Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:19:22 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./YTlSe2.save/ file Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 67 46 13 1555 896 141 Max 68 47 14 1557 916 143 Sum 2423 1675 491 55995 32559 5121 bravais-lattice index = 14 lattice parameter (alat) = 15.3515 a.u. unit-cell volume = 799.3080 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 36.00 number of Kohn-Sham states= 44 kinetic-energy cutoff = 45.0000 Ry charge density cutoff = 258.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 15.351529 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.866352 celldm(5)= 0.866352 celldm(6)= 0.866352 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.866352 0.499434 0.000000 ) a(3) = ( 0.866352 0.231835 0.442365 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.734667 -1.049349 ) b(2) = ( 0.000000 2.002266 -1.049349 ) b(3) = ( 0.000000 0.000000 2.260575 ) PseudoPot. # 1 for Tl read from file: /users/gautes/Pseudo/Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd969aa200d2b9b89aab382fbbb9d684 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Se read from file: /users/gautes/Pseudo/Se.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 38611c150961c07dbd63be353364166d Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1211 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. # 3 for Y read from file: /users/gautes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1223 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Tl 13.00 204.38330 Tl( 1.00) Se 6.00 78.96000 Se( 1.00) Y 11.00 88.90590 Y( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 290 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034483 k( 2) = ( 0.0113636 -0.0197121 -0.0119244), wk = 0.0034483 k( 3) = ( 0.0227273 -0.0394242 -0.0238488), wk = 0.0034483 k( 4) = ( 0.0340909 -0.0591364 -0.0357732), wk = 0.0034483 k( 5) = ( 0.0454546 -0.0788485 -0.0476977), wk = 0.0034483 k( 6) = ( 0.0568182 -0.0985606 -0.0596221), wk = 0.0034483 k( 7) = ( 0.0681818 -0.1182727 -0.0715465), wk = 0.0034483 k( 8) = ( 0.0795455 -0.1379849 -0.0834709), wk = 0.0034483 k( 9) = ( 0.0909091 -0.1576970 -0.0953953), wk = 0.0034483 k( 10) = ( 0.1022727 -0.1774091 -0.1073197), wk = 0.0034483 k( 11) = ( 0.1136364 -0.1971212 -0.1192442), wk = 0.0034483 k( 12) = ( 0.1250000 -0.2168333 -0.1311686), wk = 0.0034483 k( 13) = ( 0.1363636 -0.2365455 -0.1430930), wk = 0.0034483 k( 14) = ( 0.1477273 -0.2562576 -0.1550174), wk = 0.0034483 k( 15) = ( 0.1590909 -0.2759697 -0.1669418), wk = 0.0034483 k( 16) = ( 0.1704546 -0.2956818 -0.1788662), wk = 0.0034483 k( 17) = ( 0.1818182 -0.3153940 -0.1907907), wk = 0.0034483 k( 18) = ( 0.1931818 -0.3351061 -0.2027151), wk = 0.0034483 k( 19) = ( 0.2045454 -0.3548182 -0.2146395), wk = 0.0034483 k( 20) = ( 0.2159091 -0.3745303 -0.2265639), wk = 0.0034483 k( 21) = ( 0.2272727 -0.3942425 -0.2384883), wk = 0.0034483 k( 22) = ( 0.2386364 -0.4139546 -0.2504127), wk = 0.0034483 k( 23) = ( 0.2500000 -0.4336667 -0.2623372), wk = 0.0034483 k( 24) = ( 0.2613636 -0.4533788 -0.2742616), wk = 0.0034483 k( 25) = ( 0.2727273 -0.4730909 -0.2861860), wk = 0.0034483 k( 26) = ( 0.2840909 -0.4928031 -0.2981104), wk = 0.0034483 k( 27) = ( 0.2954545 -0.5125152 -0.3100348), wk = 0.0034483 k( 28) = ( 0.3068182 -0.5322273 -0.3219592), wk = 0.0034483 k( 29) = ( 0.3181818 -0.5519394 -0.3338837), wk = 0.0034483 k( 30) = ( 0.3295455 -0.5716515 -0.3458081), wk = 0.0034483 k( 31) = ( 0.3409091 -0.5913637 -0.3577325), wk = 0.0034483 k( 32) = ( 0.3522727 -0.6110758 -0.3696569), wk = 0.0034483 k( 33) = ( 0.3636364 -0.6307879 -0.3815813), wk = 0.0034483 k( 34) = ( 0.3750000 -0.6505000 -0.3935057), wk = 0.0034483 k( 35) = ( 0.3863636 -0.6702122 -0.4054301), wk = 0.0034483 k( 36) = ( 0.3977273 -0.6899243 -0.4173546), wk = 0.0034483 k( 37) = ( 0.4090909 -0.7096364 -0.4292790), wk = 0.0034483 k( 38) = ( 0.4204545 -0.7293485 -0.4412034), wk = 0.0034483 k( 39) = ( 0.4318182 -0.7490607 -0.4531278), wk = 0.0034483 k( 40) = ( 0.4431818 -0.7687728 -0.4650522), wk = 0.0034483 k( 41) = ( 0.4545455 -0.7884849 -0.4769766), wk = 0.0034483 k( 42) = ( 0.4659091 -0.8081970 -0.4889011), wk = 0.0034483 k( 43) = ( 0.4772727 -0.8279092 -0.5008255), wk = 0.0034483 k( 44) = ( 0.4886364 -0.8476213 -0.5127499), wk = 0.0034483 k( 45) = ( 0.5000000 -0.8673334 -0.5246743), wk = 0.0034483 k( 46) = ( 0.5000000 -0.8673334 -0.5246743), wk = 0.0034483 k( 47) = ( 0.5000000 -0.8542494 -0.5463034), wk = 0.0034483 k( 48) = ( 0.5000000 -0.8411654 -0.5679324), wk = 0.0034483 k( 49) = ( 0.5000000 -0.8280813 -0.5895615), wk = 0.0034483 k( 50) = ( 0.5000000 -0.8149973 -0.6111905), wk = 0.0034483 k( 51) = ( 0.5000000 -0.8019133 -0.6328196), wk = 0.0034483 k( 52) = ( 0.5000000 -0.7888293 -0.6544486), wk = 0.0034483 k( 53) = ( 0.5000000 -0.7757453 -0.6760776), wk = 0.0034483 k( 54) = ( 0.5000000 -0.7626612 -0.6977067), wk = 0.0034483 k( 55) = ( 0.5000000 -0.7495772 -0.7193358), wk = 0.0034483 k( 56) = ( 0.5000000 -0.7364932 -0.7409648), wk = 0.0034483 k( 57) = ( 0.5000000 -0.7234092 -0.7625939), wk = 0.0034483 k( 58) = ( 0.5000000 -0.7103252 -0.7842229), wk = 0.0034483 k( 59) = ( 0.5000000 -0.6972411 -0.8058520), wk = 0.0034483 k( 60) = ( 0.5000000 -0.6841571 -0.8274810), wk = 0.0034483 k( 61) = ( 0.5000000 -0.6710731 -0.8491100), wk = 0.0034483 k( 62) = ( 0.5000000 -0.6579891 -0.8707391), wk = 0.0034483 k( 63) = ( 0.5000000 -0.6449051 -0.8923682), wk = 0.0034483 k( 64) = ( 0.5000000 -0.6318210 -0.9139972), wk = 0.0034483 k( 65) = ( 0.5000000 -0.6187370 -0.9356263), wk = 0.0034483 k( 66) = ( 0.5000000 -0.6056530 -0.9572553), wk = 0.0034483 k( 67) = ( 0.5000000 -0.5925690 -0.9788844), wk = 0.0034483 k( 68) = ( 0.5000000 -0.5794850 -1.0005134), wk = 0.0034483 k( 69) = ( 0.5000000 -0.5664009 -1.0221425), wk = 0.0034483 k( 70) = ( 0.5000000 -0.5533169 -1.0437715), wk = 0.0034483 k( 71) = ( 0.5000000 -0.5402329 -1.0654006), wk = 0.0034483 k( 72) = ( 0.5000000 -0.5271489 -1.0870296), wk = 0.0034483 k( 73) = ( 0.5000000 -0.5140649 -1.1086587), wk = 0.0034483 k( 74) = ( 0.5000000 -0.5009808 -1.1302877), wk = 0.0034483 k( 75) = ( 0.8170310 -0.4161436 -0.9684095), wk = 0.0034483 k( 76) = ( 0.8104262 -0.4046865 -0.9465481), wk = 0.0034483 k( 77) = ( 0.8038214 -0.3932293 -0.9246866), wk = 0.0034483 k( 78) = ( 0.7972166 -0.3817722 -0.9028252), wk = 0.0034483 k( 79) = ( 0.7906118 -0.3703150 -0.8809638), wk = 0.0034483 k( 80) = ( 0.7840070 -0.3588579 -0.8591024), wk = 0.0034483 k( 81) = ( 0.7774021 -0.3474007 -0.8372409), wk = 0.0034483 k( 82) = ( 0.7707973 -0.3359436 -0.8153795), wk = 0.0034483 k( 83) = ( 0.7641925 -0.3244864 -0.7935181), wk = 0.0034483 k( 84) = ( 0.7575877 -0.3130293 -0.7716566), wk = 0.0034483 k( 85) = ( 0.7509829 -0.3015721 -0.7497952), wk = 0.0034483 k( 86) = ( 0.7443781 -0.2901150 -0.7279338), wk = 0.0034483 k( 87) = ( 0.7377733 -0.2786578 -0.7060724), wk = 0.0034483 k( 88) = ( 0.7311684 -0.2672007 -0.6842109), wk = 0.0034483 k( 89) = ( 0.7245636 -0.2557435 -0.6623495), wk = 0.0034483 k( 90) = ( 0.7179588 -0.2442864 -0.6404881), wk = 0.0034483 k( 91) = ( 0.7113540 -0.2328292 -0.6186266), wk = 0.0034483 k( 92) = ( 0.7047492 -0.2213721 -0.5967652), wk = 0.0034483 k( 93) = ( 0.6981444 -0.2099149 -0.5749038), wk = 0.0034483 k( 94) = ( 0.6915396 -0.1984578 -0.5530423), wk = 0.0034483 k( 95) = ( 0.6849348 -0.1870006 -0.5311809), wk = 0.0034483 k( 96) = ( 0.6783299 -0.1755435 -0.5093195), wk = 0.0034483 k( 97) = ( 0.6717251 -0.1640863 -0.4874581), wk = 0.0034483 k( 98) = ( 0.6651203 -0.1526292 -0.4655966), wk = 0.0034483 k( 99) = ( 0.6585155 -0.1411720 -0.4437352), wk = 0.0034483 k( 100) = ( 0.6519107 -0.1297149 -0.4218738), wk = 0.0034483 k( 101) = ( 0.6453059 -0.1182577 -0.4000123), wk = 0.0034483 k( 102) = ( 0.6387011 -0.1068006 -0.3781509), wk = 0.0034483 k( 103) = ( 0.6320963 -0.0953434 -0.3562895), wk = 0.0034483 k( 104) = ( 0.6254914 -0.0838863 -0.3344281), wk = 0.0034483 k( 105) = ( 0.6188866 -0.0724291 -0.3125666), wk = 0.0034483 k( 106) = ( 0.6122818 -0.0609720 -0.2907052), wk = 0.0034483 k( 107) = ( 0.6056770 -0.0495148 -0.2688438), wk = 0.0034483 k( 108) = ( 0.5990722 -0.0380577 -0.2469823), wk = 0.0034483 k( 109) = ( 0.5924674 -0.0266005 -0.2251209), wk = 0.0034483 k( 110) = ( 0.5858626 -0.0151434 -0.2032595), wk = 0.0034483 k( 111) = ( 0.5792578 -0.0036862 -0.1813981), wk = 0.0034483 k( 112) = ( 0.5726529 0.0077709 -0.1595366), wk = 0.0034483 k( 113) = ( 0.5660481 0.0192281 -0.1376752), wk = 0.0034483 k( 114) = ( 0.5594433 0.0306852 -0.1158138), wk = 0.0034483 k( 115) = ( 0.5528385 0.0421424 -0.0939523), wk = 0.0034483 k( 116) = ( 0.5462337 0.0535995 -0.0720909), wk = 0.0034483 k( 117) = ( 0.5396289 0.0650567 -0.0502295), wk = 0.0034483 k( 118) = ( 0.5330241 0.0765138 -0.0283680), wk = 0.0034483 k( 119) = ( 0.5264193 0.0879710 -0.0065066), wk = 0.0034483 k( 120) = ( 0.5198144 0.0994281 0.0153548), wk = 0.0034483 k( 121) = ( 0.5132096 0.1108853 0.0372162), wk = 0.0034483 k( 122) = ( 0.5066048 0.1223424 0.0590777), wk = 0.0034483 k( 123) = ( 0.5000000 0.1337996 0.0809391), wk = 0.0034483 k( 124) = ( 0.5000000 0.1337996 0.0809391), wk = 0.0034483 k( 125) = ( 0.4761905 0.1274282 0.0770849), wk = 0.0034483 k( 126) = ( 0.4523810 0.1210568 0.0732306), wk = 0.0034483 k( 127) = ( 0.4285714 0.1146853 0.0693764), wk = 0.0034483 k( 128) = ( 0.4047619 0.1083139 0.0655221), wk = 0.0034483 k( 129) = ( 0.3809524 0.1019425 0.0616679), wk = 0.0034483 k( 130) = ( 0.3571429 0.0955711 0.0578137), wk = 0.0034483 k( 131) = ( 0.3333333 0.0891997 0.0539594), wk = 0.0034483 k( 132) = ( 0.3095238 0.0828283 0.0501052), wk = 0.0034483 k( 133) = ( 0.2857143 0.0764569 0.0462509), wk = 0.0034483 k( 134) = ( 0.2619048 0.0700855 0.0423967), wk = 0.0034483 k( 135) = ( 0.2380952 0.0637141 0.0385424), wk = 0.0034483 k( 136) = ( 0.2142857 0.0573427 0.0346882), wk = 0.0034483 k( 137) = ( 0.1904762 0.0509713 0.0308339), wk = 0.0034483 k( 138) = ( 0.1666667 0.0445999 0.0269797), wk = 0.0034483 k( 139) = ( 0.1428571 0.0382284 0.0231255), wk = 0.0034483 k( 140) = ( 0.1190476 0.0318570 0.0192712), wk = 0.0034483 k( 141) = ( 0.0952381 0.0254856 0.0154170), wk = 0.0034483 k( 142) = ( 0.0714286 0.0191142 0.0115627), wk = 0.0034483 k( 143) = ( 0.0476191 0.0127428 0.0077085), wk = 0.0034483 k( 144) = ( 0.0238095 0.0063714 0.0038542), wk = 0.0034483 k( 145) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034483 k( 146) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034483 k( 147) = ( 0.0065670 -0.0113916 -0.0217363), wk = 0.0034483 k( 148) = ( 0.0131340 -0.0227831 -0.0434726), wk = 0.0034483 k( 149) = ( 0.0197010 -0.0341747 -0.0652089), wk = 0.0034483 k( 150) = ( 0.0262680 -0.0455663 -0.0869452), wk = 0.0034483 k( 151) = ( 0.0328350 -0.0569579 -0.1086815), wk = 0.0034483 k( 152) = ( 0.0394021 -0.0683494 -0.1304178), wk = 0.0034483 k( 153) = ( 0.0459691 -0.0797410 -0.1521541), wk = 0.0034483 k( 154) = ( 0.0525361 -0.0911326 -0.1738904), wk = 0.0034483 k( 155) = ( 0.0591031 -0.1025241 -0.1956267), wk = 0.0034483 k( 156) = ( 0.0656701 -0.1139157 -0.2173630), wk = 0.0034483 k( 157) = ( 0.0722371 -0.1253073 -0.2390993), wk = 0.0034483 k( 158) = ( 0.0788041 -0.1366989 -0.2608356), wk = 0.0034483 k( 159) = ( 0.0853711 -0.1480904 -0.2825719), wk = 0.0034483 k( 160) = ( 0.0919381 -0.1594820 -0.3043082), wk = 0.0034483 k( 161) = ( 0.0985051 -0.1708736 -0.3260445), wk = 0.0034483 k( 162) = ( 0.1050722 -0.1822652 -0.3477808), wk = 0.0034483 k( 163) = ( 0.1116392 -0.1936567 -0.3695171), wk = 0.0034483 k( 164) = ( 0.1182062 -0.2050483 -0.3912534), wk = 0.0034483 k( 165) = ( 0.1247732 -0.2164399 -0.4129898), wk = 0.0034483 k( 166) = ( 0.1313402 -0.2278315 -0.4347261), wk = 0.0034483 k( 167) = ( 0.1379072 -0.2392230 -0.4564624), wk = 0.0034483 k( 168) = ( 0.1444742 -0.2506146 -0.4781987), wk = 0.0034483 k( 169) = ( 0.1510412 -0.2620062 -0.4999350), wk = 0.0034483 k( 170) = ( 0.1576082 -0.2733978 -0.5216713), wk = 0.0034483 k( 171) = ( 0.1641752 -0.2847893 -0.5434075), wk = 0.0034483 k( 172) = ( 0.1707422 -0.2961809 -0.5651438), wk = 0.0034483 k( 173) = ( 0.1773093 -0.3075725 -0.5868802), wk = 0.0034483 k( 174) = ( 0.1838763 -0.3189640 -0.6086165), wk = 0.0034483 k( 175) = ( 0.1904433 -0.3303556 -0.6303528), wk = 0.0034483 k( 176) = ( 0.1970103 -0.3417472 -0.6520891), wk = 0.0034483 k( 177) = ( 0.2035773 -0.3531388 -0.6738254), wk = 0.0034483 k( 178) = ( 0.2101443 -0.3645303 -0.6955617), wk = 0.0034483 k( 179) = ( 0.2167113 -0.3759219 -0.7172980), wk = 0.0034483 k( 180) = ( 0.2232783 -0.3873135 -0.7390343), wk = 0.0034483 k( 181) = ( 0.2298453 -0.3987051 -0.7607706), wk = 0.0034483 k( 182) = ( 0.2364123 -0.4100966 -0.7825069), wk = 0.0034483 k( 183) = ( 0.2429794 -0.4214882 -0.8042432), wk = 0.0034483 k( 184) = ( 0.2495464 -0.4328798 -0.8259795), wk = 0.0034483 k( 185) = ( 0.2561134 -0.4442714 -0.8477158), wk = 0.0034483 k( 186) = ( 0.2626804 -0.4556629 -0.8694521), wk = 0.0034483 k( 187) = ( 0.2692474 -0.4670545 -0.8911884), wk = 0.0034483 k( 188) = ( 0.2758144 -0.4784461 -0.9129247), wk = 0.0034483 k( 189) = ( 0.2823814 -0.4898376 -0.9346610), wk = 0.0034483 k( 190) = ( 0.2889484 -0.5012292 -0.9563973), wk = 0.0034483 k( 191) = ( 0.2955154 -0.5126208 -0.9781336), wk = 0.0034483 k( 192) = ( 0.3020824 -0.5240124 -0.9998699), wk = 0.0034483 k( 193) = ( 0.3086494 -0.5354039 -1.0216062), wk = 0.0034483 k( 194) = ( 0.3152164 -0.5467955 -1.0433425), wk = 0.0034483 