -0.1560 -0.1560 0.4793 0.4793 0.9685 0.9685 1.0344 1.0344 2.6271 2.6271 3.0180 3.0180 3.3057 3.3057 3.5417 3.5417 3.6771 3.6771 4.3055 4.3055 4.5565 4.5565 6.3278 6.3278 8.0688 8.0688 8.3281 8.3281 9.3768 9.3768 k = 0.0000 0.0000 0.2920 ( 20502 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4446 -9.4446 -8.1512 -8.1512 -7.2737 -7.2737 -6.9481 -6.9481 -4.4318 -4.4318 -3.7534 -3.7534 -0.4121 -0.4121 -0.1118 -0.1118 0.5411 0.5411 0.9374 0.9374 1.0472 1.0472 2.6747 2.6747 3.0594 3.0594 3.3333 3.3333 3.5663 3.5663 3.6585 3.6585 4.2777 4.2777 4.5160 4.5160 6.1580 6.1580 7.9789 7.9789 8.3158 8.3158 9.3318 9.3318 k = 0.0000 0.0000 0.3092 ( 20497 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4148 -9.4148 -8.1971 -8.1971 -7.2621 -7.2621 -6.9522 -6.9522 -4.4363 -4.4363 -3.7914 -3.7914 -0.3866 -0.3866 -0.0693 -0.0693 0.5805 0.5805 0.9041 0.9041 1.0896 1.0896 2.7115 2.7115 3.1029 3.1029 3.3603 3.3603 3.5895 3.5895 3.6457 3.6457 4.2531 4.2531 4.4762 4.4762 5.9945 5.9945 7.8583 7.8583 8.3238 8.3238 9.2865 9.2865 k = 0.0000 0.0000 0.3263 ( 20494 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3841 -9.3841 -8.2431 -8.2431 -7.2505 -7.2505 -6.9565 -6.9565 -4.4397 -4.4397 -3.8283 -3.8283 -0.3600 -0.3600 -0.0282 -0.0282 0.5942 0.5942 0.8697 0.8697 1.1632 1.1632 2.7402 2.7402 3.1423 3.1423 3.3863 3.3863 3.6045 3.6045 3.6444 3.6444 4.2333 4.2333 4.4385 4.4385 5.8404 5.8404 7.7200 7.7200 8.3422 8.3422 9.2411 9.2411 k = 0.0000 0.0000 0.3435 ( 20502 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3529 -9.3529 -8.2887 -8.2887 -7.2390 -7.2390 -6.9610 -6.9610 -4.4419 -4.4419 -3.8635 -3.8635 -0.3323 -0.3323 0.0118 0.0118 0.5875 0.5875 0.8347 0.8347 1.2619 1.2619 2.7633 2.7633 3.1714 3.1714 3.4120 3.4120 3.6040 3.6040 3.6593 3.6593 4.2187 4.2187 4.4050 4.4050 5.6996 5.6996 7.5714 7.5714 8.3662 8.3662 9.1957 9.1957 k = 0.0000 0.0000 0.3607 ( 20510 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3215 -9.3215 -8.3334 -8.3334 -7.2279 -7.2279 -6.9656 -6.9656 -4.4430 -4.4430 -3.8968 -3.8968 -0.3041 -0.3041 0.0509 0.0509 0.5680 0.5680 0.7992 0.7992 1.3774 1.3774 2.7827 2.7827 3.1862 3.1862 3.4385 3.4385 3.5920 3.5920 3.6822 3.6822 4.2070 4.2070 4.3790 4.3790 5.5767 5.5767 7.4173 7.4173 8.3937 8.3937 9.1505 9.1505 k = 0.0000 0.0000 0.3779 ( 20514 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.2903 -9.2903 -8.3767 -8.3767 -7.2173 -7.2173 -6.9703 -6.9703 -4.4432 -4.4432 -3.9277 -3.9277 -0.2756 -0.2756 0.0888 0.0888 0.5417 0.5417 0.7634 0.7634 1.5031 1.5031 2.7996 2.7996 3.1856 3.1856 3.4662 3.4662 3.5693 3.5693 3.7095 3.7095 4.1927 4.1927 4.3635 4.3635 5.4770 5.4770 7.2614 7.2614 8.4235 8.4235 9.1058 9.1058 k = 0.0000 0.0000 0.3950 ( 20508 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.2599 -9.2599 -8.4177 -8.4177 -7.2073 -7.2073 -6.9749 -6.9749 -4.4425 -4.4425 -3.9558 -3.9558 -0.2475 -0.2475 0.1254 0.1254 0.5127 0.5127 0.7276 0.7276 1.6343 1.6343 2.8141 2.8141 