k( 195) = ( 0.3217835 -0.5581871 -1.0650788), wk = 0.0034483 k( 196) = ( 0.3283505 -0.5695787 -1.0868151), wk = 0.0034483 k( 197) = ( 0.3349175 -0.5809702 -1.1085514), wk = 0.0034483 k( 198) = ( 0.3414845 -0.5923618 -1.1302877), wk = 0.0034483 k( 199) = ( 0.6585155 -0.4585622 -1.0493486), wk = 0.0034483 k( 200) = ( 0.6519107 -0.4338805 -1.0493486), wk = 0.0034483 k( 201) = ( 0.6453059 -0.4091988 -1.0493486), wk = 0.0034483 k( 202) = ( 0.6387011 -0.3845170 -1.0493486), wk = 0.0034483 k( 203) = ( 0.6320963 -0.3598353 -1.0493486), wk = 0.0034483 k( 204) = ( 0.6254914 -0.3351535 -1.0493486), wk = 0.0034483 k( 205) = ( 0.6188866 -0.3104718 -1.0493486), wk = 0.0034483 k( 206) = ( 0.6122818 -0.2857900 -1.0493486), wk = 0.0034483 k( 207) = ( 0.6056770 -0.2611083 -1.0493486), wk = 0.0034483 k( 208) = ( 0.5990722 -0.2364265 -1.0493486), wk = 0.0034483 k( 209) = ( 0.5924674 -0.2117448 -1.0493486), wk = 0.0034483 k( 210) = ( 0.5858626 -0.1870631 -1.0493486), wk = 0.0034483 k( 211) = ( 0.5792578 -0.1623813 -1.0493486), wk = 0.0034483 k( 212) = ( 0.5726529 -0.1376996 -1.0493486), wk = 0.0034483 k( 213) = ( 0.5660481 -0.1130178 -1.0493486), wk = 0.0034483 k( 214) = ( 0.5594433 -0.0883361 -1.0493486), wk = 0.0034483 k( 215) = ( 0.5528385 -0.0636543 -1.0493486), wk = 0.0034483 k( 216) = ( 0.5462337 -0.0389726 -1.0493486), wk = 0.0034483 k( 217) = ( 0.5396289 -0.0142909 -1.0493486), wk = 0.0034483 k( 218) = ( 0.5330241 0.0103909 -1.0493486), wk = 0.0034483 k( 219) = ( 0.5264193 0.0350726 -1.0493486), wk = 0.0034483 k( 220) = ( 0.5198144 0.0597543 -1.0493486), wk = 0.0034483 k( 221) = ( 0.5132096 0.0844361 -1.0493486), wk = 0.0034483 k( 222) = ( 0.5066048 0.1091178 -1.0493486), wk = 0.0034483 k( 223) = ( 0.5000000 0.1337996 -1.0493486), wk = 0.0034483 k( 224) = ( 0.5000000 0.1337996 -1.0493486), wk = 0.0034483 k( 225) = ( 0.5198144 0.1391019 -1.0392312), wk = 0.0034483 k( 226) = ( 0.5396289 0.1444042 -1.0291138), wk = 0.0034483 k( 227) = ( 0.5594433 0.1497066 -1.0189964), wk = 0.0034483 k( 228) = ( 0.5792578 0.1550089 -1.0088791), wk = 0.0034483 k( 229) = ( 0.5990722 0.1603112 -0.9987617), wk = 0.0034483 k( 230) = ( 0.6188866 0.1656135 -0.9886443), wk = 0.0034483 k( 231) = ( 0.6387011 0.1709159 -0.9785269), wk = 0.0034483 k( 232) = ( 0.6585155 0.1762182 -0.9684095), wk = 0.0034483 k( 233) = ( 0.6585155 0.1762182 -0.9684095), wk = 0.0034483 k( 234) = ( 0.6547413 0.1752082 -0.9434250), wk = 0.0034483 k( 235) = ( 0.6509672 0.1741983 -0.9184405), wk = 0.0034483 k( 236) = ( 0.6471930 0.1731883 -0.8934560), wk = 0.0034483 k( 237) = ( 0.6434188 0.1721783 -0.8684715), wk = 0.0034483 k( 238) = ( 0.6396446 0.1711684 -0.8434870), wk = 0.0034483 k( 239) = ( 0.6358704 0.1701584 -0.8185026), wk = 0.0034483 k( 240) = ( 0.6320963 0.1691484 -0.7935181), wk = 0.0034483 k( 241) = ( 0.6283221 0.1681385 -0.7685336), wk = 0.0034483 k( 242) = ( 0.6245479 0.1671285 -0.7435491), wk = 0.0034483 k( 243) = ( 0.6207737 0.1661185 -0.7185646), wk = 0.0034483 k( 244) = ( 0.6169995 0.1651085 -0.6935801), wk = 0.0034483 k( 245) = ( 0.6132254 0.1640986 -0.6685956), wk = 0.0034483 k( 246) = ( 0.6094512 0.1630886 -0.6436111), wk = 0.0034483 k( 247) = ( 0.6056770 0.1620786 -0.6186266), wk = 0.0034483 k( 248) = ( 0.6019028 0.1610687 -0.5936421), wk = 0.0034483 k( 249) = ( 0.5981287 0.1600587 -0.5686576), wk = 0.0034483 k( 250) = ( 0.5943545 0.1590487 -0.5436731), wk = 0.0034483 k( 251) = ( 0.5905803 0.1580388 -0.5186886), wk = 0.0034483 k( 252) = ( 0.5868061 0.1570288 -0.4937042), wk = 0.0034483 k( 253) = ( 0.5830319 0.1560188 -0.4687197), wk = 0.0034483 k( 254) = ( 0.5792578 0.1550089 -0.4437352), wk = 0.0034483 k( 255) = ( 0.5754836 0.1539989 -0.4187507), wk = 0.0034483 k( 256) = ( 0.5717094 0.1529889 -0.3937662), wk = 0.0034483 k( 257) = ( 0.5679352 0.1519790 -0.3687817), wk = 0.0034483 k( 258) = ( 0.5641610 0.1509690 -0.3437972), wk = 0.0034483 k( 259) = ( 0.5603869 0.1499590 -0.3188127), wk = 0.0034483 k( 260) = ( 0.5566127 0.1489491 -0.2938283), wk = 0.0034483 k( 261) = ( 0.5528385 0.1479391 -0.2688438), wk = 0.0034483 k( 262) = ( 0.5490643 0.1469291 -0.2438593), wk = 0.0034483 k( 263) = ( 0.5452902 0.1459192 -0.2188748), wk = 0.0034483 k( 264) = ( 0.5415160 0.1449092 -0.1938903), wk = 0.0034483 k( 265) = ( 0.5377418 0.1438992 -0.1689058), wk = 0.0034483 k( 266) = ( 0.5339676 0.1428893 -0.1439213), wk = 0.0034483 k( 267) = ( 0.5301934 0.1418793 -0.1189368), wk = 0.0034483 k( 268) = ( 0.5264193 0.1408693 -0.0939523), wk = 0.0034483 k( 269) = ( 0.5226451 0.1398594 -0.0689678), wk = 0.0034483 k( 270) = ( 0.5188709 0.1388494 -0.0439833), wk = 0.0034483 k( 271) = ( 0.5150967 0.1378394 -0.0189989), wk = 0.0034483 k( 272) = ( 0.5113225 0.1368295 0.0059856), wk = 0.0034483 k( 273) = ( 0.5075484 0.1358195 0.0309701), wk = 0.0034483 k( 274) = ( 0.5037742 0.1348095 0.0559546), wk = 0.0034483 k( 275) = ( 0.5000000 0.1337996 0.0809391), wk = 0.0034483 k( 276) = ( 0.5000000 -0.8673334 -0.5246743), wk = 0.0034483 k( 277) = ( 0.5226451 -0.8577763 -0.5188929), wk = 0.0034483 k( 278) = ( 0.5452902 -0.8482192 -0.5131116), wk = 0.0034483 k( 279) = ( 0.5679352 -0.8386621 -0.5073302), wk = 0.0034483 k( 280) = ( 0.5905803 -0.8291049 -0.5015488), wk = 0.0034483 k( 281) = ( 0.6132254 -0.8195478 -0.4957675), wk = 0.0034483 k( 282) = ( 0.6358704 -0.8099907 -0.4899861), wk = 0.0034483 k( 283) = ( 0.6585155 -0.8004336 -0.4842048), wk = 0.0034483 k( 284) = ( 0.6811606 -0.7908765 -0.4784234), wk = 0.0034483 k( 285) = ( 0.7038057 -0.7813194 -0.4726420), wk = 0.0034483 k( 286) = ( 0.7264507 -0.7717623 -0.4668607), wk = 0.0034483 k( 287) = ( 0.7490958 -0.7622052 -0.4610793), wk = 0.0034483 k( 288) = ( 0.7717409 -0.7526481 -0.4552979), wk = 0.0034483 k( 289) = ( 0.7943860 -0.7430909 -0.4495166), wk = 0.0034483 k( 290) = ( 0.8170310 -0.7335338 -0.4437352), wk = 0.0034483 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034483 k( 2) = ( 0.0113636 0.0000000 -0.0000000), wk = 0.0034483 k( 3) = ( 0.0227273 0.0000000 0.0000000), wk = 0.0034483 k( 4) = ( 0.0340909 0.0000000 0.0000000), wk = 0.0034483 k( 5) = ( 0.0454546 0.0000000 -0.0000000), wk = 0.0034483 k( 6) = ( 0.0568182 0.0000000 -0.0000000), wk = 0.0034483 k( 7) = ( 0.0681818 0.0000000 0.0000000), wk = 0.0034483 k( 8) = ( 0.0795455 -0.0000000 -0.0000000), wk = 0.0034483 k( 9) = ( 0.0909091 0.0000000 -0.0000000), wk = 0.0034483 k( 10) = ( 0.1022727 -0.0000000 -0.0000000), wk = 0.0034483 k( 11) = ( 0.1136364 0.0000000 -0.0000000), wk = 0.0034483 k( 12) = ( 0.1250000 0.0000000 -0.0000000), wk = 0.0034483 k( 13) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0034483 k( 14) = ( 0.1477273 0.0000000 -0.0000000), wk = 0.0034483 k( 15) = ( 0.1590909 0.0000000 -0.0000000), wk = 0.0034483 k( 16) = ( 0.1704546 0.0000000 -0.0000000), wk = 0.0034483 k( 17) = ( 0.1818182 0.0000000 -0.0000000), wk = 0.0034483 k( 18) = ( 0.1931818 0.0000000 0.0000000), wk = 0.0034483 k( 19) = ( 0.2045454 0.0000000 -0.0000000), wk = 0.0034483 k( 20) = ( 0.2159091 0.0000000 -0.0000000), wk = 0.0034483 k( 21) = ( 0.2272727 0.0000000 0.0000000), wk = 0.0034483 k( 22) = ( 0.2386364 0.0000000 -0.0000000), wk = 0.0034483 k( 23) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0034483 k( 24) = ( 0.2613636 0.0000000 -0.0000000), wk = 0.0034483 k( 25) = ( 0.2727273 0.0000000 0.0000000), wk = 0.0034483 k( 26) = ( 0.2840909 0.0000000 -0.0000000), wk = 0.0034483 k( 27) = ( 0.2954545 0.0000000 -0.0000000), wk = 0.0034483 k( 28) = ( 0.3068182 -0.0000000 -0.0000000), wk = 0.0034483 k( 29) = ( 0.3181818 0.0000000 -0.0000000), wk = 0.0034483 k( 30) = ( 0.3295455 0.0000000 -0.0000000), wk = 0.0034483 k( 31) = ( 0.3409091 0.0000000 0.0000000), wk = 0.0034483 k( 32) = ( 0.3522727 0.0000000 -0.0000000), wk = 0.0034483 k( 33) = ( 0.3636364 0.0000000 -0.0000000), wk = 0.0034483 k( 34) = ( 0.3750000 0.0000000 -0.0000000), wk = 0.0034483 k( 35) = ( 0.3863636 0.0000000 0.0000000), wk = 0.0034483 k( 36) = ( 0.3977273 0.0000000 -0.0000000), wk = 0.0034483 k( 37) = ( 0.4090909 -0.0000000 -0.0000000), wk = 0.0034483 k( 38) = ( 0.4204545 0.0000000 -0.0000000), wk = 0.0034483 k( 39) = ( 0.4318182 0.0000000 -0.0000000), wk = 0.0034483 k( 40) = ( 0.4431818 0.0000000 -0.0000000), wk = 0.0034483 k( 41) = ( 0.4545455 0.0000000 0.0000000), wk = 0.0034483 k( 42) = ( 0.4659091 0.0000000 0.0000000), wk = 0.0034483 k( 43) = ( 0.4772727 0.0000000 -0.0000000), wk = 0.0034483 k( 44) = ( 0.4886364 0.0000000 0.0000000), wk = 0.0034483 k( 45) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0034483 k( 46) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0034483 k( 47) = ( 0.5000000 0.0065346 -0.0065346), wk = 0.0034483 k( 48) = ( 0.5000000 0.0130692 -0.0130692), wk = 0.0034483 k( 49) = ( 0.5000000 0.0196038 -0.0196038), wk = 0.0034483 k( 50) = ( 0.5000000 0.0261384 -0.0261384), wk = 0.0034483 k( 51) = ( 0.5000000 0.0326730 -0.0326730), wk = 0.0034483 k( 52) = ( 0.5000000 0.0392076 -0.0392076), wk = 0.0034483 k( 53) = ( 0.5000000 0.0457422 -0.0457422), wk = 0.0034483 k( 54) = ( 0.5000000 0.0522769 -0.0522769), wk = 0.0034483 k( 55) = ( 0.5000000 0.0588115 -0.0588115), wk = 0.0034483 k( 56) = ( 0.5000000 0.0653461 -0.0653461), wk = 0.0034483 k( 57) = ( 0.5000000 0.0718807 -0.0718807), wk = 0.0034483 k( 58) = ( 0.5000000 0.0784153 -0.0784153), wk = 0.0034483 k( 59) = ( 0.5000000 0.0849499 -0.0849499), wk = 0.0034483 k( 60) = ( 0.5000000 0.0914845 -0.0914845), wk = 0.0034483 k( 61) = ( 0.5000000 0.0980191 -0.0980191), wk = 0.0034483 k( 62) = ( 0.5000000 0.1045537 -0.1045537), wk = 0.0034483 k( 63) = ( 0.5000000 0.1110883 -0.1110883), wk = 0.0034483 k( 64) = ( 0.5000000 0.1176229 -0.1176229), wk = 0.0034483 k( 65) = ( 0.5000000 0.1241575 -0.1241575), wk = 0.0034483 k( 66) = ( 0.5000000 0.1306921 -0.1306921), wk = 0.0034483 k( 67) = ( 0.5000000 0.1372267 -0.1372267), wk = 0.0034483 k( 68) = ( 0.5000000 0.1437613 -0.1437613), wk = 0.0034483 k( 69) = ( 0.5000000 0.1502960 -0.1502960), wk = 0.0034483 k( 70) = ( 0.5000000 0.1568306 -0.1568306), wk = 0.0034483 k( 71) = ( 0.5000000 0.1633652 -0.1633652), wk = 0.0034483 k( 72) = ( 0.5000000 0.1698998 -0.1698998), wk = 0.0034483 k( 73) = ( 0.5000000 0.1764344 -0.1764344), wk = 0.0034483 k( 74) = ( 0.5000000 0.1829690 -0.1829690), wk = 0.0034483 k( 75) = ( 0.8170310 0.5000000 0.1829690), wk = 0.0034483 k( 76) = ( 0.8104262 0.5000000 0.1895738), wk = 0.0034483 k( 77) = ( 0.8038214 0.5000000 0.1961786), wk = 0.0034483 k( 78) = ( 0.7972166 0.5000000 0.2027834), wk = 0.0034483 k( 79) = ( 0.7906118 0.5000000 0.2093882), wk = 0.0034483 k( 80) = ( 0.7840070 0.5000000 0.2159930), wk = 0.0034483 k( 81) = ( 0.7774021 0.5000000 0.2225979), wk = 0.0034483 k( 82) = ( 0.7707973 0.5000000 0.2292027), wk = 0.0034483 k( 83) = ( 0.7641925 0.5000000 0.2358075), wk = 0.0034483 k( 84) = ( 0.7575877 0.5000000 0.2424123), wk = 0.0034483 k( 85) = ( 0.7509829 0.5000000 0.2490171), wk = 0.0034483 k( 86) = ( 0.7443781 0.5000000 0.2556219), wk = 0.0034483 k( 87) = ( 0.7377733 0.5000000 0.2622267), wk = 0.0034483 k( 88) = ( 0.7311684 0.5000000 0.2688315), wk = 0.0034483 k( 89) = ( 0.7245636 0.5000000 0.2754364), wk = 0.0034483 k( 90) = ( 0.7179588 0.5000000 0.2820412), wk = 0.0034483 k( 91) = ( 0.7113540 0.5000000 0.2886460), wk = 0.0034483 k( 92) = ( 0.7047492 0.5000000 0.2952508), wk = 0.0034483 k( 93) = ( 0.6981444 0.5000000 0.3018556), wk = 0.0034483 k( 94) = ( 0.6915396 0.5000000 0.3084604), wk = 0.0034483 k( 95) = ( 0.6849348 0.5000000 0.3150652), wk = 0.0034483 k( 96) = ( 0.6783299 0.5000000 0.3216700), wk = 0.0034483 k( 97) = ( 0.6717251 0.5000000 0.3282749), wk = 0.0034483 k( 98) = ( 0.6651203 0.5000000 0.3348797), wk = 0.0034483 k( 99) = ( 0.6585155 0.5000000 0.3414845), wk = 0.0034483 k( 100) = ( 0.6519107 0.5000000 0.3480893), wk = 0.0034483 k( 101) = ( 0.6453059 0.5000000 0.3546941), wk = 0.0034483 k( 102) = ( 0.6387011 0.5000000 0.3612989), wk = 0.0034483 k( 103) = ( 0.6320963 0.5000000 0.3679037), wk = 0.0034483 k( 104) = ( 0.6254914 0.5000000 0.3745085), wk = 0.0034483 k( 105) = ( 0.6188866 0.5000000 0.3811134), wk = 0.0034483 k( 106) = ( 0.6122818 0.5000000 0.3877182), wk = 0.0034483 k( 107) = ( 0.6056770 0.5000000 0.3943230), wk = 0.0034483 k( 108) = ( 0.5990722 0.5000000 0.4009278), wk = 0.0034483 k( 109) = ( 0.5924674 0.5000000 0.4075326), wk = 0.0034483 k( 110) = ( 0.5858626 0.5000000 0.4141374), wk = 0.0034483 k( 111) = ( 0.5792578 0.5000000 0.4207422), wk = 0.0034483 k( 112) = ( 0.5726529 0.5000000 0.4273471), wk = 0.0034483 k( 113) = ( 0.5660481 0.5000000 0.4339519), wk = 0.0034483 k( 114) = ( 0.5594433 0.5000000 0.4405567), wk = 0.0034483 k( 115) = ( 0.5528385 0.5000000 0.4471615), wk = 0.0034483 k( 116) = ( 0.5462337 0.5000000 0.4537663), wk = 0.0034483 k( 117) = ( 0.5396289 0.5000000 0.4603711), wk = 0.0034483 k( 118) = ( 0.5330241 0.5000000 0.4669759), wk = 0.0034483 k( 119) = ( 0.5264193 0.5000000 0.4735807), wk = 0.0034483 k( 120) = ( 0.5198144 0.5000000 0.4801856), wk = 0.0034483 k( 121) = ( 0.5132096 0.5000000 0.4867904), wk = 0.0034483 k( 122) = ( 0.5066048 0.5000000 0.4933952), wk = 0.0034483 k( 123) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034483 k( 124) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034483 k( 125) = ( 0.4761905 0.4761905 0.4761905), wk = 0.0034483 k( 126) = ( 0.4523810 0.4523810 0.4523810), wk = 0.0034483 k( 127) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0034483 k( 128) = ( 0.4047619 0.4047619 0.4047619), wk = 0.0034483 k( 129) = ( 0.3809524 0.3809524 0.3809524), wk = 0.0034483 k( 130) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0034483 k( 131) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0034483 k( 132) = ( 0.3095238 0.3095238 0.3095238), wk = 0.0034483 k( 133) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0034483 k( 134) = ( 0.2619048 0.2619048 0.2619048), wk = 0.0034483 k( 135) = ( 0.2380952 0.2380952 0.2380952), wk = 0.0034483 k( 136) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0034483 k( 137) = ( 0.1904762 0.1904762 0.1904762), wk = 0.0034483 k( 138) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0034483 k( 139) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0034483 k( 140) = ( 0.1190476 0.1190476 0.1190476), wk = 0.0034483 k( 141) = ( 0.0952381 0.0952381 0.0952381), wk = 0.0034483 k( 142) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0034483 k( 143) = ( 0.0476191 0.0476191 0.0476191), wk = 0.0034483 k( 144) = ( 0.0238095 0.0238095 0.0238095), wk = 0.0034483 k( 145) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034483 k( 146) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034483 k( 147) = ( 0.0065670 0.0000000 -0.0065670), wk = 0.0034483 k( 148) = ( 0.0131340 0.0000000 -0.0131340), wk = 0.0034483 k( 149) = ( 0.0197010 0.0000000 -0.0197010), wk = 0.0034483 k( 150) = ( 0.0262680 0.0000000 -0.0262680), wk = 0.0034483 k( 151) = ( 0.0328350 0.0000000 -0.0328350), wk = 0.0034483 k( 152) = ( 0.0394021 0.0000000 -0.0394021), wk = 0.0034483 k( 153) = ( 0.0459691 0.0000000 -0.0459691), wk = 0.0034483 k( 154) = ( 0.0525361 0.0000000 -0.0525361), wk = 0.0034483 k( 155) = ( 0.0591031 0.0000000 -0.0591031), wk = 0.0034483 k( 156) = ( 0.0656701 0.0000000 -0.0656701), wk = 0.0034483 k( 157) = ( 0.0722371 0.0000000 -0.0722371), wk = 0.0034483 k( 158) = ( 0.0788041 0.0000000 -0.0788041), wk = 0.0034483 k( 159) = ( 0.0853711 0.0000000 -0.0853711), wk = 0.0034483 k( 160) = ( 0.0919381 0.0000000 -0.0919381), wk = 0.0034483 k( 161) = ( 0.0985051 0.0000000 -0.0985051), wk = 0.0034483 k( 162) = ( 0.1050722 0.0000000 -0.1050722), wk = 0.0034483 k( 163) = ( 0.1116392 0.0000000 -0.1116392), wk = 0.0034483 k( 164) = ( 0.1182062 0.0000000 -0.1182062), wk = 0.0034483 k( 165) = ( 0.1247732 0.0000000 -0.1247732), wk = 0.0034483 k( 166) = ( 0.1313402 0.0000000 -0.1313402), wk = 0.0034483 k( 167) = ( 0.1379072 0.0000000 -0.1379072), wk = 0.0034483 k( 168) = ( 0.1444742 -0.0000000 -0.1444742), wk = 0.0034483 k( 169) = ( 0.1510412 0.0000000 -0.1510412), wk = 0.0034483 k( 170) = ( 0.1576082 0.0000000 -0.1576082), wk = 0.0034483 k( 171) = ( 0.1641752 0.0000000 -0.1641752), wk = 0.0034483 k( 172) = ( 0.1707422 0.0000000 -0.1707422), wk = 0.0034483 k( 173) = ( 0.1773093 0.0000000 -0.1773093), wk = 0.0034483 k( 174) = ( 0.1838763 0.0000000 -0.1838763), wk = 0.0034483 k( 175) = ( 0.1904433 0.0000000 -0.1904433), wk = 0.0034483 k( 176) = ( 0.1970103 0.0000000 -0.1970103), wk = 0.0034483 k( 177) = ( 0.2035773 0.0000000 -0.2035773), wk = 0.0034483 k( 178) = ( 0.2101443 0.0000000 -0.2101443), wk = 0.0034483 k( 179) = ( 0.2167113 0.0000000 -0.2167113), wk = 0.0034483 k( 180) = ( 0.2232783 0.0000000 -0.2232783), wk = 0.0034483 k( 181) = ( 0.2298453 0.0000000 -0.2298453), wk = 0.0034483 k( 182) = ( 0.2364123 0.0000000 -0.2364123), wk = 0.0034483 k( 183) = ( 0.2429794 0.0000000 -0.2429794), wk = 0.0034483 k( 184) = ( 0.2495464 0.0000000 -0.2495464), wk = 0.0034483 k( 185) = ( 0.2561134 0.0000000 -0.2561134), wk = 0.0034483 k( 186) = ( 0.2626804 0.0000000 -0.2626804), wk = 0.0034483 k( 187) = ( 0.2692474 0.0000000 -0.2692474), wk = 0.0034483 k( 188) = ( 0.2758144 0.0000000 -0.2758144), wk = 0.0034483 k( 189) = ( 0.2823814 0.0000000 -0.2823814), wk = 0.0034483 k( 190) = ( 0.2889484 0.0000000 -0.2889484), wk = 0.0034483 k( 191) = ( 0.2955154 -0.0000000 -0.2955154), wk = 0.0034483 k( 192) = ( 0.3020824 0.0000000 -0.3020824), wk = 0.0034483 k( 193) = ( 0.3086494 0.0000000 -0.3086494), wk = 0.0034483 k( 194) = ( 0.3152164 0.0000000 -0.3152164), wk = 0.0034483 k( 195) = ( 0.3217835 0.0000000 -0.3217835), wk = 0.0034483 k( 196) = ( 0.3283505 0.0000000 -0.3283505), wk = 0.0034483 k( 197) = ( 0.3349175 0.0000000 -0.3349175), wk = 0.0034483 k( 198) = ( 0.3414845 0.0000000 -0.3414845), wk = 0.0034483 k( 199) = ( 0.6585155 0.3414845 0.0000000), wk = 0.0034483 k( 200) = ( 0.6519107 0.3480893 0.0000000), wk = 0.0034483 k( 201) = ( 0.6453059 0.3546941 -0.0000000), wk = 0.0034483 k( 202) = ( 0.6387011 0.3612989 -0.0000000), wk = 0.0034483 k( 203) = ( 0.6320963 0.3679037 0.0000000), wk = 0.0034483 k( 204) = ( 0.6254914 0.3745086 0.0000000), wk = 0.0034483 k( 205) = ( 0.6188866 0.3811134 0.0000000), wk = 0.0034483 k( 206) = ( 0.6122818 0.3877182 0.0000000), wk = 0.0034483 k( 207) = ( 0.6056770 0.3943230 -0.0000000), wk = 0.0034483 k( 208) = ( 0.5990722 0.4009278 0.0000000), wk = 0.0034483 k( 209) = ( 0.5924674 0.4075326 0.0000000), wk = 0.0034483 k( 210) = ( 0.5858626 0.4141374 -0.0000000), wk = 0.0034483 k( 211) = ( 0.5792578 0.4207422 -0.0000000), wk = 0.0034483 k( 212) = ( 0.5726529 0.4273471 -0.0000000), wk = 0.0034483 k( 213) = ( 0.5660481 0.4339519 -0.0000000), wk = 0.0034483 k( 214) = ( 0.5594433 0.4405567 -0.0000000), wk = 0.0034483 k( 215) = ( 0.5528385 0.4471615 -0.0000000), wk = 0.0034483 k( 216) = ( 0.5462337 0.4537663 -0.0000000), wk = 0.0034483 k( 217) = ( 0.5396289 0.4603711 -0.0000000), wk = 0.0034483 k( 218) = ( 0.5330241 0.4669759 -0.0000000), wk = 0.0034483 k( 219) = ( 0.5264193 0.4735808 -0.0000000), wk = 0.0034483 k( 220) = ( 0.5198144 0.4801856 -0.0000000), wk = 0.0034483 k( 221) = ( 0.5132096 0.4867904 -0.0000000), wk = 0.0034483 k( 222) = ( 0.5066048 0.4933952 -0.0000000), wk = 0.0034483 k( 223) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0034483 k( 224) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0034483 k( 225) = ( 0.5198144 0.5198144 0.0228711), wk = 0.0034483 k( 226) = ( 0.5396289 0.5396289 0.0457422), wk = 0.0034483 k( 227) = ( 0.5594433 0.5594433 0.0686134), wk = 0.0034483 k( 228) = ( 0.5792578 0.5792578 0.0914845), wk = 0.0034483 k( 229) = ( 0.5990722 0.5990722 0.1143556), wk = 0.0034483 k( 230) = ( 0.6188866 0.6188866 0.1372267), wk = 0.0034483 k( 231) = ( 0.6387011 0.6387011 0.1600979), wk = 0.0034483 k( 232) = ( 0.6585155 0.6585155 0.1829690), wk = 0.0034483 k( 233) = ( 0.6585155 0.6585155 0.1829690), wk = 0.0034483 k( 234) = ( 0.6547413 0.6547413 0.1905173), wk = 0.0034483 k( 235) = ( 0.6509672 0.6509672 0.1980657), wk = 0.0034483 k( 236) = ( 0.6471930 0.6471930 0.2056141), wk = 0.0034483 k( 237) = ( 0.6434188 0.6434188 0.2131624), wk = 0.0034483 k( 238) = ( 0.6396446 0.6396446 0.2207108), wk = 0.0034483 k( 239) = ( 0.6358704 0.6358704 0.2282591), wk = 0.0034483 k( 240) = ( 0.6320963 0.6320963 0.2358075), wk = 0.0034483 k( 241) = ( 0.6283221 0.6283221 0.2433558), wk = 0.0034483 k( 242) = ( 0.6245479 0.6245479 0.2509042), wk = 0.0034483 k( 243) = ( 0.6207737 0.6207737 0.2584526), wk = 0.0034483 k( 244) = ( 0.6169995 0.6169995 0.2660009), wk = 0.0034483 k( 245) = ( 0.6132254 0.6132254 0.2735493), wk = 0.0034483 k( 246) = ( 0.6094512 0.6094512 0.2810976), wk = 0.0034483 k( 247) = ( 0.6056770 0.6056770 0.2886460), wk = 0.0034483 k( 248) = ( 0.6019028 0.6019028 0.2961943), wk = 0.0034483 k( 249) = ( 0.5981287 0.5981287 0.3037427), wk = 0.0034483 k( 250) = ( 0.5943545 0.5943545 0.3112911), wk = 0.0034483 k( 251) = ( 0.5905803 0.5905803 0.3188394), wk = 0.0034483 k( 252) = ( 0.5868061 0.5868061 0.3263878), wk = 0.0034483 k( 253) = ( 0.5830319 0.5830319 0.3339361), wk = 0.0034483 k( 254) = ( 0.5792578 0.5792578 0.3414845), wk = 0.0034483 k( 255) = ( 0.5754836 0.5754836 0.3490329), wk = 0.0034483 k( 256) = ( 0.5717094 0.5717094 0.3565812), wk = 0.0034483 k( 257) = ( 0.5679352 0.5679352 0.3641296), wk = 0.0034483 k( 258) = ( 0.5641610 0.5641610 0.3716779), wk = 0.0034483 k( 259) = ( 0.5603869 0.5603869 0.3792263), wk = 0.0034483 k( 260) = ( 0.5566127 0.5566127 0.3867746), wk = 0.0034483 k( 261) = ( 0.5528385 0.5528385 0.3943230), wk = 0.0034483 k( 262) = ( 0.5490643 0.5490643 0.4018713), wk = 0.0034483 k( 263) = ( 0.5452902 0.5452902 0.4094197), wk = 0.0034483 k( 264) = ( 0.5415160 0.5415160 0.4169681), wk = 0.0034483 k( 265) = ( 0.5377418 0.5377418 0.4245164), wk = 0.0034483 k( 266) = ( 0.5339676 0.5339676 0.4320648), wk = 0.0034483 k( 267) = ( 0.5301934 0.5301934 0.4396131), wk = 0.0034483 k( 268) = ( 0.5264193 0.5264193 0.4471615), wk = 0.0034483 k( 269) = ( 0.5226451 0.5226451 0.4547099), wk = 0.0034483 k( 270) = ( 0.5188709 0.5188709 0.4622582), wk = 0.0034483 k( 271) = ( 0.5150967 0.5150967 0.4698066), wk = 0.0034483 k( 272) = ( 0.5113225 0.5113225 0.4773549), wk = 0.0034483 k( 273) = ( 0.5075484 0.5075484 0.4849033), wk = 0.0034483 k( 274) = ( 0.5037742 0.5037742 0.4924516), wk = 0.0034483 k( 275) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034483 k( 276) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0034483 k( 277) = ( 0.5226451 0.0243918 0.0243917), wk = 0.0034483 k( 278) = ( 0.5452902 0.0487835 0.0487835), wk = 0.0034483 k( 279) = ( 0.5679352 0.0731753 0.0731752), wk = 0.0034483 k( 280) = ( 0.5905803 0.0975670 0.0975670), wk = 0.0034483 k( 281) = ( 0.6132254 0.1219588 0.1219587), wk = 0.0034483 k( 282) = ( 0.6358704 0.1463505 0.1463505), wk = 0.0034483 k( 283) = ( 0.6585155 0.1707422 0.1707422), wk = 0.0034483 k( 284) = ( 0.6811606 0.1951340 0.1951340), wk = 0.0034483 k( 285) = ( 0.7038057 0.2195257 0.2195257), wk = 0.0034483 k( 286) = ( 0.7264507 0.2439175 0.2439175), wk = 0.0034483 k( 287) = ( 0.7490958 0.2683092 0.2683092), wk = 0.0034483 k( 288) = ( 0.7717409 0.2927010 0.2927010), wk = 0.0034483 k( 289) = ( 0.7943860 0.3170927 0.3170927), wk = 0.0034483 k( 290) = ( 0.8170310 0.3414845 0.3414845), wk = 0.0034483 Dense grid: 55995 G-vectors FFT dimensions: ( 80, 80, 80) Smooth grid: 32559 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.15 Mb ( 230, 44) NL pseudopotentials 0.17 Mb ( 115, 96) Each V/rho on FFT grid 0.29 Mb ( 19200) Each G-vector array 0.01 Mb ( 1557) G-vector shells 0.01 Mb ( 1279) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.62 Mb ( 230, 176) Each subspace H/S matrix 0.03 Mb ( 44, 44) Each matrix 0.13 Mb ( 96, 2, 44) The potential is recalculated from file : ./YTlSe2.save/charge-density.dat Starting wfc are 60 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.8 secs Computing kpt #: 2 total cpu time spent up to now is 6.4 secs Computing kpt #: 3 total cpu time spent up to now is 6.9 secs Computing kpt #: 4 total cpu time spent up to now is 7.5 secs Computing kpt #: 5 total cpu time spent up to now is 8.0 secs Computing kpt #: 6 total cpu time spent up to now is 8.5 secs Computing kpt #: 7 total cpu time spent up to now is 9.1 secs Computing kpt #: 8 total cpu time spent up to now is 9.6 secs Computing kpt #: 9 total cpu time spent up to now is 10.1 secs Computing kpt #: 10 total cpu time spent up to now is 10.7 secs Computing kpt #: 11 total cpu time spent up to now is 11.2 secs Computing kpt #: 12 total cpu time spent up to now is 11.7 secs Computing kpt #: 13 total cpu time spent up to now is 12.3 secs Computing kpt #: 14 total cpu time spent up to now is 12.9 secs Computing kpt #: 15 total cpu time spent up to now is 13.4 secs Computing kpt #: 16 total cpu time spent up to now is 14.0 secs Computing kpt #: 17 total cpu time spent up to now is 14.6 secs Computing kpt #: 18 total cpu time spent up to now is 15.1 secs Computing kpt #: 19 total cpu time spent up to now is 15.8 secs Computing kpt #: 20 total cpu time spent up to now is 16.4 secs Computing kpt #: 21 total cpu time spent up to now is 17.0 secs Computing kpt #: 22 total cpu time spent up to now is 17.6 secs Computing kpt #: 23 total cpu time spent up to now is 18.2 secs Computing kpt #: 24 total cpu time spent up to now is 18.8 secs Computing kpt #: 25 total cpu time spent up to now is 19.4 secs Computing kpt #: 26 total cpu time spent up to now is 20.0 secs Computing kpt #: 27 total cpu time spent up to now is 20.6 secs Computing kpt #: 28 total cpu time spent up to now is 21.2 secs Computing kpt #: 29 total cpu time spent up to now is 21.8 secs Computing kpt #: 30 total cpu time spent up to now is 22.4 secs Computing kpt #: 31 total cpu time spent up to now is 23.1 secs Computing kpt #: 32 total cpu time spent up to now is 23.8 secs Computing kpt #: 33 total cpu time spent up to now is 24.5 secs Computing kpt #: 34 total cpu time spent up to now is 25.2 secs Computing kpt #: 35 total cpu time spent up to now is 25.9 secs Computing kpt #: 36 total cpu time spent up to now is 26.6 secs Computing kpt #: 37 total cpu time spent up to now is 27.3 secs Computing kpt #: 38 total cpu time spent up to now is 28.0 secs Computing kpt #: 39 total cpu time spent up to now is 28.7 secs Computing kpt #: 40 total cpu time spent up to now is 29.4 secs Computing kpt #: 41 total cpu time spent up to now is 30.1 secs Computing kpt #: 42 total cpu time spent up to now is 30.8 secs Computing kpt #: 43 total cpu time spent up to now is 31.5 secs Computing kpt #: 44 total cpu time spent up to now is 32.1 secs Computing kpt #: 45 total cpu time spent up to now is 32.8 secs Computing kpt #: 46 total cpu time spent up to now is 33.5 secs Computing kpt #: 47 total cpu time spent up to now is 34.2 secs Computing kpt #: 48 total cpu time spent up to now is 34.9 secs Computing