3.1714 3.1714 3.4914 3.4914 3.5387 3.5387 3.7406 3.7406 4.1712 4.1712 4.3571 4.3571 5.4062 5.4062 7.1069 7.1069 8.4547 8.4547 9.0619 9.0619 k = 0.0000 0.0000 0.4122 ( 20508 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.2311 -9.2311 -8.4558 -8.4558 -7.1982 -7.1982 -6.9794 -6.9794 -4.4412 -4.4412 -3.9806 -3.9806 -0.2204 -0.2204 0.1601 0.1601 0.4839 0.4839 0.6925 0.6925 1.7671 1.7671 2.8258 2.8258 3.1459 3.1459 3.4805 3.4805 3.5355 3.5355 3.7749 3.7749 4.1434 4.1434 4.3522 4.3522 5.3681 5.3681 6.9572 6.9572 8.4864 8.4864 9.0195 9.0195 k = 0.0000 0.0000 0.4294 ( 20516 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.2047 -9.2047 -8.4898 -8.4898 -7.1903 -7.1903 -6.9834 -6.9834 -4.4396 -4.4396 -4.0018 -4.0018 -0.1954 -0.1954 0.1917 0.1917 0.4578 0.4578 0.6588 0.6588 1.8974 1.8974 2.8333 2.8333 3.1114 3.1114 3.4378 3.4378 3.5595 3.5595 3.8112 3.8112 4.1121 4.1121 4.3421 4.3421 5.3622 5.3622 6.8168 6.8168 8.5178 8.5178 8.9795 8.9795 k = 0.0000 0.0000 0.4466 ( 20517 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.1821 -9.1821 -8.5185 -8.5185 -7.1837 -7.1837 -6.9869 -6.9869 -4.4379 -4.4379 -4.0189 -4.0189 -0.1736 -0.1736 0.2189 0.2189 0.4367 0.4367 0.6278 0.6278 2.0200 2.0200 2.8337 2.8337 3.0721 3.0721 3.3962 3.3962 3.5828 3.5828 3.8485 3.8485 4.0798 4.0798 4.3258 4.3258 5.3814 5.3814 6.6914 6.6914 8.5472 8.5472 8.9434 8.9434 k = 0.0000 0.0000 0.4637 ( 20520 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.1644 -9.1644 -8.5405 -8.5405 -7.1788 -7.1788 -6.9895 -6.9895 -4.4364 -4.4364 -4.0315 -4.0315 -0.1564 -0.1564 0.2394 0.2394 0.4226 0.4226 0.6017 0.6017 2.1268 2.1268 2.8242 2.8242 3.0358 3.0358 3.3634 3.3634 3.6015 3.6015 3.8849 3.8849 4.0480 4.0480 4.3074 4.3074 5.4131 5.4131 6.5890 6.5890 8.5725 8.5725 8.9133 8.9133 k = 0.0000 0.0000 0.4809 ( 20522 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.1532 -9.1532 -8.5544 -8.5544 -7.1757 -7.1757 -6.9912 -6.9912 -4.4353 -4.4353 -4.0392 -4.0392 -0.1453 -0.1453 0.2519 0.2519 0.4156 0.4156 0.5835 0.5835 2.2040 2.2040 2.8075 2.8075 3.0120 3.0120 3.3429 3.3429 3.6136 3.6136 3.9172 3.9172 4.0194 4.0194 4.2931 4.2931 5.4418 5.4418 6.5204 6.5204 8.5902 8.5902 8.8927 8.8927 k = 0.0000 0.0000 0.4981 ( 20526 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.1493 -9.1493 -8.5592 -8.5592 -7.1747 -7.1747 -6.9918 -6.9918 -4.4350 -4.4350 -4.0418 -4.0418 -0.1415 -0.1415 0.2559 0.2559 0.4137 0.4137 0.5769 0.5769 2.2333 2.2333 2.7983 2.7983 3.0041 3.0041 3.3359 3.3359 3.6178 3.6178 3.9334 3.9334 4.0046 4.0046 4.2876 4.2876 5.4533 5.4533 6.4959 6.4959 8.5967 8.5967 8.8852 8.8852 k = 0.0000-0.4977 0.4742 ( 20560 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -8.9993 -8.9993 -8.3985 -8.3985 -7.3056 -7.3056 -7.0241 -7.0241 -5.1187 -5.1187 -4.4806 -4.4806 -0.1379 -0.1379 0.3856 0.3856 1.6571 1.6571 1.7550 1.7550 2.5155 2.5155 2.6627 2.6627 3.0663 3.0663 3.2821 3.2821 3.7905 3.7905 3.9527 3.9527 4.7032 4.7032 4.7532 4.7532 5.2529 5.2529 6.2810 6.2810 6.6160 6.6160 6.8356 6.8356 k = 0.0000-0.4849 0.4621 ( 20561 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.0017 -9.0017 -8.3963 -8.3963 -7.3059 -7.3059 -7.0235 -7.0235 -5.1187 -5.1187 -4.4779 -4.4779 -0.1404 -0.1404 0.3881 0.3881 1.6481 1.6481 1.7581 1.7581 2.5162 2.5162 2.6533 2.6533 3.0496 3.0496 3.2985 3.2985 3.7985 3.7985 3.9509 3.9509 4.6871 4.6871 4.7688 4.7688 5.2401 5.2401 6.2874 6.2874 6.6304 6.6304 6.8436 6.8436 k = 0.0000-0.4722 0.4499 ( 20551 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.0087 -9.0087 -8.3898 -8.3898 -7.3067 -7.3067 -7.0218 -7.0218 -5.1187 -5.1187 -4.4698 -4.4698 -0.1480 -0.1480 0.3955 0.3955 1.6235 1.6235 1.7649 1.7649 2.5180 2.5180 2.6264 2.6264 3.0126 3.0126 3.3327 3.3327 3.8229 3.8229 3.9462 3.9462 4.6587 4.6587 4.7956 4.7956 5.2039 5.2039 6.3065 6.3065 6.6719 6.6719 6.8674 6.8674 k = 0.0000-0.4594 0.4378 ( 20552 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.0201 -9.0201 -8.3792 -8.3792 -7.3080 -7.3080 -7.0189 -7.0189 -5.1185 -5.1185 -4.4567 -4.4567 -0.1600 -0.1600 0.4075 0.4075 1.5867 1.5867 1.7718 1.7718 2.5182 2.5182 2.5880 2.5880 2.9706 2.9706 3.3652 3.3652 3.8619 3.8619 3.9421 3.9421 4.6285 4.6285 4.8215 4.8215 5.1508 5.1508 6.3380 6.3380 6.7365 6.7365 6.9061 6.9061 k = 0.0000-0.4466 0.4256 ( 20552 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.0353 -9.0353 -8.3651 -8.3651 -7.3098 -7.3098 -7.0152 -7.0152 -5.1178 -5.1178 -4.4386 -4.4386 -0.1760 -0.1760 0.4232 0.4232 1.5396 1.5396 1.7768 1.7768 2.5011 2.5011 2.5585 2.5585 2.9288 2.9288 3.3871 3.3871 3.8923 3.8923 3.9607 3.9607 4.5983 4.5983 4.8401 4.8401 5.0914 5.0914 6.3818 6.3818 6.8186 6.8186 6.9588 6.9588 k = 0.0000-0.4339 0.4134 ( 20547 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.0538 -9.0538 -8.3480 -8.3480 -7.3119 -7.3119 -7.0107 -7.0107 -5.1162 -5.1162 -4.4162 -4.4162 -0.1953 -0.1953 0.4421 0.4421 1.4830 1.4830 1.7789 1.7789 2.4525 2.4525 2.5571 2.5571 2.8873 2.8873 3.3975 3.3975 3.8883 3.8883 4.0240 4.0240 4.5685 4.5685 4.8385 4.8385 5.0448 5.0448 6.4377 6.4377 6.9126 6.9126 7.0247 7.0247 k = 0.0000-0.4211 0.4013 ( 20551 PWs) bands (ev): -40.3134 -40.3134 -40.3127 -40.3127 -9.0751 -9.0751 -8.3283 -8.3283 -7.3142 -7.3142 -7.0056 -7.0056 -5.1134 -5.1134 -4.3897 -4.3897 -0.2170 -0.2170 0.4634 0.4634 1.4178 1.4178 1.7771 1.7771 2.3940 2.3940 2.5665 2.5665 2.8451 2.8451 3.3984 3.3984 3.8738 3.8738 4.1018 4.1018 4.5396 4.5396 4.7993 4.7993 5.0347 5.0347 6.5054 6.5054 7.0123 7.0123 7.1044 7.1044 k = 0.0000-0.4084 0.3891 ( 20555 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.0986 -9.0986 -8.3066 -8.3066 -7.3166 -7.3166 -7.0001 -7.0001 -5.1090 -5.1090 -4.3597 -4.3597 -0.2407 -0.2407 0.4864 0.4864 1.3449 1.3449 1.7702 1.7702 2.3359 2.3359 2.5796 2.5796 2.8016 2.8016 3.3917 3.3917 3.8584 3.8584 4.1766 4.1766 4.5130 4.5130 4.7315 4.7315 5.0596 5.0596 6.5841 6.5841 7.1121 7.1121 7.1991 