kpt #: 49 total cpu time spent up to now is 35.6 secs Computing kpt #: 50 total cpu time spent up to now is 36.3 secs Computing kpt #: 51 total cpu time spent up to now is 37.0 secs Computing kpt #: 52 total cpu time spent up to now is 37.7 secs Computing kpt #: 53 total cpu time spent up to now is 38.4 secs Computing kpt #: 54 total cpu time spent up to now is 39.1 secs Computing kpt #: 55 total cpu time spent up to now is 39.8 secs Computing kpt #: 56 total cpu time spent up to now is 40.5 secs Computing kpt #: 57 total cpu time spent up to now is 41.2 secs Computing kpt #: 58 total cpu time spent up to now is 41.8 secs Computing kpt #: 59 total cpu time spent up to now is 42.5 secs Computing kpt #: 60 total cpu time spent up to now is 43.1 secs Computing kpt #: 61 total cpu time spent up to now is 43.7 secs Computing kpt #: 62 total cpu time spent up to now is 44.4 secs Computing kpt #: 63 total cpu time spent up to now is 45.1 secs Computing kpt #: 64 total cpu time spent up to now is 45.7 secs Computing kpt #: 65 total cpu time spent up to now is 46.3 secs Computing kpt #: 66 total cpu time spent up to now is 47.0 secs Computing kpt #: 67 total cpu time spent up to now is 47.6 secs Computing kpt #: 68 total cpu time spent up to now is 48.2 secs Computing kpt #: 69 total cpu time spent up to now is 48.9 secs Computing kpt #: 70 total cpu time spent up to now is 49.5 secs Computing kpt #: 71 total cpu time spent up to now is 50.1 secs Computing kpt #: 72 total cpu time spent up to now is 50.8 secs Computing kpt #: 73 total cpu time spent up to now is 51.4 secs Computing kpt #: 74 total cpu time spent up to now is 52.0 secs Computing kpt #: 75 total cpu time spent up to now is 52.6 secs Computing kpt #: 76 total cpu time spent up to now is 53.2 secs Computing kpt #: 77 total cpu time spent up to now is 53.8 secs Computing kpt #: 78 total cpu time spent up to now is 54.4 secs Computing kpt #: 79 total cpu time spent up to now is 55.0 secs Computing kpt #: 80 total cpu time spent up to now is 55.7 secs Computing kpt #: 81 total cpu time spent up to now is 56.3 secs Computing kpt #: 82 total cpu time spent up to now is 56.9 secs Computing kpt #: 83 total cpu time spent up to now is 57.5 secs Computing kpt #: 84 total cpu time spent up to now is 58.1 secs Computing kpt #: 85 total cpu time spent up to now is 58.7 secs Computing kpt #: 86 total cpu time spent up to now is 59.3 secs Computing kpt #: 87 total cpu time spent up to now is 59.9 secs Computing kpt #: 88 total cpu time spent up to now is 60.5 secs Computing kpt #: 89 total cpu time spent up to now is 61.0 secs Computing kpt #: 90 total cpu time spent up to now is 61.6 secs Computing kpt #: 91 total cpu time spent up to now is 62.2 secs Computing kpt #: 92 total cpu time spent up to now is 62.8 secs Computing kpt #: 93 total cpu time spent up to now is 63.4 secs Computing kpt #: 94 total cpu time spent up to now is 64.0 secs Computing kpt #: 95 total cpu time spent up to now is 64.6 secs Computing kpt #: 96 total cpu time spent up to now is 65.1 secs Computing kpt #: 97 total cpu time spent up to now is 65.8 secs Computing kpt #: 98 total cpu time spent up to now is 66.4 secs Computing kpt #: 99 total cpu time spent up to now is 67.1 secs Computing kpt #: 100 total cpu time spent up to now is 67.8 secs Computing kpt #: 101 total cpu time spent up to now is 68.5 secs Computing kpt #: 102 total cpu time spent up to now is 69.2 secs Computing kpt #: 103 total cpu time spent up to now is 69.7 secs Computing kpt #: 104 total cpu time spent up to now is 70.3 secs Computing kpt #: 105 total cpu time spent up to now is 70.9 secs Computing kpt #: 106 total cpu time spent up to now is 71.4 secs Computing kpt #: 107 total cpu time spent up to now is 72.0 secs Computing kpt #: 108 total cpu time spent up to now is 72.5 secs Computing kpt #: 109 total cpu time spent up to now is 73.1 secs Computing kpt #: 110 total cpu time spent up to now is 73.7 secs Computing kpt #: 111 total cpu time spent up to now is 74.2 secs Computing kpt #: 112 total cpu time spent up to now is 74.7 secs Computing kpt #: 113 total cpu time spent up to now is 75.3 secs Computing kpt #: 114 total cpu time spent up to now is 75.8 secs Computing kpt #: 115 total cpu time spent up to now is 76.4 secs Computing kpt #: 116 total cpu time spent up to now is 76.9 secs Computing kpt #: 117 total cpu time spent up to now is 77.5 secs Computing kpt #: 118 total cpu time spent up to now is 78.0 secs Computing kpt #: 119 total cpu time spent up to now is 78.5 secs Computing kpt #: 120 total cpu time spent up to now is 79.1 secs Computing kpt #: 121 total cpu time spent up to now is 79.6 secs Computing kpt #: 122 total cpu time spent up to now is 80.1 secs Computing kpt #: 123 total cpu time spent up to now is 80.7 secs Computing kpt #: 124 total cpu time spent up to now is 81.2 secs Computing kpt #: 125 total cpu time spent up to now is 81.8 secs Computing kpt #: 126 total cpu time spent up to now is 82.3 secs Computing kpt #: 127 total cpu time spent up to now is 82.8 secs Computing kpt #: 128 total cpu time spent up to now is 83.4 secs Computing kpt #: 129 total cpu time spent up to now is 83.9 secs Computing kpt #: 130 total cpu time spent up to now is 84.4 secs Computing kpt #: 131 total cpu time spent up to now is 85.0 secs Computing kpt #: 132 total cpu time spent up to now is 85.5 secs Computing kpt #: 133 total cpu time spent up to now is 86.0 secs Computing kpt #: 134 total cpu time spent up to now is 86.6 secs Computing kpt #: 135 total cpu time spent up to now is 87.1 secs Computing kpt #: 136 total cpu time spent up to now is 87.7 secs Computing kpt #: 137 total cpu time spent up to now is 88.2 secs Computing kpt #: 138 total cpu time spent up to now is 88.8 secs Computing kpt #: 139 total cpu time spent up to now is 89.5 secs Computing kpt #: 140 total cpu time spent up to now is 90.3 secs Computing kpt #: 141 total cpu time spent up to now is 90.9 secs Computing kpt #: 142 total cpu time spent up to now is 91.4 secs Computing kpt #: 143 total cpu time spent up to now is 91.9 secs Computing kpt #: 144 total cpu time spent up to now is 92.5 secs Computing kpt #: 145 total cpu time spent up to now is 93.0 secs Computing kpt #: 146 total cpu time spent up to now is 93.5 secs Computing kpt #: 147 total cpu time spent up to now is 94.0 secs Computing kpt #: 148 total cpu time spent up to now is 94.6 secs Computing kpt #: 149 total cpu time spent up to now is 95.1 secs Computing kpt #: 150 total cpu time spent up to now is 95.6 secs Computing kpt #: 151 total cpu time spent up to now is 96.1 secs Computing kpt #: 152 total cpu time spent up to now is 96.7 secs Computing kpt #: 153 total cpu time spent up to now is 97.2 secs Computing kpt #: 154 total cpu time spent up to now is 97.7 secs Computing kpt #: 155 total cpu time spent up to now is 98.3 secs Computing kpt #: 156 total cpu time spent up to now is 98.8 secs Computing kpt #: 157 total cpu time spent up to now is 99.4 secs Computing kpt #: 158 total cpu time spent up to now is 99.9 secs Computing kpt #: 159 total cpu time spent up to now is 100.5 secs Computing kpt #: 160 total cpu time spent up to now is 101.1 secs Computing kpt #: 161 total cpu time spent up to now is 101.7 secs Computing kpt #: 162 total cpu time spent up to now is 102.3 secs Computing kpt #: 163 total cpu time spent up to now is 102.9 secs Computing kpt #: 164 total cpu time spent up to now is 103.5 secs Computing kpt #: 165 total cpu time spent up to now is 104.0 secs Computing kpt #: 166 total cpu time spent up to now is 104.6 secs Computing kpt #: 167 total cpu time spent up to now is 105.2 secs Computing kpt #: 168 total cpu time spent up to now is 105.8 secs Computing kpt #: 169 total cpu time spent up to now is 106.4 secs Computing kpt #: 170 total cpu time spent up to now is 107.0 secs Computing kpt #: 171 total cpu time spent up to now is 107.6 secs Computing kpt #: 172 total cpu time spent up to now is 108.2 secs Computing kpt #: 173 total cpu time spent up to now is 108.9 secs Computing kpt #: 174 total cpu time spent up to now is 109.6 secs Computing kpt #: 175 total cpu time spent up to now is 110.3 secs Computing kpt #: 176 total cpu time spent up to now is 111.0 secs Computing kpt #: 177 total cpu time spent up to now is 111.7 secs Computing kpt #: 178 total cpu time spent up to now is 112.4 secs Computing kpt #: 179 total cpu time spent up to now is 113.1 secs Computing kpt #: 180 total cpu time spent up to now is 114.0 secs Computing kpt #: 181 total cpu time spent up to now is 114.8 secs Computing kpt #: 182 total cpu time spent up to now is 115.5 secs Computing kpt #: 183 total cpu time spent up to now is 116.2 secs Computing kpt #: 184 total cpu time spent up to now is 116.9 secs Computing kpt #: 185 total cpu time spent up to now is 117.6 secs Computing kpt #: 186 total cpu time spent up to now is 118.3 secs Computing kpt #: 187 total cpu time spent up to now is 119.0 secs Computing kpt #: 188 total cpu time spent up to now is 119.6 secs Computing kpt #: 189 total cpu time spent up to now is 120.2 secs Computing kpt #: 190 total cpu time spent up to now is 120.8 secs Computing kpt #: 191 total cpu time spent up to now is 121.4 secs Computing kpt #: 192 total cpu time spent up to now is 122.0 secs Computing kpt #: 193 total cpu time spent up to now is 122.6 secs Computing kpt #: 194 total cpu time spent up to now is 123.2 secs Computing kpt #: 195 total cpu time spent up to now is 123.8 secs Computing kpt #: 196 total cpu time spent up to now is 124.4 secs Computing kpt #: 197 total cpu time spent up to now is 125.0 secs Computing kpt #: 198 total cpu time spent up to now is 125.6 secs Computing kpt #: 199 total cpu time spent up to now is 126.2 secs Computing kpt #: 200 total cpu time spent up to now is 126.8 secs Computing kpt #: 201 total cpu time spent up to now is 127.4 secs Computing kpt #: 202 total cpu time spent up to now is 128.0 secs Computing kpt #: 203 total cpu time spent up to now is 128.6 secs Computing kpt #: 204 total cpu time spent up to now is 129.2 secs Computing kpt #: 205 total cpu time spent up to now is 129.8 secs Computing kpt #: 206 total cpu time spent up to now is 130.5 secs Computing kpt #: 207 total cpu time spent up to now is 131.1 secs Computing kpt #: 208 total cpu time spent up to now is 131.7 secs Computing kpt #: 209 total cpu time spent up to now is 132.3 secs Computing kpt #: 210 total cpu time spent up to now is 132.9 secs Computing kpt #: 211 total cpu time spent up to now is 133.5 secs Computing kpt #: 212 total cpu time spent up to now is 134.1 secs Computing kpt #: 213 total cpu time spent up to now is 134.8 secs Computing kpt #: 214 total cpu time spent up to now is 135.4 secs Computing kpt #: 215 total cpu time spent up to now is 136.0 secs Computing kpt #: 216 total cpu time spent up to now is 136.7 secs Computing kpt #: 217 total cpu time spent up to now is 137.4 secs Computing kpt #: 218 total cpu time spent up to now is 138.1 secs Computing kpt #: 219 total cpu time spent up to now is 138.8 secs Computing kpt #: 220 total cpu time spent up to now is 139.5 secs Computing kpt #: 221 total cpu time spent up to now is 140.2 secs Computing kpt #: 222 total cpu time spent up to now is 141.0 secs Computing kpt #: 223 total cpu time spent up to now is 141.7 secs Computing kpt #: 224 total cpu time spent up to now is 142.4 secs Computing kpt #: 225 total cpu time spent up to now is 143.1 secs Computing kpt #: 226 total cpu time spent up to now is 143.8 secs Computing kpt #: 227 total cpu time spent up to now is 144.6 secs Computing kpt #: 228 total cpu time spent up to now is 145.3 secs Computing kpt #: 229 total cpu time spent up to now is 146.0 secs Computing kpt #: 230 total cpu time spent up to now is 146.7 secs Computing kpt #: 231 total cpu time spent up to now is 147.4 secs Computing kpt #: 232 total cpu time spent up to now is 148.1 secs Computing kpt #: 233 total cpu time spent up to now is 148.8 secs Computing kpt #: 234 total cpu time spent up to now is 149.5 secs Computing kpt #: 235 total cpu time spent up to now is 150.2 secs Computing kpt #: 236 total cpu time spent up to now is 150.9 secs Computing kpt #: 237 total cpu time spent up to now is 151.6 secs Computing kpt #: 238 total cpu time spent up to now is 152.3 secs Computing kpt #: 239 total cpu time spent up to now is 153.0 secs Computing kpt #: 240 total cpu time spent up to now is 153.7 secs Computing kpt #: 241 total cpu time spent up to now is 154.4 secs Computing kpt #: 242 total cpu time spent up to now is 155.1 secs Computing kpt #: 243 total cpu time spent up to now is 155.8 secs Computing kpt #: 244 total cpu time spent up to now is 156.5 secs Computing kpt #: 245 total cpu time spent up to now is 157.2 secs Computing kpt #: 246 total cpu time spent up to now is 157.8 secs Computing kpt #: 247 total cpu time spent up to now is 158.4 secs Computing kpt #: 248 total cpu time spent up to now is 159.0 secs Computing kpt #: 249 total cpu time spent up to now is 159.6 secs Computing kpt #: 250 total cpu time spent up to now is 160.2 secs Computing kpt #: 251 total cpu time spent up to now is 160.8 secs Computing kpt #: 252 total cpu time spent up to now is 161.4 secs Computing kpt #: 253 total cpu time spent up to now is 162.0 