7.1991 k = 0.0000-0.3956 0.3770 ( 20552 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.1239 -9.1239 -8.2833 -8.2833 -7.3192 -7.3192 -6.9945 -6.9945 -5.1026 -5.1026 -4.3265 -4.3265 -0.2659 -0.2659 0.5104 0.5104 1.2655 1.2655 1.7565 1.7565 2.2822 2.2822 2.5947 2.5947 2.7568 2.7568 3.3790 3.3790 3.8449 3.8449 4.2340 4.2340 4.4904 4.4904 4.6590 4.6590 5.1063 5.1063 6.6727 6.6727 7.2093 7.2093 7.3074 7.3074 k = 0.0000-0.3828 0.3648 ( 20560 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.1504 -9.1504 -8.2587 -8.2587 -7.3217 -7.3217 -6.9888 -6.9888 -5.0940 -5.0940 -4.2905 -4.2905 -0.2920 -0.2920 0.5346 0.5346 1.1812 1.1812 1.7342 1.7342 2.2357 2.2357 2.6102 2.6102 2.7118 2.7118 3.3611 3.3611 3.8346 3.8346 4.2591 4.2591 4.4639 4.4639 4.6100 4.6100 5.1697 5.1697 6.7700 6.7700 7.3054 7.3054 7.4249 7.4249 k = 0.0000-0.3701 0.3526 ( 20558 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.1780 -9.1780 -8.2332 -8.2332 -7.3242 -7.3242 -6.9833 -6.9833 -5.0829 -5.0829 -4.2522 -4.2522 -0.3188 -0.3188 0.5581 0.5581 1.0941 1.0941 1.7015 1.7015 2.1982 2.1982 2.6191 2.6191 2.6733 2.6733 3.3391 3.3391 3.8274 3.8274 4.2488 4.2488 4.4128 4.4128 4.6099 4.6099 5.2489 5.2489 6.8748 6.8748 7.4020 7.4020 7.5473 7.5473 k = 0.0000-0.3573 0.3405 ( 20556 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.2062 -9.2062 -8.2070 -8.2070 -7.3267 -7.3267 -6.9780 -6.9780 -5.0692 -5.0692 -4.2119 -4.2119 -0.3459 -0.3459 0.5790 0.5790 1.0067 1.0067 1.6579 1.6579 2.1704 2.1704 2.5948 2.5948 2.6672 2.6672 3.3145 3.3145 3.8214 3.8214 4.2143 4.2143 4.3492 4.3492 4.6389 4.6389 5.3434 5.3434 6.9855 6.9855 7.4994 7.4994 7.6718 7.6718 k = 0.0000-0.3446 0.3283 ( 20553 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.2348 -9.2348 -8.1802 -8.1802 -7.3290 -7.3290 -6.9731 -6.9731 -5.0527 -5.0527 -4.1699 -4.1699 -0.3730 -0.3730 0.5937 0.5937 0.9236 0.9236 1.6037 1.6037 2.1517 2.1517 2.5483 2.5483 2.6823 2.6823 3.2885 3.2885 3.8130 3.8130 4.1680 4.1680 4.2898 4.2898 4.6731 4.6731 5.4515 5.4515 7.1010 7.1010 7.5973 7.5973 7.7967 7.7967 k = 0.0000-0.3318 0.3162 ( 20550 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.2635 -9.2635 -8.1532 -8.1532 -7.3313 -7.3313 -6.9686 -6.9686 -5.0334 -5.0334 -4.1266 -4.1266 -0.3999 -0.3999 0.5943 0.5943 0.8535 0.8535 1.5408 1.5408 2.1399 2.1399 2.4976 2.4976 2.7004 2.7004 3.2628 3.2628 3.7972 3.7972 4.1206 4.1206 4.2395 4.2395 4.7043 4.7043 5.5710 5.5710 7.2199 7.2199 7.6946 7.6946 7.9206 7.9206 k = 0.0000-0.3190 0.3040 ( 20548 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.2923 -9.2923 -8.1259 -8.1259 -7.3336 -7.3336 -6.9645 -6.9645 -5.0114 -5.0114 -4.0822 -4.0822 -0.4264 -0.4264 0.5674 0.5674 0.8103 0.8103 1.4711 1.4711 2.1324 2.1324 2.4461 2.4461 2.7177 2.7177 3.2386 3.2386 3.7696 3.7696 4.0794 4.0794 4.2004 4.2004 4.7307 4.7307 5.6993 5.6993 7.3409 7.3409 7.7904 7.7904 8.0423 8.0423 k = 0.0000-0.3063 0.2918 ( 20552 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3208 -9.3208 -8.0987 -8.0987 -7.3358 -7.3358 -6.9608 -6.9608 -4.9866 -4.9866 -4.0370 -4.0370 -0.4523 -0.4523 0.5085 0.5085 0.7989 0.7989 1.3968 1.3968 2.1258 2.1258 2.3961 2.3961 2.7327 2.7327 3.2166 3.2166 3.7300 3.7300 4.0438 4.0438 4.1759 4.1759 4.7523 4.7523 5.8342 5.8342 7.4626 7.4626 7.8833 7.8833 8.1608 8.1608 k = 0.0000-0.2935 0.2797 ( 20557 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3490 -9.3490 -8.0714 -8.0714 -7.3379 -7.3379 -6.9576 -6.9576 -4.9593 -4.9593 -3.9913 -3.9913 -0.4775 -0.4775 0.4304 0.4304 0.8067 0.8067 1.3197 1.3197 2.1159 2.1159 2.3504 2.3504 2.7440 2.7440 3.1973 3.1973 3.6837 3.6837 4.0081 4.0081 4.1687 4.1687 4.7698 4.7698 5.9736 5.9736 7.5835 7.5835 7.9720 7.9720 8.2751 8.2751 k = 0.0000-0.2807 0.2675 ( 20550 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.3768 -9.3768 -8.0444 -8.0444 -7.3402 -7.3402 -6.9547 -6.9547 -4.9296 -4.9296 -3.9453 -3.9453 -0.5018 -0.5018 0.3443 0.3443 0.8221 0.8221 1.2419 1.2419 2.0976 2.0976 2.3133 2.3133 2.7506 2.7506 3.1806 3.1806 3.6374 3.6374 3.9700 3.9700 4.1767 4.1767 4.7840 4.7840 6.1160 6.1160 7.7017 7.7017 8.0554 8.0554 8.3843 8.3843 k = 0.0000-0.2680 0.2554 ( 20547 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4039 -9.4039 -8.0176 -8.0176 -7.3424 -7.3424 -6.9521 -6.9521 -4.8978 -4.8978 -3.8992 -3.8992 -0.5251 -0.5251 0.2559 0.2559 0.8383 0.8383 1.1661 1.1661 2.0668 2.0668 2.2876 2.2876 2.7518 2.7518 3.1662 3.1662 3.5964 3.5964 3.9306 3.9306 4.1950 4.1950 4.7956 4.7956 6.2601 6.2601 7.8147 7.8147 8.1326 8.1326 8.4875 8.4875 k = 0.0000-0.2552 0.2432 ( 20556 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4303 -9.4303 -7.9912 -7.9912 -7.3447 -7.3447 -6.9497 -6.9497 -4.8640 -4.8640 -3.8534 -3.8534 -0.5473 -0.5473 0.1676 0.1676 0.8491 0.8491 1.0969 1.0969 2.0238 2.0238 2.2723 2.2723 2.7475 2.7475 3.1534 3.1534 3.5642 3.5642 3.8917 3.8917 4.2195 4.2195 4.8053 4.8053 6.4047 6.4047 7.9193 7.9193 8.2038 8.2038 8.5840 8.5840 k = 0.0000-0.2425 0.2310 ( 20555 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4560 -9.4560 -7.9652 -7.9652 -7.3472 -7.3472 -6.9475 -6.9475 -4.8285 -4.8285 -3.8079 -3.8079 -0.5682 -0.5682 0.0809 0.0809 0.8440 0.8440 1.0443 1.0443 1.9722 1.9722 2.2624 2.2624 2.7388 2.7388 3.1419 3.1419 3.5424 3.5424 3.8548 3.8548 4.2475 4.2475 4.8135 4.8135 6.5488 6.5488 8.0112 8.0112 8.2701 8.2701 8.6736 8.6736 k = 0.0000-0.2297 0.2189 ( 20552 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.4807 -9.4807 -7.9397 -7.9397 -7.3497 -7.3497 -6.9455 -6.9455 -4.7918 -4.7918 -3.7631 -3.7631 -0.5879 -0.5879 -0.0033 -0.0033 0.8109 0.8109 1.0205 1.0205 1.9159 1.9159 2.2528 2.2528 2.7276 2.7276 3.1314 3.1314 3.5301 3.5301 3.8213 3.8213 4.2775 4.2775 4.8209 4.8209 6.6914 6.6914 8.0857 8.0857 8.3333 8.3333 8.7565 8.7565 k = 0.0000-0.2169 0.2067 ( 20553 PWs) bands (ev): -40.3135 -40.3135 -40.3127 -40.3127 -9.5045 -9.5045 -7.9148 -7.9148 -7.3524 -7.3524 -6.9435 -6.9435 -4.7540 -4.7540 -3.7191 -3.7191 -0.6063 -0.6063 -0.0844 -0.0844 0.7531 0.7531 1.0221 1.0221 1.8577 1.8577 2.2396 2.2396 2.7165 2.7165 3.1221 3.1221 3.5252 3.5252 3.7926 3.7926 4.3082 4.3082 4.8277 4.8277 6.8316 6.8316 8.1403 8.1403 8.3935 8.3935 8.8341 8.8341 k = 0.0000-0.2042 0.1946 ( 20545 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.5272 -9.5272 -7.8907 -7.8907 -7.3552 -7.3552 -6.9416 -6.9416 -4.7156 -4.7156 -3.6763 -3.6763 -0.6233 -0.6233 -0.1618 -0.1618 0.6837 0.6837 1.0361 1.0361 1.7991 1.7991 2.2202 2.2202 2.7085 2.7085 3.1144 3.1144 3.5240 3.5240 3.7705 3.7705 4.3388 4.3388 4.8344 4.8344 6.9682 6.9682 8.1758 8.1758 8.4477 8.4477 8.9085 8.9085 k = 0.0000-0.1914 0.1824 ( 20539 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.5489 -9.5489 -7.8674 -7.8674 -7.3581 -7.3581 -6.9397 -6.9397 -4.6769 -4.6769 -3.6347 -3.6347 -0.6391 -0.6391 -0.2351 -0.2351 0.6103 0.6103 1.0549 1.0549 1.7415 1.7415 2.1933 2.1933 2.7053 2.7053 3.1083 3.1083 3.5228 3.5228 3.7571 3.7571 4.3687 4.3687 4.8413 4.8413 7.1002 7.1002 8.1960 8.1960 8.4915 8.4915 8.9823 8.9823 k = 0.0000-0.1787 0.1702 ( 20541 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.5694 -9.5694 -7.8450 -7.8450 -7.3610 -7.3610 -6.9377 -6.9377 -4.6383 -4.6383 -3.5946 -3.5946 -0.6539 -0.6539 -0.3037 -0.3037 0.5362 0.5362 1.0754 1.0754 1.6857 1.6857 2.1594 2.1594 2.7078 2.7078 3.1037 3.1037 3.5184 3.5184 3.7535 3.7535 4.3974 4.3974 4.8485 4.8485 7.2264 7.2264 8.2053 8.2053 8.5219 8.5219 9.0567 9.0567 k = 0.0000-0.1659 0.1581 ( 20540 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.5887 -9.5887 -7.8236 -7.8236 -7.3640 -7.3640 -6.9358 -6.9358 -4.6000 -4.6000 -3.5563 -3.5563 -0.6678 -0.6678 -0.3669 -0.3669 0.4630 0.4630 1.0962 1.0962 1.6324 1.6324 2.1196 2.1196 2.7157 2.7157 3.1003 3.1003 3.5097 3.5097 3.7596 3.7596 4.4246 4.4246 4.8562 4.8562 7.3454 7.3454 8.2075 8.2075 8.5388 8.5388 9.1313 9.1313 k = 0.0000-0.1531 0.1459 ( 20535 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6067 -9.6067 -7.8033 -7.8033 -7.3670 -7.3670 -6.9338 -6.9338 -4.5627 -4.5627 -3.5198 -3.5198 -0.6815 -0.6815 -0.4240 -0.4240 0.3915 0.3915 1.1164 1.1164 1.5821 1.5821 2.0759 2.0759 2.7278 2.7278 3.0980 3.0980 3.4974 3.4974 3.7732 3.7732 4.4502 4.4502 4.8645 4.8645 7.4557 7.4557 8.2055 8.2055 8.5439 8.5439 9.2045 9.2045 k = 0.0000-0.1404 0.1338 ( 20537 PWs) bands (ev): -40.3135 -40.3135 -40.3126 -40.3126 -9.6235 -9.6235 -7.7842 -7.7842 -7.3699 -7.3699 -6.9319 -6.9319 -4.5265 -4.5265 -3.4855 -3.4855 -0.6958 -0.6958 -0.4738 -0.4738 0.3224 0.3224 1.1355 1.1355 1.5353 1.5353 2.0301 2.0301 2.7431 2.7431 3.0965 3.0965 3.4831 3.4831 3.7917 3.7917 4.4739 4.4739 4.8733 4.8733 7.5554 7.5554 8.2020 8.2020 8.5400 8.5400 9.2737 9.2737 k = 0.0000-0.1276 0.1216 ( 20542 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6389 -9.6389 -7.7663 -7.7663 -7.3727 -7.3727 -6.9300 -6.9300 -4.4918 -4.4918 -3.4535 -3.4535 -0.7117 -0.7117 -0.5152 -0.5152 0.2561 0.2561 1.1533 1.1533 1.4922 1.4922 1.9840 1.9840 2.7603 2.7603 3.0955 3.0955 3.4682 3.4682 3.8130 3.8130 4.4958 4.4958 4.8825 4.8825 7.6431 7.6431 8.1991 8.1991 8.5296 8.5296 9.3355 9.3355 k = 0.0000-0.1149 0.1094 ( 20547 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6529 -9.6529 -7.7499 -7.7499 -7.3754 -7.3754 -6.9281 -6.9281 -4.4592 -4.4592 -3.4239 -3.4239 -0.7304 -0.7304 -0.5470 -0.5470 0.1930 0.1930 1.1695 1.1695 1.4531 1.4531 1.9389 1.9389 2.7784 2.7784 3.0948 3.0948 3.4539 3.4539 3.8351 3.8351 4.5158 4.5158 4.8919 4.8919 7.7169 7.7169 8.1984 8.1984 8.5150 8.5150 9.3842 9.3842 k = 0.0000-0.1021 0.0973 ( 20543 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6656 -9.6656 -7.7350 -7.7350 -7.3779 -7.3779 -6.9263 -6.9263 -4.4288 -4.4288 -3.3970 -3.3970 -0.7519 -0.7519 -0.5689 -0.5689 0.1336 0.1336 1.1838 1.1838 1.4181 1.4181 1.8961 1.8961 2.7966 2.7966 3.0943 3.0943 3.4407 3.4407 3.8567 3.8567 4.5338 4.5338 4.9013 4.9013 7.7761 7.7761 8.2011 8.2011 8.4981 8.4981 9.4101 9.4101 k = 0.0000-0.0893 0.0851 ( 20538 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6768 -9.6768 -7.7216 -7.7216 -7.3802 -7.3802 -6.9247 -6.9247 -4.4011 -4.4011 -3.3730 -3.3730 -0.7753 -0.7753 -0.5821 -0.5821 0.0783 0.0783 1.1964 1.1964 1.3874 1.3874 1.8566 1.8566 2.8140 2.8140 3.0940 3.0940 3.4290 3.4290 3.8771 3.8771 4.5500 4.5500 4.9105 4.9105 7.8205 7.8205 8.2074 8.2074 8.4803 8.4803 9.4148 9.4148 k = 0.0000-0.0766 0.0730 ( 20536 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6865 -9.6865 -7.7099 -7.7099 -7.3822 -7.3822 -6.9232 -6.9232 -4.3763 -4.3763 -3.3518 -3.3518 -0.7988 -0.7988 -0.5885 -0.5885 0.0278 0.0278 1.2071 1.2071 1.3607 1.3607 1.8212 1.8212 2.8301 2.8301 3.0937 3.0937 3.4190 3.4190 3.8955 3.8955 4.5643 4.5643 4.9191 4.9191 7.8518 7.8518 8.2162 8.2162 8.4628 8.4628 9.4115 9.4115 k = 0.0000-0.0638 0.0608 ( 20536 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.6948 -9.6948 -7.6998 -7.6998 -7.3840 -7.3840 -6.9218 -6.9218 -4.3548 -4.3548 -3.3337 -3.3337 -0.8207 -0.8207 -0.5901 -0.5901 -0.0173 -0.0173 1.2162 1.2162 1.3380 1.3380 1.7905 1.7905 2.8445 2.8445 3.0934 3.0934 3.4108 3.4108 3.9115 3.9115 4.5766 4.5766 4.9268 4.9268 7.8725 7.8725 8.2261 8.2261 8.4466 8.4466 9.4061 9.4061 k = 0.0000-0.0510 0.0486 ( 20526 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7016 -9.7016 -7.6916 -7.6916 -7.3854 -7.3854 -6.9207 -6.9207 -4.3368 -4.3368 -3.3187 -3.3187 -0.8398 -0.8398 -0.5885 -0.5885 -0.0562 -0.0562 1.2238 1.2238 1.3190 1.3190 1.7650 1.7650 2.8566 2.8566 3.0932 3.0932 3.4042 3.4042 3.9249 3.9249 4.5868 4.5868 4.9336 4.9336 7.8855 7.8855 8.2354 8.2354 8.4324 8.4324 9.3998 9.3998 k = 0.0000-0.0383 0.0365 ( 20523 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7069 -9.7069 -7.6851 -7.6851 -7.3865 -7.3865 -6.9198 -6.9198 -4.3226 -4.3226 -3.3070 -3.3070 -0.8553 -0.8553 -0.5854 -0.5854 -0.0880 -0.0880 1.2303 1.2303 1.3035 