secs Computing kpt #: 254 total cpu time spent up to now is 162.5 secs Computing kpt #: 255 total cpu time spent up to now is 163.1 secs Computing kpt #: 256 total cpu time spent up to now is 163.7 secs Computing kpt #: 257 total cpu time spent up to now is 164.3 secs Computing kpt #: 258 total cpu time spent up to now is 164.8 secs Computing kpt #: 259 total cpu time spent up to now is 165.4 secs Computing kpt #: 260 total cpu time spent up to now is 165.9 secs Computing kpt #: 261 total cpu time spent up to now is 166.5 secs Computing kpt #: 262 total cpu time spent up to now is 167.0 secs Computing kpt #: 263 total cpu time spent up to now is 167.5 secs Computing kpt #: 264 total cpu time spent up to now is 168.1 secs Computing kpt #: 265 total cpu time spent up to now is 168.6 secs Computing kpt #: 266 total cpu time spent up to now is 169.2 secs Computing kpt #: 267 total cpu time spent up to now is 169.7 secs Computing kpt #: 268 total cpu time spent up to now is 170.3 secs Computing kpt #: 269 total cpu time spent up to now is 170.8 secs Computing kpt #: 270 total cpu time spent up to now is 171.3 secs Computing kpt #: 271 total cpu time spent up to now is 171.9 secs Computing kpt #: 272 total cpu time spent up to now is 172.4 secs Computing kpt #: 273 total cpu time spent up to now is 172.9 secs Computing kpt #: 274 total cpu time spent up to now is 173.5 secs Computing kpt #: 275 total cpu time spent up to now is 174.0 secs Computing kpt #: 276 total cpu time spent up to now is 174.7 secs Computing kpt #: 277 total cpu time spent up to now is 175.3 secs Computing kpt #: 278 total cpu time spent up to now is 175.9 secs Computing kpt #: 279 total cpu time spent up to now is 176.6 secs Computing kpt #: 280 total cpu time spent up to now is 177.3 secs Computing kpt #: 281 total cpu time spent up to now is 178.0 secs Computing kpt #: 282 total cpu time spent up to now is 178.7 secs Computing kpt #: 283 total cpu time spent up to now is 179.4 secs Computing kpt #: 284 total cpu time spent up to now is 180.0 secs Computing kpt #: 285 total cpu time spent up to now is 180.7 secs Computing kpt #: 286 total cpu time spent up to now is 181.4 secs Computing kpt #: 287 total cpu time spent up to now is 182.1 secs Computing kpt #: 288 total cpu time spent up to now is 182.8 secs Computing kpt #: 289 total cpu time spent up to now is 183.5 secs Computing kpt #: 290 total cpu time spent up to now is 184.2 secs ethr = 2.78E-08, avg # of iterations = 19.3 total cpu time spent up to now is 184.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4147 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5922 -5.5922 -5.1390 -5.1390 -5.0763 -5.0763 -4.8552 -4.8552 -2.9849 -2.9849 -2.9144 -2.9144 -2.9015 -2.9015 0.7489 0.7489 4.6138 4.6138 4.8271 4.8271 4.9076 4.9076 5.3077 5.3077 6.1480 6.1480 6.3955 6.3955 9.3642 9.3642 9.3693 9.3693 9.6923 9.6923 10.1514 10.1514 k = 0.0114-0.0197-0.0119 ( 4134 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0693 -15.0693 -5.5914 -5.5914 -5.1390 -5.1390 -5.0765 -5.0765 -4.8551 -4.8551 -2.9848 -2.9848 -2.9144 -2.9144 -2.9014 -2.9014 0.7501 0.7501 4.6111 4.6111 4.8225 4.8225 4.9037 4.9037 5.3171 5.3171 6.1467 6.1467 6.3933 6.3933 9.3652 9.3652 9.3708 9.3708 9.6950 9.6950 10.1462 10.1462 k = 0.0227-0.0394-0.0238 ( 4130 PWs) bands (ev): -35.5857 -35.5857 -16.5502 -16.5502 -15.1457 -15.1457 -15.0696 -15.0696 -5.5890 -5.5890 -5.1392 -5.1392 -5.0770 -5.0770 -4.8546 -4.8546 -2.9846 -2.9846 -2.9142 -2.9142 -2.9014 -2.9014 0.7537 0.7537 4.6025 4.6025 4.8092 4.8092 4.8942 4.8942 5.3427 5.3427 6.1430 6.1430 6.3870 6.3870 9.3658 9.3658 9.3775 9.3775 9.7032 9.7032 10.1308 10.1308 k = 0.0341-0.0591-0.0358 ( 4120 PWs) bands (ev): -35.5857 -35.5857 -16.5504 -16.5504 -15.1457 -15.1457 -15.0702 -15.0702 -5.5851 -5.5851 -5.1395 -5.1395 -5.0779 -5.0779 -4.8538 -4.8538 -2.9842 -2.9842 -2.9139 -2.9139 -2.9013 -2.9013 0.7598 0.7598 4.5868 4.5868 4.7893 4.7893 4.8830 4.8830 5.3796 5.3796 6.1371 6.1371 6.3767 6.3767 9.3648 9.3648 9.3898 9.3898 9.7173 9.7173 10.1057 10.1057 k = 0.0455-0.0788-0.0477 ( 4120 PWs) bands (ev): -35.5856 -35.5856 -16.5507 -16.5507 -15.1458 -15.1458 -15.0710 -15.0710 -5.5796 -5.5796 -5.1400 -5.1400 -5.0791 -5.0791 -4.8527 -4.8527 -2.9837 -2.9837 -2.9136 -2.9136 -2.9011 -2.9011 0.7682 0.7682 4.5627 4.5627 4.7673 4.7673 4.8717 4.8717 5.4226 5.4226 6.1293 6.1293 6.3629 6.3629 9.3618 9.3618 9.4071 9.4071 9.7377 9.7377 10.0717 10.0717 k = 0.0568-0.0986-0.0596 ( 4121 PWs) bands (ev): -35.5855 -35.5855 -16.5510 -16.5510 -15.1459 -15.1459 -15.0720 -15.0720 -5.5726 -5.5726 -5.1407 -5.1407 -5.0805 -5.0805 -4.8513 -4.8513 -2.9831 -2.9831 -2.9131 -2.9131 -2.9010 -2.9010 0.7789 0.7789 4.5298 4.5298 4.7468 4.7468 4.8603 4.8603 5.4679 5.4679 6.1201 6.1201 6.3459 6.3459 9.3565 9.3565 9.4291 9.4291 9.7644 9.7644 10.0302 10.0302 k = 0.0682-0.1183-0.0715 ( 4113 PWs) bands (ev): -35.5854 -35.5854 -16.5515 -16.5515 -15.1461 -15.1461 -15.0733 -15.0733 -5.5641 -5.5641 -5.1415 -5.1415 -5.0821 -5.0821 -4.8497 -4.8497 -2.9823 -2.9823 -2.9125 -2.9125 -2.9007 -2.9007 0.7919 0.7919 4.4894 4.4894 4.7284 4.7284 4.8487 4.8487 5.5125 5.5125 6.1100 6.1100 6.3264 6.3264 9.3485 9.3485 9.4553 9.4553 9.7970 9.7970 9.9829 9.9829 k = 0.0795-0.1380-0.0835 ( 4106 PWs) bands (ev): -35.5853 -35.5853 -16.5520 -16.5520 -15.1462 -15.1462 -15.0747 -15.0747 -5.5542 -5.5542 -5.1425 -5.1425 -5.0838 -5.0838 -4.8479 -4.8479 -2.9815 -2.9815 -2.9119 -2.9119 -2.9004 -2.9004 0.8071 0.8071 4.4440 4.4440 4.7108 4.7108 4.8375 4.8375 5.5546 5.5546 6.0994 6.0994 6.3050 6.3050 9.3377 9.3377 9.4854 9.4854 9.8330 9.8330 9.9337 9.9337 k = 0.0909-0.1577-0.0954 ( 4110 PWs) bands (ev): -35.5852 -35.5852 -16.5526 -16.5526 -15.1464 -15.1464 -15.0763 -15.0763 -5.5430 -5.5430 -5.1437 -5.1437 -5.0856 -5.0856 -4.8459 -4.8459 -2.9805 -2.9805 -2.9113 -2.9113 -2.9001 -2.9001 0.8245 0.8245 4.3959 4.3959 4.6917 4.6917 4.8273 4.8273 5.5926 5.5926 6.0886 6.0886 6.2822 6.2822 9.3242 9.3242 9.5189 9.5189 9.8500 9.8500 9.9062 9.9062 k = 0.1023-0.1774-0.1073 ( 4108 PWs) bands (ev): -35.5851 -35.5851 -16.5533 -16.5533 -15.1466 -15.1466 -15.0781 -15.0781 -5.5304 -5.5304 -5.1450 -5.1450 -5.0875 -5.0875 -4.8438 -4.8438 -2.9795 -2.9795 -2.9106 -2.9106 -2.8996 -2.8996 0.8440 0.8440 4.3469 4.3469 4.6690 4.6690 4.8190 4.8190 5.6255 5.6255 6.0777 6.0777 6.2588 6.2588 9.3081 9.3081 9.5550 9.5550 9.8085 9.8085 9.9413 9.9413 k = 0.1136-0.1971-0.1192 ( 4108 PWs) bands (ev): -35.5850 -35.5850 -16.5541 -16.5541 -15.1469 -15.1469 -15.0800 -15.0800 -5.5165 -5.5165 -5.1466 -5.1466 -5.0892 -5.0892 -4.8415 -4.8415 -2.9783 -2.9783 -2.9099 -2.9099 -2.8990 -2.8990 0.8655 0.8655 4.2983 4.2983 4.6412 4.6412 4.8131 4.8131 5.6531 5.6531 6.0664 6.0664 6.2350 6.2350 9.2897 9.2897 9.5924 9.5924 9.7578 9.7578 9.9917 9.9917 k = 0.1250-0.2168-0.1312 ( 4110 PWs) bands (ev): -35.5848 -35.5848 -16.5549 -16.5549 -15.1472 -15.1472 -15.0821 -15.0821 -5.5016 -5.5016 -5.1484 -5.1484 -5.0908 -5.0908 -4.8391 -4.8391 -2.9771 -2.9771 -2.9091 -2.9091 -2.8984 -2.8984 0.8888 0.8888 4.2512 4.2512 4.6078 4.6078 4.8097 4.8097 5.6752 5.6752 6.0541 6.0541 6.2112 6.2112 9.2691 9.2691 9.6256 9.6256 9.7151 9.7151 10.0461 10.0461 k = 0.1364-0.2365-0.1431 ( 4101 PWs) bands (ev): -35.5846 -35.5846 -16.5558 -16.5558 -15.1476 -15.1476 -15.0842 -15.0842 -5.4856 -5.4856 -5.1503 -5.1503 -5.0923 -5.0923 -4.8366 -4.8366 -2.9759 -2.9759 -2.9084 -2.9084 -2.8976 -2.8976 0.9139 0.9139 4.2062 4.2062 4.5688 4.5688 4.8084 4.8084 5.6924 5.6924 6.0404 6.0404 6.1872 6.1872 9.2465 9.2465 9.6286 9.6286 9.7092 9.7092 10.1024 10.1024 k = 0.1477-0.2563-0.1550 ( 4092 PWs) bands (ev): -35.5845 -35.5845 -16.5567 -16.5567 -15.1481 -15.1481 -15.0865 -15.0865 -5.4686 -5.4686 -5.1523 -5.1523 -5.0936 -5.0936 -4.8341 -4.8341 -2.9746 -2.9746 -2.9077 -2.9077 -2.8966 -2.8966 0.9407 0.9407 4.1639 4.1639 4.5247 4.5247 4.8088 4.8088 5.7050 5.7050 6.0252 6.0252 6.1624 6.1624 9.2220 9.2220 9.5986 9.5986 9.7437 9.7437 10.1594 10.1594 k = 0.1591-0.2760-0.1669 ( 4092 PWs) bands (ev): -35.5843 -35.5843 -16.5577 -16.5577 -15.1486 -15.1486 -15.0888 -15.0888 -5.4509 -5.4509 -5.1544 -5.1544 -5.0947 -5.0947 -4.8315 -4.8315 -2.9733 -2.9733 -2.9070 -2.9070 -2.8956 -2.8956 0.9690 0.9690 4.1246 4.1246 4.4760 4.4760 4.8104 4.8104 5.7138 5.7138 6.0085 6.0085 6.1358 6.1358 9.1960 9.1960 9.5672 9.5672 9.7880 9.7880 10.2157 10.2157 k = 0.1705-0.2957-0.1789 ( 4100 PWs) bands (ev): -35.5841 -35.5841 -16.5588 -16.5588 -15.1492 -15.1492 -15.0912 -15.0912 -5.4324 -5.4324 -5.1565 -5.1565 -5.0956 -5.0956 -4.8288 -4.8288 -2.9721 -2.9721 -2.9064 -2.9064 -2.8945 -2.8945 0.9987 0.9987 4.0886 4.0886 4.4233 4.4233 4.8128 4.8128 5.7190 5.7190 5.9910 5.9910 6.1064 6.1064 9.1688 9.1688 9.5413 9.5413 9.8349 9.8349 10.2698 10.2698 k = 0.1818-0.3154-0.1908 ( 4092 PWs) bands (ev): -35.5839 -35.5839 -16.5599 -16.5599 -15.1499 -15.1499 -15.0935 -15.0935 -5.4135 -5.4135 -5.1585 -5.1585 -5.0963 -5.0963 -4.8261 -4.8261 -2.9708 -2.9708 -2.9057 -2.9057 -2.8932 -2.8932 1.0296 1.0296 4.0561 4.0561 4.3673 4.3673 4.8157 4.8157 5.7206 5.7206 5.9730 5.9730 6.0741 6.0741 9.1409 9.1409 9.5218 9.5218 9.8829 9.8829 10.3192 10.3192 k = 0.1932-0.3351-0.2027 ( 4094 PWs) bands (ev): -35.5837 -35.5837 -16.5610 -16.5610 -15.1507 -15.1507 -15.0959 -15.0959 -5.3943 -5.3943 -5.1603 -5.1603 -5.0967 -5.0967 -4.8234 -4.8234 -2.9696 -2.9696 -2.9051 -2.9051 -2.8918 -2.8918 1.0617 1.0617 4.0272 4.0272 4.3086 4.3086 4.8188 4.8188 5.7183 5.7183 5.9537 5.9537 6.0402 6.0402 9.1130 9.1130 9.5083 9.5083 9.9311 9.9311 10.3584 10.3584 k = 0.2045-0.3548-0.2146 ( 4092 PWs) bands (ev): -35.5835 -35.5835 -16.5622 -16.5622 -15.1517 -15.1517 -15.0982 -15.0982 -5.3750 -5.3750 -5.1618 -5.1618 -5.0970 -5.0970 -4.8205 -4.8205 -2.9684 -2.9684 -2.9044 -2.9044 -2.8904 -2.8904 1.0947 1.0947 4.0019 4.0019 4.2481 4.2481 4.8220 4.8220 5.7116 5.7116 5.9292 5.9292 6.0095 6.0095 9.0855 9.0855 9.4996 9.4996 9.9792 9.9792 10.3767 10.3767 k = 0.2159-0.3745-0.2266 ( 4091 PWs) bands (ev): -35.5832 -35.5832 -16.5634 -16.5634 -15.1527 -15.1527 -15.1004 -15.1004 -5.3558 -5.3558 -5.1628 -5.1628 -5.0969 -5.0969 -4.8176 -4.8176 -2.9672 -2.9672 -2.9037 -2.9037 -2.8888 -2.8888 1.1285 1.1285 3.9799 3.9799 4.1866 4.1866 4.8251 4.8251 5.6998 5.6998 5.8935 5.8935 5.9893 5.9893 9.0588 9.0588 9.4942 9.4942 10.0265 10.0265 10.3689 10.3689 k = 0.2273-0.3942-0.2385 ( 4095 PWs) bands (ev): -35.5830 -35.5830 -16.5646 -16.5646 -15.1539 -15.1539 -15.1026 -15.1026 -5.3371 -5.3371 -5.1633 -5.1633 -5.0967 -5.0967 -4.8146 -4.8146 -2.9662 -2.9662 -2.9030 -2.9030 -2.8872 -2.8872 1.1630 1.1630 3.9602 3.9602 4.1258 4.1258 4.8279 4.8279 5.6818 5.6818 5.8471 5.8471 5.9811 5.9811 9.0331 9.0331 9.4903 9.4903 10.0728 10.0728 10.3476 10.3476 k = 0.2386-0.4140-0.2504 ( 4096 PWs) bands (ev): -35.5828 -35.5828 -16.5659 -16.5659 -15.1553 -15.1553 -15.1046 -15.1046 -5.3192 -5.3192 -5.1629 -5.1629 -5.0962 -5.0962 -4.8114 -4.8114 -2.9652 -2.9652 -2.9023 -2.9023 -2.8855 -2.8855 1.1980 1.1980 3.9404 3.9404 4.0686 4.0686 4.8302 4.8302 5.6555 5.6555 5.7968 5.7968 5.9813 5.9813 9.0084 9.0084 9.4860 9.4860 10.1175 10.1175 10.3247 10.3247 k = 0.2500-0.4337-0.2623 ( 4083 PWs) bands (ev): -35.5826 -35.5826 -16.5671 -16.5671 -15.1567 -15.1567 -15.1064 -15.1064 -5.3025 -5.3025 -5.1616 -5.1616 -5.0953 -5.0953 -4.8080 -4.8080 -2.9643 -2.9643 -2.9015 -2.9015 -2.8837 -2.8837 1.2334 1.2334 3.9142 3.9142 4.0216 4.0216 4.8319 4.8319 5.6169 5.6169 5.7502 5.7502 5.9870 5.9870 8.9848 8.9848 9.4795 9.4795 10.1603 10.1603 10.3057 10.3057 k = 0.2614-0.4534-0.2743 ( 4082 PWs) bands (ev): -35.5823 -35.5823 -16.5684 -16.5684 -15.1583 -15.1583 -15.1082 -15.1082 -5.2875 -5.2875 -5.1590 -5.1590 -5.0941 -5.0941 -4.8045 -4.8045 -2.9635 -2.9635 -2.9007 -2.9007 -2.8819 -2.8819 1.2690 1.2690 3.8735 3.8735 3.9935 3.9935 4.8330 4.8330 5.5633 5.5633 5.7127 5.7127 5.9966 5.9966 8.9621 8.9621 9.4692 9.4692 10.2001 10.2001 10.2935 10.2935 k = 0.2727-0.4731-0.2862 ( 4081 PWs) bands (ev): -35.5821 -35.5821 -16.5697 -16.5697 -15.1601 -15.1601 -15.1097 -15.1097 -5.2745 -5.2745 -5.1551 -5.1551 -5.0924 -5.0924 -4.8006 -4.8006 -2.9627 -2.9627 -2.9000 -2.9000 -2.8800 -2.8800 1.3047 1.3047 3.8199 3.8199 3.9828 3.9828 4.8333 4.8333 5.4970 5.4970 5.6839 5.6839 6.0091 6.0091 8.9404 8.9404 9.4539 9.4539 10.2346 10.2346 10.2912 10.2912 k = 0.2841-0.4928-0.2981 ( 4082 PWs) bands (ev): -35.5819 -35.5819 -16.5709 -16.5709 -15.1619 -15.1619 -15.1111 -15.1111 -5.2638 -5.2638 -5.1499 -5.1499 -5.0901 -5.0901 -4.7964 -4.7964 -2.9621 -2.9621 -2.8991 -2.8991 -2.8781 -2.8781 1.3404 1.3404 3.7606 3.7606 3.9825 3.9825 4.8327 4.8327 5.4230 5.4230 5.6608 5.6608 6.0237 6.0237 8.9194 8.9194 9.4330 9.4330 10.2577 10.2577 10.3046 10.3046 k = 0.2955-0.5125-0.3100 ( 4084 PWs) bands (ev): -35.5817 -35.5817 -16.5722 -16.5722 -15.1638 -15.1638 -15.1124 -15.1124 -5.2555 -5.2555 -5.1438 -5.1438 -5.0870 -5.0870 -4.7919 -4.7919 -2.9615 -2.9615 -2.8983 -2.8983 -2.8761 -2.8761 1.3759 1.3759 3.6995 3.6995 3.9888 3.9888 4.8311 4.8311 5.3448 5.3448 5.6412 5.6412 6.0399 6.0399 8.8992 8.8992 9.4065 9.4065 10.2702 10.2702 10.3320 10.3320 k = 0.3068-0.5322-0.3220 ( 4085 PWs) bands (ev): -35.5815 -35.5815 -16.5734 -16.5734 -15.1658 -15.1658 -15.1135 -15.1135 -5.2492 -5.2492 -5.1374 -5.1374 -5.0827 -5.0827 -4.7869 -4.7869 -2.9610 -2.9610 -2.8975 -2.8975 -2.8741 -2.8741 1.4111 1.4111 3.6386 3.6386 3.9999 3.9999 4.8285 4.8285 5.2647 5.2647 5.6241 5.6241 6.0571 6.0571 8.8796 8.8796 9.3748 9.3748 10.2803 10.2803 10.3637 10.3637 k = 0.3182-0.5519-0.3339 ( 4083 PWs) bands (ev): -35.5812 -35.5812 -16.5746 -16.5746 -15.1679 -15.1679 -15.1144 -15.1144 -5.2445 -5.2445 -5.1314 -5.1314 -5.0773 -5.0773 -4.7816 -4.7816 -2.9606 -2.9606 -2.8967 -2.8967 -2.8721 -2.8721 1.4460 1.4460 3.5786 3.5786 4.0148 4.0148 4.8245 4.8245 5.1847 5.1847 5.6090 5.6090 6.0752 6.0752 8.8607 8.8607 9.3387 9.3387 10.2899 10.2899 10.3959 10.3959 k = 0.3295-0.5717-0.3458 ( 4072 PWs) bands (ev): -35.5810 -35.5810 -16.5758 -16.5758 -15.1700 -15.1700 -15.1152 -15.1152 -5.2412 -5.2412 -5.1262 -5.1262 -5.0706 -5.0706 -4.7757 -4.7757 -2.9603 -2.9603 -2.8958 -2.8958 -2.8700 -2.8700 1.4803 1.4803 3.5202 3.5202 4.0328 4.0328 4.8189 4.8189 5.1063 5.1063 5.5956 5.5956 6.0936 6.0936 8.8424 8.8424 9.2990 9.2990 10.2980 10.2980 10.4279 10.4279 k = 0.3409-0.5914-0.3577 ( 4073 PWs) bands (ev): -35.5809 -35.5809 -16.5769 -16.5769 -15.1720 -15.1720 -15.1159 -15.1159 -5.2389 -5.2389 -5.1221 -5.1221 -5.0631 -5.0631 -4.7695 -4.7695 -2.9600 -2.9600 -2.8950 -2.8950 -2.8680 -2.8680 1.5140 1.5140 3.4638 3.4638 4.0532 4.0532 4.8108 4.8108 5.0314 5.0314 5.5839 5.5839 6.1122 6.1122 8.8245 8.8245 9.2567 9.2567 10.3023 10.3023 10.4595 10.4595 k = 0.3523-0.6111-0.3697 ( 4067 PWs) bands (ev): -35.5807 -35.5807 -16.5780 -16.5780 -15.1741 -15.1741 -15.1165 -15.1165 -5.2371 -5.2371 -5.1190 -5.1190 -5.0552 -5.0552 -4.7628 -4.7628 -2.9597 -2.9597 -2.8942 -2.8942 -2.8660 -2.8660 1.5469 1.5469 3.4097 3.4097 4.0753 4.0753 4.7985 4.7985 4.9628 4.9628 5.5737 5.5737 6.1307 6.1307 8.8073 8.8073 9.2125 9.2125 10.3010 10.3010 10.4905 10.4905 k = 0.3636-0.6308-0.3816 ( 4069 PWs) bands (ev): -35.5805 -35.5805 -16.5790 -16.5790 -15.1761 -15.1761 -15.1170 -15.1170 -5.2359 -5.2359 -5.1166 -5.1166 -5.0473 -5.0473 -4.7558 -4.7558 -2.9595 -2.9595 -2.8934 -2.8934 -2.8640 -2.8640 1.5789 1.5789 3.3581 3.3581 4.0984 4.0984 4.7777 4.7777 4.9059 4.9059 5.5648 5.5648 6.1489 6.1489 8.7905 8.7905 9.1675 9.1675 10.2928 10.2928 10.5197 10.5197 k = 0.3750-0.6505-0.3935 ( 4069 PWs) bands (ev): -35.5803 -35.5803 -16.5800 -16.5800 -15.1780 -15.1780 -15.1175 -15.1175 -5.2349 -5.2349 -5.1147 -5.1147 -5.0399 -5.0399 -4.7486 -4.7486 -2.9593 -2.9593 -2.8927 -2.8927 -2.8620 -2.8620 1.6097 1.6097 3.3094 3.3094 4.1216 4.1216 4.7434 4.7434 4.8667 4.8667 5.5572 5.5572 6.1665 6.1665 8.7741 8.7741 9.1223 9.1223 10.2774 10.2774 10.5446 10.5446 k = 0.3864-0.6702-0.4054 ( 4066 PWs) bands (ev): -35.5802 -35.5802 -16.5809 -16.5809 -15.1798 -15.1798 -15.1178 -15.1178 -5.2342 -5.2342 -5.1133 -5.1133 -5.0330 -5.0330 -4.7413 -4.7413 -2.9592 -2.9592 -2.8920 -2.8920 -2.8602 -2.8602 1.6393 1.6393 3.2638 3.2638 4.1440 4.1440 4.6979 4.6979 4.8440 4.8440 5.5508 5.5508 6.1834 6.1834 8.7583 8.7583 9.0778 9.0778 10.2556 10.2556 10.5609 10.5609 k = 0.3977-0.6899-0.4174 ( 4059 PWs) bands (ev): -35.5800 -35.5800 -16.5817 -16.5817 -15.1814 -15.1814 -15.1181 -15.1181 -5.2335 -5.2335 -5.1121 -5.1121 -5.0269 -5.0269 -4.7340 -4.7340 -2.9591 -2.9591 -2.8913 -2.8913 -2.8584 -2.8584 1.6674 1.6674 3.2215 3.2215 4.1645 4.1645 4.6498 4.6498 4.8303 4.8303 5.5454 5.5454 6.1994 6.1994 8.7430 8.7430 9.0348 9.0348 10.2293 10.2293 10.5675 10.5675 k = 0.4091-0.7096-0.4293 ( 4063 PWs) bands (ev): -35.5799 -35.5799 -16.5825 -16.5825 -15.1830 -15.1830 -15.1183 -15.1183 -5.2330 -5.2330 -5.1112 -5.1112 -5.0216 -5.0216 -4.7269 -4.7269 -2.9590 -2.9590 -2.8907 -2.8907 -2.8567 -2.8567 1.6937 1.6937 3.1828 3.1828 4.1817 4.1817 4.6052 4.6052 4.8208 4.8208 5.5409 5.5409 6.2143 6.2143 8.7281 8.7281 8.9943 8.9943 10.2005 10.2005 10.5682 10.5682 k = 0.4205-0.7293-0.4412 ( 4062 PWs) bands (ev): -35.5798 -35.5798 -16.5832 -16.5832 -15.1844 -15.1844 -15.1185 -15.1185 -5.2326 -5.2326 -5.1105 -5.1105 -5.0170 -5.0170 -4.7202 -4.7202 -2.9590 -2.9590 -2.8902 -2.8902 -2.8552 -2.8552 1.7179 1.7179 3.1479 3.1479 4.1946 4.1946 4.5674 4.5674 4.8135 4.8135 5.5373 5.5373 6.2278 6.2278 8.7137 8.7137 8.9570 8.9570 10.1713 10.1713 10.5666 10.5666 k = 0.4318-0.7491-0.4531 ( 4059 PWs) bands (ev): -35.5797 -35.5797 -16.5838 -16.5838 -15.1856 -15.1856 -15.1187 -15.1187 -5.2323 -5.2323 -5.1099 -5.1099 -5.0133 -5.0133 -4.7141 -4.7141 -2.9589 -2.9589 -2.8897 -2.8897 -2.8538 -2.8538 1.7399 1.7399 3.1170 3.1170 4.2022 4.2022 4.5381 4.5381 4.8076 4.8076 5.5343 5.5343 6.2400 6.2400 8.7000 8.7000 8.9236 8.9236 10.1433 10.1433 10.5643 10.5643 k = 0.4432-0.7688-0.4651 ( 4061 PWs) bands (ev): -35.5796 -35.5796 -16.5843 -16.5843 -15.1867 -15.1867 -15.1188 -15.1188 -5.2319 -5.2319 -5.1094 -5.1094 -5.0102 -5.0102 -4.7086 -4.7086 -2.9589 -2.9589 -2.8893 -2.8893 -2.8526 -2.8526 1.7591 1.7591 3.0903 3.0903 4.2042 4.2042 4.5176 4.5176 4.8027 4.8027 5.5320 5.5320 6.2505 6.2505 8.6871 8.6871 8.8950 8.8950 10.1180 10.1180 10.5620 10.5620 k = 0.4545-0.7885-0.4770 ( 4059 PWs) bands (ev): -35.5795 -35.5795 -16.5847 -16.5847 -15.1876 -15.1876 -15.1189 -15.1189 -5.2317 -5.2317 -5.1090 -5.1090 -5.0078 -5.0078 -4.7039 -4.7039 -2.9589 -2.9589 -2.8889 -2.8889 -2.8516 -2.8516 1.7755 1.7755 3.0681 3.0681 4.2019 4.2019 4.5051 4.5051 4.7988 4.7988 5.5302 5.5302 6.2594 6.2594 8.6755 8.6755 8.8714 8.8714 10.0962 10.0962 10.5599 10.5599 k = 0.4659-0.8082-0.4889 ( 4059 PWs) bands (ev): -35.5795 -35.5795 -16.5850 -16.5850 -15.1883 -15.1883 -15.1190 -15.1190 -5.2315 -5.2315 -5.1087 -5.1087 -5.0060 -5.0060 -4.7002 -4.7002 -2.9588 -2.9588 -2.8886 -2.8886 -2.8508 -2.8508 1.7886 1.7886 3.0506 3.0506 4.1970 4.1970 4.4986 4.4986 4.7957 4.7957 5.5289 5.5289 6.2664 6.2664 8.6655 8.6655 8.8531 8.8531 10.0787 10.0787 10.5582 10.5582 k = 0.4773-0.8279-0.5008 ( 4061 PWs) bands (ev): -35.5794 -35.5794 -16.5853 -16.5853 -15.1888 -15.1888 -15.1191 -15.1191 -5.2313 -5.2313 -5.1085 -5.1085 -5.0047 -5.0047 -4.6974 -4.6974 -2.9588 -2.9588 -2.8884 -2.8884 -2.8503 -2.8503 1.7981 1.7981 3.0379 3.0379 4.1916 4.1916 4.4957 4.4957 4.7934 4.7934 5.5280 5.5280 6.2714 6.2714 8.6578 8.6578 8.8401 8.8401 10.0659 10.0659 10.5569 10.5569 k = 0.4886-0.8476-0.5127 ( 4064 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1891 -15.1891 -15.1191 -15.1191 -5.2313 -5.2313 -5.1084 -5.1084 -5.0040 -5.0040 -4.6957 -4.6957 -2.9588 -2.9588 -2.8883 -2.8883 -2.8499 -2.8499 1.8039 1.8039 3.0303 3.0303 4.1877 4.1877 4.4948 4.4948 4.7921 4.7921 5.5275 5.5275 6.2745 6.2745 8.6529 8.6529 8.8324 8.8324 10.0581 10.0581 10.5562 10.5562 k = 0.5000-0.8673-0.5247 ( 4058 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1892 -15.1892 -15.1191 -15.1191 -5.2312 -5.2312 -5.1084 -5.1084 -5.0037 -5.0037 -4.6952 -4.6952 -2.9588 -2.9588 -2.8883 -2.8883 -2.8498 -2.8498 1.8059 1.8059 3.0277 3.0277 4.1863 4.1863 4.4946 4.4946 4.7917 4.7917 5.5273 5.5273 6.2755 6.2755 8.6513 8.6513 8.8298 8.8298 10.0554 10.0554 10.5559 10.5559 k = 0.5000-0.8673-0.5247 ( 4058 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1892 -15.1892 -15.1191 -15.1191 -5.2312 -5.2312 -5.1084 -5.1084 -5.0037 -5.0037 -4.6952 -4.6952 -2.9588 -2.9588 -2.8883 -2.8883 -2.8498 -2.8498 1.8059 1.8059 3.0277 3.0277 4.1863 4.1863 4.4946 4.4946 4.7917 4.7917 5.5273 5.5273 6.2755 6.2755 8.6513 8.6513 8.8298 8.8298 10.0554 10.0554 10.5559 10.5559 k = 0.5000-0.8542-0.5463 ( 4064 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1892 -15.1892 -15.1192 -15.1192 -5.2312 -5.2312 -5.1089 -5.1089 -5.0028 -5.0028 -4.6953 -4.6953 -2.9587 -2.9587 -2.8883 -2.8883 -2.8499 -2.8499 1.8061 1.8061 3.0292 3.0292 4.1869 4.1869 4.4946 4.4946 4.7923 4.7923 5.5222 5.5222 6.2719 6.2719 8.6544 8.6544 8.8317 8.8317 10.0581 10.0581 10.5565 10.5565 k = 0.5000-0.8412-0.5679 ( 4068 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1890 -15.1890 -15.1195 -15.1195 -5.2310 -5.2310 -5.1105 -5.1105 -5.0001 -5.0001 -4.6958 -4.6958 -2.9584 -2.9584 -2.8884 -2.8884 -2.8501 -2.8501 1.8066 1.8066 3.0337 3.0337 4.1887 4.1887 4.4943 4.4943 4.7944 4.7944 5.5073 5.5073 6.2611 6.2611 8.6636 8.6636 8.8374 8.8374 10.0662 10.0662 10.5583 10.5583 k = 0.5000-0.8281-0.5896 ( 4062 PWs) bands (ev): -35.5794 -35.5794 -16.5856 -16.5856 -15.1888 -15.1888 -15.1200 -15.1200 -5.2306 -5.2306 -5.1130 -5.1130 -4.9959 -4.9959 -4.6965 -4.6965 -2.9579 -2.9579 -2.8885 -2.8885 -2.8504 -2.8504 1.8075 1.8075 3.0411 3.0411 4.1915 4.1915 4.4940 4.4940 4.7978 4.7978 5.4828 5.4828 6.2434 6.2434 8.6778 8.6778 8.8474 8.8474 10.0793 10.0793 10.5617 10.5617 k = 0.5000-0.8150-0.6112 ( 4062 PWs) bands (ev): -35.5794 -35.5794 -16.5856 -16.5856 -15.1884 -15.1884 -15.1206 -15.1206 -5.2301 -5.2301 -5.1161 -5.1161 -4.9902 -4.9902 -4.6975 -4.6975 -2.9571 -2.9571 -2.8887 -2.8887 -2.8509 -2.8509 1.8088 1.8088 3.0515 3.0515 4.1954 4.1954 4.4935 4.4935 4.8024 4.8024 5.4496 5.4496 6.2190 6.2190 8.6956 8.6956 8.8621 8.8621 10.0970 10.0970 10.5671 10.5671 k = 0.5000-0.8019-0.6328 ( 4064 PWs) bands (ev): -35.5793 -35.5793 -16.5857 -16.5857 -15.1880 -15.1880 -15.1214 -15.1214 -5.2295 -5.2295 -5.1197 -5.1197 -4.9834 -4.9834 -4.6988 -4.6988 -2.9562 -2.9562 -2.8890 -2.8890 -2.8515 -2.8515 1.8103 1.8103 3.0648 3.0648 4.2002 4.2002 4.4930 4.4930 4.8083 4.8083 5.4087 5.4087 6.1885 6.1885 8.7153 8.7153 8.8823 8.8823 10.1185 10.1185 10.5750 10.5750 k = 0.5000-0.7888-0.6544 ( 4064 PWs) bands (ev): -35.5793 -35.5793 -16.5858 -16.5858 -15.1875 -15.1875 -15.1224 -15.1224 -5.2288 -5.2288 -5.1237 -5.1237 -4.9756 -4.9756 -4.7004 -4.7004 -2.9551 -2.9551 -2.8893 -2.8893 -2.8522 -2.8522 1.8123 1.8123 3.0810 3.0810 4.2057 4.2057 4.4923 4.4923 4.8153 4.8153 5.3612 5.3612 6.1523 6.1523 8.7349 8.7349 8.9087 8.9087 10.1427 10.1427 10.5859 10.5859 k = 0.5000-0.7757-0.6761 ( 4064 PWs) bands (ev): -35.5793 -35.5793 -16.5860 -16.5860 -15.1869 -15.1869 -15.1236 -15.1236 -5.2279 -5.2279 -5.1278 -5.1278 -4.9670 -4.9670 -4.7022 -4.7022 -2.9538 -2.9538 -2.8896 -2.8896 -2.8531 -2.8531 1.8146 1.8146 3.0999 3.0999 4.2115 4.2115 4.4917 4.4917 4.8233 4.8233 5.3085 5.3085 6.1110 6.1110 8.7533 8.7533 8.9411 8.9411 10.1682 10.1682 10.6000 10.6000 k = 0.5000-0.7627-0.6977 ( 4068 PWs) bands (ev): -35.5792 -35.5792 -16.5861 -16.5861 -15.1862 -15.1862 -15.1249 -15.1249 -5.2269 -5.2269 -5.1321 -5.1321 -4.9578 -4.9578 -4.7043 -4.7043 -2.9523 -2.9523 -2.8900 -2.8900 -2.8541 -2.8541 1.8172 1.8172 3.1217 3.1217 4.2174 4.2174 4.4909 4.4909 4.8323 4.8323 5.2519 5.2519 6.0653 6.0653 8.7698 8.7698 8.9792 8.9792 10.1927 10.1927 10.6174 10.6174 k = 0.5000-0.7496-0.7193 ( 4074 PWs) bands (ev): -35.5792 -35.5792 -16.5863 -16.5863 -15.1854 -15.1854 -15.1264 -15.1264 -5.2258 -5.2258 -5.1363 -5.1363 -4.9480 -4.9480 -4.7067 -4.7067 -2.9507 -2.9507 -2.8905 -2.8905 -2.8551 -2.8551 1.8201 1.8201 3.1461 3.1461 4.2229 4.2229 4.4902 4.4902 4.8419 4.8419 5.1931 5.1931 6.0159 6.0159 8.7842 8.7842 9.0220 9.0220 10.2136 10.2136 10.6369 10.6369 k = 0.5000-0.7365-0.7410 ( 4080 PWs) bands (ev): -35.5792 -35.5792 -16.5865 -16.5865 -15.1845 -15.1845 -15.1280 -15.1280 -5.2245 -5.2245 -5.1405 -5.1405 -4.9378 -4.9378 -4.7094 -4.7094 -2.9489 -2.9489 -2.8909 -2.8909 -2.8563 -2.8563 1.8233 1.8233 3.1732 3.1732 4.2273 4.2273 4.4893 4.4893 4.8519 4.8519 5.1337 5.1337 5.9634 5.9634 8.7966 8.7966 9.0684 9.0684 10.2277 10.2277 10.6523 10.6523 k = 0.5000-0.7234-0.7626 ( 4070 PWs) bands (ev): -35.5791 -35.5791 -16.5866 -16.5866 -15.1836 -15.1836 -15.1296 -15.1296 -5.2232 -5.2232 -5.1446 -5.1446 -4.9273 -4.9273 -4.7123 -4.7123 -2.9469 -2.9469 -2.8914 -2.8914 -2.8575 -2.8575 1.8268 1.8268 3.2028 3.2028 4.2298 4.2298 4.4884 4.4884 4.8618 4.8618 5.0759 5.0759 5.9086 5.9086 8.8070 8.8070 9.1176 9.1176 10.2316 10.2316 10.6391 10.6391 k = 0.5000-0.7103-0.7842 ( 4070 PWs) bands (ev): -35.5791 -35.5791 -16.5868 -16.5868 -15.1826 -15.1826 -15.1314 -15.1314 -5.2217 -5.2217 -5.1486 -5.1486 -4.9166 -4.9166 -4.7154 -4.7154 -2.9449 -2.9449 -2.8919 -2.8919 -2.8588 -2.8588 1.8305 1.8305 3.2348 3.2348 4.2294 4.2294 4.4873 4.4873 4.8706 4.8706 5.0223 5.0223 5.8524 5.8524 8.8154 8.8154 9.1689 9.1689 10.2225 10.2225 10.6187 10.6187 k = 0.5000-0.6972-0.8059 ( 4072 PWs) bands (ev): -35.5790 -35.5790 -16.5871 -16.5871 -15.1816 -15.1816 -15.1332 -15.1332 -5.2201 -5.2201 -5.1526 -5.1526 -4.9058 -4.9058 -4.7187 -4.7187 -2.9428 -2.9428 -2.8924 -2.8924 -2.8602 -2.8602 1.8344 1.8344 3.2692 3.2692 4.2249 4.2249 4.4860 4.4860 4.8754 4.8754 4.9775 4.9775 5.7953 5.7953 8.8218 8.8218 9.2218 9.2218 10.1992 10.1992 10.6004 10.6004 k = 0.5000-0.6842-0.8275 ( 4068 PWs) bands (ev): -35.5790 -35.5790 -16.5873 -16.5873 -15.1805 -15.1805 -15.1351 -15.1351 -5.2184 -5.2184 -5.1563 -5.1563 -4.8949 -4.8949 -4.7222 -4.7222 -2.9406 -2.9406 -2.8929 -2.8929 -2.8616 -2.8616 1.8385 1.8385 3.3058 3.3058 4.2149 4.2149 4.4845 4.4845 4.8695 4.8695 4.9500 4.9500 5.7384 5.7384 8.8260 8.8260 9.2761 9.2761 10.1627 10.1627 10.5825 10.5825 k = 0.5000-0.6711-0.8491 ( 4068 PWs) bands (ev): -35.5789 -35.5789 -16.5875 -16.5875 -15.1794 -15.1794 -15.1371 -15.1371 -5.2166 -5.2166 -5.1600 -5.1600 -4.8841 -4.8841 -4.7259 -4.7259 -2.9383 -2.9383 -2.8933 -2.8933 -2.8630 -2.8630 1.8426 1.8426 3.3445 3.3445 4.1980 4.1980 4.4829 4.4829 4.8501 4.8501 4.9438 4.9438 5.6825 5.6825 8.8279 8.8279 9.3313 9.3313 10.1154 10.1154 10.5630 10.5630 k = 0.5000-0.6580-0.8707 ( 4072 PWs) bands (ev): -35.5789 -35.5789 -16.5877 -16.5877 -15.1782 -15.1782 -15.1390 -15.1390 -5.2148 -5.2148 -5.1636 -5.1636 -4.8734 -4.8734 -4.7298 -4.7298 -2.9361 -2.9361 -2.8938 -2.8938 -2.8644 -2.8644 1.8468 1.8468 3.3852 3.3852 4.1735 4.1735 4.4812 4.4812 4.8280 4.8280 4.9490 4.9490 5.6285 5.6285 8.8274 8.8274 9.3871 9.3871 10.0603 10.0603 10.5415 10.5415 k = 0.5000-0.6449-0.8924 ( 4070 