1.3035 1.7449 1.7449 2.8663 2.8663 3.0931 3.0931 3.3993 3.3993 3.9354 3.9354 4.5949 4.5949 4.9390 4.9390 7.8932 7.8932 8.2431 8.2431 8.4207 8.4207 9.3934 9.3934 k = 0.0000-0.0255 0.0243 ( 20518 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7107 -9.7107 -7.6804 -7.6804 -7.3874 -7.3874 -6.9192 -6.9192 -4.3123 -4.3123 -3.2986 -3.2986 -0.8666 -0.8666 -0.5820 -0.5820 -0.1118 -0.1118 1.2358 1.2358 1.2915 1.2915 1.7305 1.7305 2.8734 2.8734 3.0930 3.0930 3.3959 3.3959 3.9430 3.9430 4.6008 4.6008 4.9431 4.9431 7.8975 7.8975 8.2486 8.2486 8.4120 8.4120 9.3875 9.3875 k = 0.0000-0.0128 0.0122 ( 20514 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7130 -9.7130 -7.6776 -7.6776 -7.3878 -7.3878 -6.9188 -6.9188 -4.3061 -4.3061 -3.2935 -3.2935 -0.8735 -0.8735 -0.5795 -0.5795 -0.1265 -0.1265 1.2399 1.2399 1.2834 1.2834 1.7219 1.7219 2.8776 2.8776 3.0929 3.0929 3.3938 3.3938 3.9475 3.9475 4.6044 4.6044 4.9455 4.9455 7.8997 7.8997 8.2519 8.2519 8.4067 8.4067 9.3835 9.3835 k = 0.0000 0.0000 0.0000 ( 20519 PWs) bands (ev): -40.3136 -40.3136 -40.3126 -40.3126 -9.7138 -9.7138 -7.6767 -7.6767 -7.3880 -7.3880 -6.9186 -6.9186 -4.3040 -4.3040 -3.2918 -3.2918 -0.8758 -0.8758 -0.5785 -0.5785 -0.1315 -0.1315 1.2415 1.2415 1.2804 1.2804 1.7190 1.7190 2.8790 2.8790 3.0929 3.0929 3.3932 3.3932 3.9491 3.9491 4.6056 4.6056 4.9464 4.9464 7.9004 7.9004 8.2529 8.2529 8.4049 8.4049 9.3820 9.3820 Writing output data file LiAsSe2.save init_run : 1.46s CPU 11.67s WALL ( 1 calls) electrons : 937.81s CPU 950.83s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.11s WALL ( 1 calls) potinit : 0.31s CPU 1.70s WALL ( 1 calls) Called by electrons: c_bands : 937.78s CPU 950.44s WALL ( 1 calls) v_of_rho : 0.05s CPU 1.20s WALL ( 1 calls) v_h : 0.00s CPU 0.07s WALL ( 1 calls) v_xc : 0.04s CPU 0.66s WALL ( 1 calls) newd : 0.13s CPU 0.41s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.14s CPU 0.31s WALL ( 261 calls) cegterg : 867.36s CPU 875.12s WALL ( 586 calls) Called by sum_band: Called by *egterg: h_psi : 510.06s CPU 517.51s WALL ( 10747 calls) s_psi : 22.09s CPU 22.35s WALL ( 10747 calls) g_psi : 2.37s CPU 2.42s WALL ( 9900 calls) cdiaghg : 163.64s CPU 161.56s WALL ( 10161 calls) cegterg:over : 92.61s CPU 90.14s WALL ( 9900 calls) cegterg:upda : 46.49s CPU 49.89s WALL ( 9900 calls) cegterg:last : 33.05s CPU 33.74s WALL ( 1622 calls) Called by h_psi: h_psi:vloc : 446.74s CPU 451.91s WALL ( 10747 calls) h_psi:vnl : 60.04s CPU 61.42s WALL ( 10747 calls) add_vuspsi : 19.21s CPU 22.41s WALL ( 10747 calls) General routines calbec : 40.79s CPU 38.90s WALL ( 10747 calls) fft : 0.19s CPU 1.12s WALL ( 15 calls) fftw : 416.40s CPU 419.81s WALL ( 926324 calls) davcio : 0.04s CPU 3.91s WALL ( 522 calls) Parallel routines fft_scatter : 199.37s CPU 199.48s WALL ( 926339 calls) PWSCF : 17m11.74s CPU 20m31.84s WALL This run was terminated on: 17:33:13 28Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=