PWs) bands (ev): -35.5788 -35.5788 -16.5879 -16.5879 -15.1770 -15.1770 -15.1410 -15.1410 -5.2128 -5.2128 -5.1670 -5.1670 -4.8630 -4.8630 -4.7338 -4.7338 -2.9339 -2.9339 -2.8941 -2.8941 -2.8659 -2.8659 1.8508 1.8508 3.4277 3.4277 4.1413 4.1413 4.4794 4.4794 4.8109 4.8109 4.9578 4.9578 5.5775 5.5775 8.8245 8.8245 9.4430 9.4430 10.0003 10.0003 10.5188 10.5188 k = 0.5000-0.6318-0.9140 ( 4066 PWs) bands (ev): -35.5788 -35.5788 -16.5881 -16.5881 -15.1758 -15.1758 -15.1429 -15.1429 -5.2107 -5.2107 -5.1703 -5.1703 -4.8529 -4.8529 -4.7378 -4.7378 -2.9319 -2.9319 -2.8943 -2.8943 -2.8673 -2.8673 1.8547 1.8547 3.4720 3.4720 4.1022 4.1022 4.4774 4.4774 4.8008 4.8008 4.9673 4.9673 5.5303 5.5303 8.8190 8.8190 9.4979 9.4979 9.9387 9.9387 10.4958 10.4958 k = 0.5000-0.6187-0.9356 ( 4068 PWs) bands (ev): -35.5788 -35.5788 -16.5883 -16.5883 -15.1747 -15.1747 -15.1447 -15.1447 -5.2086 -5.2086 -5.1736 -5.1736 -4.8433 -4.8433 -4.7419 -4.7419 -2.9299 -2.9299 -2.8945 -2.8945 -2.8687 -2.8687 1.8583 1.8583 3.5177 3.5177 4.0577 4.0577 4.4750 4.4750 4.7973 4.7973 4.9762 4.9762 5.4882 5.4882 8.8111 8.8111 9.5490 9.5490 9.8794 9.8794 10.4736 10.4736 k = 0.5000-0.6057-0.9573 ( 4066 PWs) bands (ev): -35.5787 -35.5787 -16.5884 -16.5884 -15.1736 -15.1736 -15.1464 -15.1464 -5.2064 -5.2064 -5.1767 -5.1767 -4.8344 -4.8344 -4.7459 -4.7459 -2.9282 -2.9282 -2.8945 -2.8945 -2.8699 -2.8699 1.8615 1.8615 3.5648 3.5648 4.0092 4.0092 4.4719 4.4719 4.7994 4.7994 4.9839 4.9839 5.4519 5.4519 8.8008 8.8008 9.5893 9.5893 9.8310 9.8310 10.4527 10.4527 k = 0.5000-0.5926-0.9789 ( 4068 PWs) bands (ev): -35.5787 -35.5787 -16.5886 -16.5886 -15.1726 -15.1726 -15.1479 -15.1479 -5.2041 -5.2041 -5.1797 -5.1797 -4.8263 -4.8263 -4.7498 -4.7498 -2.9267 -2.9267 -2.8944 -2.8944 -2.8711 -2.8711 1.8641 1.8641 3.6130 3.6130 3.9586 3.9586 4.4678 4.4678 4.8057 4.8057 4.9901 4.9901 5.4224 5.4224 8.7886 8.7886 9.6022 9.6022 9.8110 9.8110 10.4333 10.4333 k = 0.5000-0.5795-1.0005 ( 4062 PWs) bands (ev): -35.5787 -35.5787 -16.5887 -16.5887 -15.1717 -15.1717 -15.1492 -15.1492 -5.2018 -5.2018 -5.1826 -5.1826 -4.8192 -4.8192 -4.7532 -4.7532 -2.9255 -2.9255 -2.8942 -2.8942 -2.8722 -2.8722 1.8660 1.8660 3.6621 3.6621 3.9072 3.9072 4.4625 4.4625 4.8152 4.8152 4.9947 4.9947 5.4000 5.4000 8.7746 8.7746 9.5766 9.5766 9.8310 9.8310 10.4156 10.4156 k = 0.5000-0.5664-1.0221 ( 4068 PWs) bands (ev): -35.5786 -35.5786 -16.5888 -16.5888 -15.1709 -15.1709 -15.1503 -15.1503 -5.1995 -5.1995 -5.1855 -5.1855 -4.8135 -4.8135 -4.7561 -4.7561 -2.9246 -2.9246 -2.8938 -2.8938 -2.8731 -2.8731 1.8671 1.8671 3.7117 3.7117 3.8566 3.8566 4.4558 4.4558 4.8267 4.8267 4.9980 4.9980 5.3849 5.3849 8.7592 8.7592 9.5284 9.5284 9.8755 9.8755 10.3995 10.3995 k = 0.5000-0.5533-1.0438 ( 4076 PWs) bands (ev): -35.5786 -35.5786 -16.5889 -16.5889 -15.1704 -15.1704 -15.1511 -15.1511 -5.1972 -5.1972 -5.1882 -5.1882 -4.8095 -4.8095 -4.7582 -4.7582 -2.9240 -2.9240 -2.8935 -2.8935 -2.8737 -2.8737 1.8670 1.8670 3.7587 3.7587 3.8102 3.8102 4.4479 4.4479 4.8394 4.8394 5.0007 5.0007 5.3764 5.3764 8.7428 8.7428 9.4732 9.4732 9.9291 9.9291 10.3849 10.3849 k = 0.5000-0.5402-1.0654 ( 4076 PWs) bands (ev): -35.5786 -35.5786 -16.5889 -16.5889 -15.1702 -15.1702 -15.1514 -15.1514 -5.1952 -5.1952 -5.1904 -5.1904 -4.8074 -4.8074 -4.7591 -4.7591 -2.9237 -2.9237 -2.8931 -2.8931 -2.8741 -2.8741 1.8658 1.8658 3.7523 3.7523 3.8198 3.8198 4.4390 4.4390 4.8524 4.8524 5.0037 5.0037 5.3739 5.3739 8.7260 8.7260 9.4175 9.4175 9.9849 9.9849 10.3722 10.3722 k = 0.5000-0.5271-1.0870 ( 4072 PWs) bands (ev): -35.5786 -35.5786 -16.5889 -16.5889 -15.1702 -15.1702 -15.1514 -15.1514 -5.1953 -5.1953 -5.1905 -5.1905 -4.8073 -4.8073 -4.7590 -4.7590 -2.9238 -2.9238 -2.8929 -2.8929 -2.8742 -2.8742 1.8632 1.8632 3.7092 3.7092 3.8689 3.8689 4.4295 4.4295 4.8652 4.8652 5.0076 5.0076 5.3761 5.3761 8.7093 8.7093 9.3641 9.3641 10.0388 10.0388 10.3619 10.3619 k = 0.5000-0.5141-1.1087 ( 4070 PWs) bands (ev): -35.5786 -35.5786 -16.5889 -16.5889 -15.1704 -15.1704 -15.1511 -15.1511 -5.1974 -5.1974 -5.1885 -5.1885 -4.8090 -4.8090 -4.7581 -4.7581 -2.9240 -2.9240 -2.8929 -2.8929 -2.8739 -2.8739 1.8590 1.8590 3.6673 3.6673 3.9198 3.9198 4.4200 4.4200 4.8772 4.8772 5.0130 5.0130 5.3822 5.3822 8.6931 8.6931 9.3144 9.3144 10.0865 10.0865 10.3559 10.3559 k = 0.5000-0.5010-1.1303 ( 4070 PWs) bands (ev): -35.5786 -35.5786 -16.5888 -16.5888 -15.1708 -15.1708 -15.1504 -15.1504 -5.1999 -5.1999 -5.1860 -5.1860 -4.8121 -4.8121 -4.7568 -4.7568 -2.9245 -2.9245 -2.8931 -2.8931 -2.8733 -2.8733 1.8532 1.8532 3.6285 3.6285 3.9707 3.9707 4.4113 4.4113 4.8880 4.8880 5.0203 5.0203 5.3911 5.3911 8.6781 8.6781 9.2696 9.2696 10.1226 10.1226 10.3577 10.3577 k = 0.8170-0.4161-0.9684 ( 4070 PWs) bands (ev): -35.5786 -35.5786 -16.5888 -16.5888 -15.1708 -15.1708 -15.1504 -15.1504 -5.1999 -5.1999 -5.1860 -5.1860 -4.8121 -4.8121 -4.7568 -4.7568 -2.9245 -2.9245 -2.8931 -2.8931 -2.8733 -2.8733 1.8532 1.8532 3.6285 3.6285 3.9707 3.9707 4.4113 4.4113 4.8880 4.8880 5.0203 5.0203 5.3911 5.3911 8.6781 8.6781 9.2696 9.2696 10.1226 10.1226 10.3577 10.3577 k = 0.8104-0.4047-0.9465 ( 4062 PWs) bands (ev): -35.5787 -35.5787 -16.5886 -16.5886 -15.1713 -15.1713 -15.1495 -15.1495 -5.2025 -5.2025 -5.1834 -5.1834 -4.8161 -4.8161 -4.7557 -4.7557 -2.9252 -2.9252 -2.8934 -2.8934 -2.8725 -2.8725 1.8454 1.8454 3.5932 3.5932 4.0218 4.0218 4.4039 4.4039 4.8976 4.8976 5.0294 5.0294 5.4021 5.4021 8.6645 8.6645 9.2299 9.2299 10.1415 10.1415 10.3707 10.3707 k = 0.8038-0.3932-0.9247 ( 4062 PWs) bands (ev): -35.5787 -35.5787 -16.5885 -16.5885 -15.1718 -15.1718 -15.1485 -15.1485 -5.2052 -5.2052 -5.1807 -5.1807 -4.8209 -4.8209 -4.7550 -4.7550 -2.9261 -2.9261 -2.8939 -2.8939 -2.8715 -2.8715 1.8356 1.8356 3.5619 3.5619 4.0721 4.0721 4.3987 4.3987 4.9055 4.9055 5.0401 5.0401 5.4147 5.4147 8.6530 8.6530 9.1964 9.1964 10.1418 10.1418 10.3927 10.3927 k = 0.7972-0.3818-0.9028 ( 4064 PWs) bands (ev): -35.5787 -35.5787 -16.5882 -16.5882 -15.1723 -15.1723 -15.1472 -15.1472 -5.2079 -5.2079 -5.1780 -5.1780 -4.8260 -4.8260 -4.7550 -4.7550 -2.9271 -2.9271 -2.8946 -2.8946 -2.8704 -2.8704 1.8239 1.8239 3.5351 3.5351 4.1213 4.1213 4.3963 4.3963 4.9115 4.9115 5.0521 5.0521 5.4285 5.4285 8.6443 8.6443 9.1695 9.1695 10.1281 10.1281 10.4140 10.4140 k = 0.7906-0.3703-0.8810 ( 4068 PWs) bands (ev): -35.5788 -35.5788 -16.5879 -16.5879 -15.1727 -15.1727 -15.1459 -15.1459 -5.2106 -5.2106 -5.1753 -5.1753 -4.8315 -4.8315 -4.7558 -4.7558 -2.9282 -2.9282 -2.8953 -2.8953 -2.8694 -2.8694 1.8100 1.8100 3.5129 3.5129 4.1690 4.1690 4.3973 4.3973 4.9156 4.9156 5.0650 5.0650 5.4430 5.4430 8.6386 8.6386 9.1494 9.1494 10.1061 10.1061 10.4237 10.4237 k = 0.7840-0.3589-0.8591 ( 4066 PWs) bands (ev): -35.5789 -35.5789 -16.5876 -16.5876 -15.1731 -15.1731 -15.1445 -15.1445 -5.2133 -5.2133 -5.1725 -5.1725 -4.8372 -4.8372 -4.7576 -4.7576 -2.9295 -2.9295 -2.8960 -2.8960 -2.8684 -2.8684 1.7942 1.7942 3.4955 3.4955 4.2148 4.2148 4.4022 4.4022 4.9174 4.9174 5.0784 5.0784 5.4584 5.4584 8.6365 8.6365 9.1363 9.1363 10.0797 10.0797 10.4182 10.4182 k = 0.7774-0.3474-0.8372 ( 4058 PWs) bands (ev): -35.5789 -35.5789 -16.5871 -16.5871 -15.1733 -15.1733 -15.1431 -15.1431 -5.2161 -5.2161 -5.1698 -5.1698 -4.8431 -4.8431 -4.7603 -4.7603 -2.9308 -2.9308 -2.8968 -2.8968 -2.8675 -2.8675 1.7763 1.7763 3.4829 3.4829 4.2583 4.2583 4.4114 4.4114 4.9169 4.9169 5.0918 5.0918 5.4745 5.4745 8.6383 8.6383 9.1300 9.1300 10.0515 10.0515 10.4013 10.4013 k = 0.7708-0.3359-0.8154 ( 4060 PWs) bands (ev): -35.5790 -35.5790 -16.5866 -16.5866 -15.1734 -15.1734 -15.1417 -15.1417 -5.2190 -5.2190 -5.1671 -5.1671 -4.8491 -4.8491 -4.7641 -4.7641 -2.9322 -2.9322 -2.8976 -2.8976 -2.8667 -2.8667 1.7565 1.7565 3.4753 3.4753 4.2991 4.2991 4.4251 4.4251 4.9142 4.9142 5.1049 5.1049 5.4917 5.4917 8.6445 8.6445 9.1304 9.1304 10.0235 10.0235 10.3779 10.3779 k = 0.7642-0.3245-0.7935 ( 4060 PWs) bands (ev): -35.5791 -35.5791 -16.5861 -16.5861 -15.1734 -15.1734 -15.1402 -15.1402 -5.2219 -5.2219 -5.1644 -5.1644 -4.8552 -4.8552 -4.7689 -4.7689 -2.9336 -2.9336 -2.8983 -2.8983 -2.8662 -2.8662 1.7350 1.7350 3.4728 3.4728 4.3365 4.3365 4.4434 4.4434 4.9095 4.9095 5.1170 5.1170 5.5103 5.5103 8.6553 8.6553 9.1370 9.1370 9.9970 9.9970 10.3509 10.3509 k = 0.7576-0.3130-0.7717 ( 4064 PWs) bands (ev): -35.5793 -35.5793 -16.5855 -16.5855 -15.1732 -15.1732 -15.1387 -15.1387 -5.2249 -5.2249 -5.1617 -5.1617 -4.8615 -4.8615 -4.7746 -4.7746 -2.9351 -2.9351 -2.8991 -2.8991 -2.8658 -2.8658 1.7119 1.7119 3.4753 3.4753 4.3702 4.3702 4.4663 4.4663 4.9031 4.9031 5.1276 5.1276 5.5306 5.5306 8.6709 8.6709 9.1493 9.1493 9.9732 9.9732 10.3220 10.3220 k = 0.7510-0.3016-0.7498 ( 4074 PWs) bands (ev): -35.5794 -35.5794 -16.5848 -16.5848 -15.1729 -15.1729 -15.1372 -15.1372 -5.2280 -5.2280 -5.1591 -5.1591 -4.8678 -4.8678 -4.7813 -4.7813 -2.9367 -2.9367 -2.8998 -2.8998 -2.8656 -2.8656 1.6875 1.6875 3.4828 3.4828 4.3994 4.3994 4.4938 4.4938 4.8957 4.8957 5.1361 5.1361 5.5530 5.5530 8.6915 8.6915 9.1665 9.1665 9.9530 9.9530 10.2924 10.2924 k = 0.7444-0.2901-0.7279 ( 4072 PWs) bands (ev): -35.5795 -35.5795 -16.5841 -16.5841 -15.1724 -15.1724 -15.1357 -15.1357 -5.2312 -5.2312 -5.1565 -5.1565 -4.8742 -4.8742 -4.7889 -4.7889 -2.9382 -2.9382 -2.9005 -2.9005 -2.8657 -2.8657 1.6618 1.6618 3.4953 3.4953 4.4237 4.4237 4.5254 4.5254 4.8878 4.8878 5.1423 5.1423 5.5779 5.5779 8.7172 8.7172 9.1878 9.1878 9.9371 9.9371 10.2628 10.2628 k = 0.7378-0.2787-0.7061 ( 4080 PWs) bands (ev): -35.5797 -35.5797 -16.5833 -16.5833 -15.1718 -15.1718 -15.1341 -15.1341 -5.2345 -5.2345 -5.1540 -5.1540 -4.8808 -4.8808 -4.7973 -4.7973 -2.9399 -2.9399 -2.9012 -2.9012 -2.8659 -2.8659 1.6352 1.6352 3.5126 3.5126 4.4422 4.4422 4.5611 4.5611 4.8804 4.8804 5.1458 5.1458 5.6056 5.6056 8.7479 8.7479 9.2124 9.2124 9.9257 9.9257 10.2340 10.2340 k = 0.7312-0.2672-0.6842 ( 4084 PWs) bands (ev): -35.5798 -35.5798 -16.5824 -16.5824 -15.1711 -15.1711 -15.1326 -15.1326 -5.2380 -5.2380 -5.1516 -5.1516 -4.8875 -4.8875 -4.8064 -4.8064 -2.9415 -2.9415 -2.9018 -2.9018 -2.8664 -2.8664 1.6080 1.6080 3.5347 3.5347 4.4543 4.4543 4.6006 4.6006 4.8742 4.8742 5.1465 5.1465 5.6363 5.6363 8.7835 8.7835 9.2394 9.2394 9.9187 9.9187 10.2072 10.2072 k = 0.7246-0.2557-0.6623 ( 4086 PWs) bands (ev): -35.5800 -35.5800 -16.5815 -16.5815 -15.1702 -15.1702 -15.1311 -15.1311 -5.2417 -5.2417 -5.1492 -5.1492 -4.8945 -4.8945 -4.8160 -4.8160 -2.9431 -2.9431 -2.9024 -2.9024 -2.8671 -2.8671 1.5802 1.5802 3.5614 3.5614 4.4595 4.4595 4.6437 4.6437 4.8701 4.8701 5.1445 5.1445 5.6701 5.6701 8.8236 8.8236 9.2677 9.2677 9.9151 9.9151 10.1835 10.1835 k = 0.7180-0.2443-0.6405 ( 4082 PWs) bands (ev): -35.5802 -35.5802 -16.5805 -16.5805 -15.1692 -15.1692 -15.1295 -15.1295 -5.2456 -5.2456 -5.1469 -5.1469 -4.9017 -4.9017 -4.8260 -4.8260 -2.9448 -2.9448 -2.9030 -2.9030 -2.8680 -2.8680 1.5522 1.5522 3.5923 3.5923 4.4578 4.4578 4.6900 4.6900 4.8685 4.8685 5.1399 5.1399 5.7068 5.7068 8.8678 8.8678 9.2968 9.2968 9.9132 9.9132 10.1648 10.1648 k = 0.7114-0.2328-0.6186 ( 4088 PWs) bands (ev): -35.5803 -35.5803 -16.5795 -16.5795 -15.1681 -15.1681 -15.1279 -15.1279 -5.2498 -5.2498 -5.1447 -5.1447 -4.9094 -4.9094 -4.8362 -4.8362 -2.9465 -2.9465 -2.9035 -2.9035 -2.8690 -2.8690 1.5242 1.5242 3.6271 3.6271 4.4498 4.4498 4.7385 4.7385 4.8697 4.8697 5.1333 5.1333 5.7465 5.7465 8.9156 8.9156 9.3260 9.3260 9.9106 9.9106 10.1534 10.1534 k = 0.7047-0.2214-0.5968 ( 4088 PWs) bands (ev): -35.5805 -35.5805 -16.5784 -16.5784 -15.1669 -15.1669 -15.1263 -15.1263 -5.2542 -5.2542 -5.1426 -5.1426 -4.9175 -4.9175 -4.8463 -4.8463 -2.9481 -2.9481 -2.9040 -2.9040 -2.8703 -2.8703 1.4963 1.4963 3.6652 3.6652 4.4366 4.4366 4.7877 4.7877 4.8744 4.8744 5.1251 5.1251 5.7890 5.7890 8.9664 8.9664 9.3550 9.3550 9.9045 9.9045 10.1511 10.1511 k = 0.6981-0.2099-0.5749 ( 4088 PWs) bands (ev): -35.5807 -35.5807 -16.5773 -16.5773 -15.1657 -15.1657 -15.1246 -15.1246 -5.2590 -5.2590 -5.1406 -5.1406 -4.9263 -4.9263 -4.8561 -4.8561 -2.9498 -2.9498 -2.9045 -2.9045 -2.8717 -2.8717 1.4688 1.4688 3.7060 3.7060 4.4199 4.4199 4.8311 4.8311 4.8876 4.8876 5.1163 5.1163 5.8341 5.8341 9.0192 9.0192 9.3834 9.3834 9.8936 9.8936 10.1586 10.1586 k = 0.6915-0.1985-0.5530 ( 4084 PWs) bands (ev): -35.5809 -35.5809 -16.5761 -16.5761 -15.1643 -15.1643 -15.1229 -15.1229 -5.2641 -5.2641 -5.1388 -5.1388 -4.9358 -4.9358 -4.8654 -4.8654 -2.9514 -2.9514 -2.9049 -2.9049 -2.8732 -2.8732 1.4418 1.4418 3.7482 3.7482 4.4015 4.4015 4.8546 4.8546 4.9211 4.9211 5.1084 5.1084 5.8816 5.8816 9.0732 9.0732 9.4109 9.4109 9.8781 9.8781 10.1747 10.1747 k = 0.6849-0.1870-0.5312 ( 4084 PWs) bands (ev): -35.5812 -35.5812 -16.5749 -16.5749 -15.1630 -15.1630 -15.1211 -15.1211 -5.2696 -5.2696 -5.1370 -5.1370 -4.9459 -4.9459 -4.8741 -4.8741 -2.9531 -2.9531 -2.9052 -2.9052 -2.8749 -2.8749 1.4156 1.4156 3.7904 3.7904 4.3838 4.3838 4.8629 4.8629 4.9664 4.9664 5.1049 5.1049 5.9314 5.9314 9.1275 9.1275 9.4371 9.4371 9.8596 9.8596 10.1977 10.1977 k = 0.6783-0.1755-0.5093 ( 4084 PWs) bands (ev): -35.5814 -35.5814 -16.5737 -16.5737 -15.1616 -15.1616 -15.1192 -15.1192 -5.2756 -5.2756 -5.1354 -5.1354 -4.9568 -4.9568 -4.8821 -4.8821 -2.9547 -2.9547 -2.9056 -2.9056 -2.8766 -2.8766 1.3901 1.3901 3.8301 3.8301 4.3699 4.3699 4.8660 4.8660 5.0031 5.0031 5.1155 5.1155 5.9832 5.9832 9.1809 9.1809 9.4611 9.4611 9.8398 9.8398 10.2264 10.2264 k = 0.6717-0.1641-0.4875 ( 4084 PWs) bands (ev): -35.5816 -35.5816 -16.5725 -16.5725 -15.1603 -15.1603 -15.1173 -15.1173 -5.2820 -5.2820 -5.1340 -5.1340 -4.9681 -4.9681 -4.8892 -4.8892 -2.9563 -2.9563 -2.9059 -2.9059 -2.8785 -2.8785 1.3656 1.3656 3.8642 3.8642 4.3633 4.3633 4.8667 4.8667 5.0174 5.0174 5.1513 5.1513 6.0369 6.0369 9.2325 9.2325 9.4818 9.4818 9.8203 9.8203 10.2606 10.2606 k = 0.6651-0.1526-0.4656 ( 4084 PWs) bands (ev): -35.5818 -35.5818 -16.5712 -16.5712 -15.1589 -15.1589 -15.1153 -15.1153 -5.2890 -5.2890 -5.1327 -5.1327 -4.9799 -4.9799 -4.8957 -4.8957 -2.9579 -2.9579 -2.9061 -2.9061 -2.8804 -2.8804 1.3420 1.3420 3.8888 3.8888 4.3682 4.3682 4.8653 4.8653 5.0154 5.0154 5.2053 5.2053 6.0924 6.0924 9.2813 9.2813 9.4979 9.4979 9.8025 9.8025 10.3009 10.3009 k = 0.6585-0.1412-0.4437 ( 4088 PWs) bands (ev): -35.5821 -35.5821 -16.5699 -16.5699 -15.1576 -15.1576 -15.1132 -15.1132 -5.2966 -5.2966 -5.1315 -5.1315 -4.9917 -4.9917 -4.9014 -4.9014 -2.9595 -2.9595 -2.9063 -2.9063 -2.8823 -2.8823 1.3196 1.3196 3.9011 3.9011 4.3876 4.3876 4.8623 4.8623 5.0075 5.0075 5.2669 5.2669 6.1495 6.1495 9.3264 9.3264 9.5083 9.5083 9.7874 9.7874 10.3479 10.3479 k = 0.6519-0.1297-0.4219 ( 4086 PWs) bands (ev): -35.5823 -35.5823 -16.5686 -16.5686 -15.1564 -15.1564 -15.1111 -15.1111 -5.3047 -5.3047 -5.1306 -5.1306 -5.0035 -5.0035 -4.9066 -4.9066 -2.9610 -2.9610 -2.9065 -2.9065 -2.8843 -2.8843 1.2984 1.2984 3.9002 3.9002 4.4223 4.4223 4.8581 4.8581 4.9981 4.9981 5.3318 5.3318 6.2081 6.2081 9.3668 9.3668 9.5125 9.5125 9.7759 9.7759 10.4017 10.4017 k = 0.6453-0.1183-0.4000 ( 4080 PWs) bands (ev): -35.5825 -35.5825 -16.5673 -16.5673 -15.1552 -15.1552 -15.1088 -15.1088 -5.3134 -5.3134 -5.1297 -5.1297 -5.0151 -5.0151 -4.9113 -4.9113 -2.9626 -2.9626 -2.9067 -2.9067 -2.8863 -2.8863 1.2783 1.2783 3.8877 3.8877 4.4701 4.4701 4.8531 4.8531 4.9888 4.9888 5.3981 5.3981 6.2679 6.2679 9.4012 9.4012 9.5111 9.5111 9.7687 9.7687 10.4599 10.4599 k = 0.6387-0.1068-0.3782 ( 4082 PWs) bands (ev): -35.5827 -35.5827 -16.5661 -16.5661 -15.1541 -15.1541 -15.1065 -15.1065 -5.3227 -5.3227 -5.1291 -5.1291 -5.0262 -5.0262 -4.9155 -4.9155 -2.9641 -2.9641 -2.9068 -2.9068 -2.8882 -2.8882 1.2595 1.2595 3.8667 3.8667 4.5267 4.5267 4.8484 4.8484 4.9807 4.9807 5.4649 5.4649 6.3288 6.3288 9.4276 9.4276 9.5056 9.5056 9.7663 9.7663 10.5112 10.5112 k = 0.6321-0.0953-0.3563 ( 4070 PWs) bands (ev): -35.5830 -35.5830 -16.5648 -16.5648 -15.1530 -15.1530 -15.1041 -15.1041 -5.3325 -5.3325 -5.1286 -5.1286 -5.0367 -5.0367 -4.9193 -4.9193 -2.9656 -2.9656 -2.9069 -2.9069 -2.8901 -2.8901 1.2419 1.2419 3.8399 3.8399 4.5869 4.5869 4.8456 4.8456 4.9755 4.9755 5.5317 5.5317 6.3906 6.3906 9.4434 9.4434 9.4991 9.4991 9.7694 9.7694 10.5255 10.5255 k = 0.6255-0.0839-0.3344 ( 4072 PWs) bands (ev): -35.5832 -35.5832 -16.5636 -16.5636 -15.1521 -15.1521 -15.1016 -15.1016 -5.3429 -5.3429 -5.1282 -5.1282 -5.0466 -5.0466 -4.9228 -4.9228 -2.9671 -2.9671 -2.9070 -2.9070 -2.8919 -2.8919 1.2256 1.2256 3.8094 3.8094 4.6434 4.6434 4.8475 4.8475 4.9758 4.9758 5.5978 5.5978 6.4531 6.4531 9.4458 9.4458 9.4947 9.4947 9.7782 9.7782 10.5032 10.5032 k = 0.6189-0.0724-0.3126 ( 4074 PWs) bands (ev): -35.5834 -35.5834 -16.5623 -16.5623 -15.1512 -15.1512 -15.0992 -15.0992 -5.3537 -5.3537 -5.1281 -5.1281 -5.0558 -5.0558 -4.9259 -4.9259 -2.9685 -2.9685 -2.9071 -2.9071 -2.8937 -2.8937 1.2105 1.2105 3.7769 3.7769 4.6864 4.6864 4.8560 4.8560 4.9882 4.9882 5.6630 5.6630 6.5160 6.5160 9.4373 9.4373 9.4912 9.4912 9.7924 9.7924 10.4658 10.4658 k = 0.6123-0.0610-0.2907 ( 4078 PWs) bands (ev): -35.5836 -35.5836 -16.5612 -16.5612 -15.1504 -15.1504 -15.0967 -15.0967 -5.3649 -5.3649 -5.1281 -5.1281 -5.0642 -5.0642 -4.9287 -4.9287 -2.9700 -2.9700 -2.9073 -2.9073 -2.8953 -2.8953 1.1966 1.1966 3.7433 3.7433 4.7094 4.7094 4.8665 4.8665 5.0230 5.0230 5.7269 5.7269 6.5791 6.5791 9.4234 9.4234 9.4851 9.4851 9.8108 9.8108 10.4197 10.4197 k = 0.6057-0.0495-0.2688 ( 4082 PWs) bands (ev): -35.5839 -35.5839 -16.5600 -16.5600 -15.1497 -15.1497 -15.0942 -15.0942 -5.3763 -5.3763 -5.1282 -5.1282 -5.0718 -5.0718 -4.9313 -4.9313 -2.9714 -2.9714 -2.9075 -2.9075 -2.8967 -2.8967 1.1840 1.1840 3.7096 3.7096 4.7163 4.7163 4.8712 4.8712 5.0834 5.0834 5.7892 5.7892 6.6420 6.6420 9.4076 9.4076 9.4753 9.4753 9.8316 9.8316 10.3661 10.3661 k = 0.5991-0.0381-0.2470 ( 4084 PWs) bands (ev): -35.5841 -35.5841 -16.5589 -16.5589 -15.1491 -15.1491 -15.0917 -15.0917 -5.3878 -5.3878 -5.1285 -5.1285 -5.0786 -5.0786 -4.9336 -4.9336 -2.9727 -2.9727 -2.9077 -2.9077 -2.8980 -2.8980 1.1724 1.1724 3.6762 3.6762 4.7144 4.7144 4.8697 4.8697 5.1614 5.1614 5.8495 5.8495 6.7044 6.7044 9.3912 9.3912 9.4625 9.4625 9.8528 9.8528 10.3053 10.3053 k = 0.5925-0.0266-0.2251 ( 4084 PWs) bands (ev): -35.5843 -35.5843 -16.5578 -16.5578 -15.1486 -15.1486 -15.0892 -15.0892 -5.3993 -5.3993 -5.1290 -5.1290 -5.0846 -5.0846 -4.9357 -4.9357 -2.9741 -2.9741 -2.9080 -2.9080 -2.8991 -2.8991 1.1620 1.1620 3.6437 3.6437 4.7085 4.7085 4.8649 4.8649 5.2493 5.2493 5.9078 5.9078 6.7659 6.7659 9.3749 9.3749 9.4478 9.4478 9.8726 9.8726 10.2380 10.2380 k = 0.5859-0.0151-0.2033 ( 4086 PWs) bands (ev): -35.5844 -35.5844 -16.5568 -16.5568 -15.1481 -15.1481 -15.0868 -15.0868 -5.4107 -5.4107 -5.1296 -5.1296 -5.0899 -5.0899 -4.9376 -4.9376 -2.9754 -2.9754 -2.9085 -2.9085 -2.8999 -2.8999 1.1526 1.1526 3.6123 3.6123 4.7007 4.7007 4.8586 4.8586 5.3422 5.3422 5.9638 5.9638 6.8261 6.8261 9.3589 9.3589 9.4321 9.4321 9.8885 9.8885 10.1659 10.1659 k = 0.5793-0.0037-0.1814 ( 4086 PWs) bands (ev): -35.5846 -35.5846 -16.5559 -16.5559 -15.1476 -15.1476 -15.0845 -15.0845 -5.4218 -5.4218 -5.1303 -5.1303 -5.0945 -5.0945 -4.9393 -4.9393 -2.9766 -2.9766 -2.9090 -2.9090 -2.9006 -2.9006 1.1442 1.1442 3.5825 3.5825 4.6922 4.6922 4.8516 4.8516 5.4374 5.4374 6.0175 6.0175 6.8846 6.8846 9.3433 9.3433 9.4165 9.4165 9.8955 9.8955 10.0943 10.0943 k = 0.5727 0.0078-0.1595 ( 4086 PWs) bands (ev): -35.5848 -35.5848 -16.5550 -16.5550 -15.1473 -15.1473 -15.0823 -15.0823 -5.4325 -5.4325 -5.1312 -5.1312 -5.0985 -5.0985 -4.9408 -4.9408 -2.9778 -2.9778 -2.9096 -2.9096 -2.9010 -2.9010 1.1368 1.1368 3.5543 3.5543 4.6835 4.6835 4.8444 4.8444 5.5329 5.5329 6.0687 6.0687 6.9410 6.9410 9.3277 9.3277 9.4018 9.4018 9.8810 9.8810 10.0370 10.0370 k = 0.5660 0.0192-0.1377 ( 4082 PWs) bands (ev): -35.5849 -35.5849 -16.5541 -16.5541 -15.1470 -15.1470 -15.0802 -15.0802 -5.4427 -5.4427 -5.1321 -5.1321 -5.1018 -5.1018 -4.9421 -4.9421 -2.9789 -2.9789 -2.9103 -2.9103 -2.9013 -2.9013 1.1303 1.1303 3.5281 3.5281 4.6751 4.6751 4.8374 4.8374 5.6270 5.6270 6.1177 6.1177 6.9946 6.9946 9.3115 9.3115 9.3885 9.3885 9.8296 9.8296 10.0113 10.0113 k = 0.5594 0.0307-0.1158 ( 4084 PWs) bands (ev): -35.5851 -35.5851 -16.5534 -16.5534 -15.1467 -15.1467 -15.0782 -15.0782 -5.4523 -5.4523 -5.1331 -5.1331 -5.1046 -5.1046 -4.9433 -4.9433 -2.9799 -2.9799 -2.9110 -2.9110 -2.9014 -2.9014 1.1246 1.1246 3.5039 3.5039 4.6672 4.6672 4.8307 4.8307 5.7180 5.7180 6.1647 6.1647 7.0451 7.0451 9.2942 9.2942 9.3774 9.3774 9.7532 9.7532 10.0078 10.0078 k = 0.5528 0.0421-0.0940 ( 4084 PWs) bands (ev): -35.5852 -35.5852 -16.5527 -16.5527 -15.1465 -15.1465 -15.0764 -15.0764 -5.4611 -5.4611 -5.1341 -5.1341 -5.1070 -5.1070 -4.9443 -4.9443 -2.9809 -2.9809 -2.9116 -2.9116 -2.9015 -2.9015 1.1196 1.1196 3.4819 3.4819 4.6599 4.6599 4.8244 4.8244 5.8040 5.8040 6.2098 6.2098 7.0920 7.0920 9.2749 9.2749 9.3685 9.3685 9.6699 9.6699 10.0116 10.0116 k = 0.5462 0.0536-0.0721 ( 4080 PWs) bands (ev): -35.5853 -35.5853 -16.5520 -16.5520 -15.1463 -15.1463 -15.0748 -15.0748 -5.4691 -5.4691 -5.1351 -5.1351 -5.1089 -5.1089 -4.9452 -4.9452 -2.9817 -2.9817 -2.9122 -2.9122 -2.9015 -2.9015 1.1154 1.1154 3.4623 3.4623 4.6532 4.6532 4.8188 4.8188 5.8831 5.8831 6.2533 6.2533 7.1349 7.1349 9.2525 9.2525 9.3620 9.3620 9.5892 9.5892 10.0169 10.0169 k = 0.5396 0.0651-0.0502 ( 4084 PWs) bands (ev): -35.5854 -35.5854 -16.5515 -16.5515 -15.1461 -15.1461 -15.0733 -15.0733 -5.4762 -5.4762 -5.1360 -5.1360 -5.1104 -5.1104 -4.9459 -4.9459 -2.9825 -2.9825 -2.9128 -2.9128 -2.9015 -2.9015 1.1119 1.1119 3.4451 3.4451 4.6474 4.6474 4.8138 4.8138 5.9532 5.9532 6.2956 6.2956 7.1732 7.1732 9.2256 9.2256 9.3574 9.3574 9.5171 9.5171 10.0220 10.0220 k = 0.5330 0.0765-0.0284 ( 4084 PWs) bands (ev): -35.5855 -35.5855 -16.5510 -16.5510 -15.1460 -15.1460 -15.0721 -15.0721 -5.4824 -5.4824 -5.1368 -5.1368 -5.1117 -5.1117 -4.9465 -4.9465 -2.9832 -2.9832 -2.9133 -2.9133 -2.9015 -2.9015 1.1090 1.1090 3.4304 3.4304 4.6424 4.6424 4.8094 4.8094 6.0129 6.0129 6.3362 6.3362 7.2066 7.2066 9.1935 9.1935 9.3545 9.3545 9.4580 9.4580 10.0263 10.0263 k = 0.5264 0.0880-0.0065 ( 4084 PWs) bands (ev): -35.5856 -35.5856 -16.5507 -16.5507 -15.1459 -15.1459 -15.0710 -15.0710 -5.4875 -5.4875 -5.1375 -5.1375 -5.1126 -5.1126 -4.9470 -4.9470 -2.9837 -2.9837 -2.9137 -2.9137 -2.9014 -2.9014 1.1067 1.1067 3.4182 3.4182 4.6382 4.6382 4.8059 4.8059 6.0610 6.0610 6.3741 6.3741 7.2347 7.2347 9.1574 9.1574 9.3528 9.3528 9.4140 9.4140 10.0298 10.0298 k = 0.5198 0.0994 0.0154 ( 4078 PWs) bands (ev): -35.5856 -35.5856 -16.5504 -16.5504 -15.1458 -15.1458 -15.0702 -15.0702 -5.4915 -5.4915 -5.1381 -5.1381 -5.1133 -5.1133 -4.9474 -4.9474 -2.9842 -2.9842 -2.9140 -2.9140 -2.9014 -2.9014 1.1049 1.1049 3.4087 3.4087 4.6350 4.6350 4.8030 4.8030 6.0975 6.0975 6.4074 6.4074 7.2571 7.2571 9.1214 9.1214 9.3519 9.3519 9.3839 9.3839 10.0323 10.0323 k = 0.5132 0.1109 0.0372 ( 4070 PWs) bands (ev): -35.5857 -35.5857 -16.5501 -16.5501 -15.1457 -15.1457 -15.0696 -15.0696 -5.4944 -5.4944 -5.1385 -5.1385 -5.1138 -5.1138 -4.9477 -4.9477 -2.9845 -2.9845 -2.9142 -2.9142 -2.9013 -2.9013 1.1036 1.1036 3.4019 3.4019 4.6327 4.6327 4.8010 4.8010 6.1228 6.1228 6.4337 6.4337 7.2734 7.2734 9.0909 9.0909 9.3516 9.3516 9.3650 9.3650 10.0341 10.0341 k = 0.5066 0.1223 0.0591 ( 4070 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0693 -15.0693 -5.4962 -5.4962 -5.1388 -5.1388 -5.1141 -5.1141 -4.9479 -4.9479 -2.9847 -2.9847 -2.9143 -2.9143 -2.9013 -2.9013 1.1029 1.1029 3.3978 3.3978 4.6313 4.6313 4.7998 4.7998 6.1376 6.1376 6.4505 6.4505 7.2834 7.2834 9.0706 9.0706 9.3515 9.3515 9.3547 9.3547 10.0352 10.0352 k = 0.5000 0.1338 0.0809 ( 4082 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.4967 -5.4967 -5.1389 -5.1389 -5.1142 -5.1142 -4.9479 -4.9479 -2.9847 -2.9847 -2.9144 -2.9144 -2.9013 -2.9013 1.1026 1.1026 3.3965 3.3965 4.6308 4.6308 4.7994 4.7994 6.1424 6.1424 6.4563 6.4563 7.2867 7.2867 9.0636 9.0636 9.3512 9.3512 9.3516 9.3516 10.0355 10.0355 k = 0.5000 0.1338 0.0809 ( 4082 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.4967 -5.4967 -5.1389 -5.1389 -5.1142 -5.1142 -4.9479 -4.9479 -2.9847 -2.9847 -2.9144 -2.9144 -2.9013 -2.9013 1.1026 1.1026 3.3965 3.3965 4.6308 4.6308 4.7994 4.7994 6.1424 6.1424 6.4563 6.4563 7.2867 7.2867 9.0636 9.0636 9.3512 9.3512 9.3516 9.3516 10.0355 10.0355 k = 0.4762 0.1274 0.0771 ( 4070 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.4974 -5.4974 -5.1389 -5.1389 -5.1138 -5.1138 -4.9474 -4.9474 -2.9847 -2.9847 -2.9144 -2.9144 -2.9013 -2.9013 1.1002 1.1002 3.4019 3.4019 4.6310 4.6310 4.7995 4.7995 6.1418 6.1418 6.4560 6.4560 7.2769 7.2769 9.0691 9.0691 9.3517 9.3517 9.3518 9.3518 10.0370 10.0370 k = 0.4524 0.1211 0.0732 ( 4070 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.4994 -5.4994 -5.1389 -5.1389 -5.1126 -5.1126 -4.9461 -4.9461 -2.9847 -2.9847 -2.9144 -2.9144 -2.9013 -2.9013 1.0930 1.0930 3.4179 3.4179 4.6317 4.6317 4.8000 4.8000 6.1399 6.1399 6.4550 6.4550 7.2482 7.2482 9.0853 9.0853 9.3521 9.3521 9.3534 9.3534 10.0413 10.0413 k = 0.4286 0.1147 0.0694 ( 4067 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5026 -5.5026 -5.1389 -5.1389 -5.1108 -5.1108 -4.9438 -4.9438 -2.9847 -2.9847 -2.9144 -2.9144 -2.9013 -2.9013 1.0813 1.0813 3.4444 3.4444 4.6327 4.6327 4.8007 4.8007 6.1367 6.1367 6.4533 6.4533 7.2019 7.2019 9.1104 9.1104 9.3526 9.3526 9.3562 9.3562 10.0483 10.0483 k = 0.4048 0.1083 0.0655 ( 4073 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5070 -5.5070 -5.1389 -5.1389 -5.1083 -5.1083 -4.9406 -4.9406 -2.9847 -2.9847 -2.9144 -2.9144 -2.9013 -2.9013 1.0655 1.0655 3.4808 3.4808 4.6342 4.6342 4.8017 4.8017 6.1322 6.1322 6.4511 6.4511 7.1404 7.1404 9.1423 9.1423 9.3534 9.3534 9.3603 9.3603 10.0577 10.0577 k = 0.3810 0.1019 0.0617 ( 4076 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5123 -5.5123 -5.1389 -5.1389 -5.1055 -5.1055 -4.9365 -4.9365 -2.9847 -2.9847 -2.9144 -2.9144 -2.9013 -2.9013 1.0463 1.0463 3.5265 3.5265 4.6361 4.6361 4.8030 4.8030 6.1263 6.1263 6.4482 6.4482 7.0660 7.0660 9.1781 9.1781 9.3543 9.3543 9.3663 9.3663 10.0690 10.0690 k = 0.3571 0.0956 0.0578 ( 4084 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5183 -5.5183 -5.1389 -5.1389 -5.1024 -5.1024 -4.9317 -4.9317 -2.9848 -2.9848 -2.9144 -2.9144 -2.9013 -2.9013 1.0243 1.0243 3.5808 3.5808 4.6383 4.6383 4.8045 4.8045 6.1189 6.1189 6.4449 6.4449 6.9814 6.9814 9.2150 9.2150 9.3553 9.3553 9.3747 9.3747 10.0817 10.0817 k = 0.3333 0.0892 0.0540 ( 4090 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5249 -5.5249 -5.1389 -5.1389 -5.0992 -5.0992 -4.9262 -4.9262 -2.9848 -2.9848 -2.9144 -2.9144 -2.9013 -2.9013 1.0002 1.0002 3.6431 3.6431 4.6408 4.6408 4.8062 4.8062 6.1099 6.1099 6.4412 6.4412 6.8889 6.8889 9.2499 9.2499 9.3565 9.3565 9.3869 9.3869 10.0950 10.0950 k = 0.3095 0.0828 0.0501 ( 4084 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5318 -5.5318 -5.1389 -5.1389 -5.0960 -5.0960 -4.9200 -4.9200 -2.9848 -2.9848 -2.9144 -2.9144 -2.9013 -2.9013 0.9746 0.9746 3.7126 3.7126 4.6437 4.6437 4.8080 4.8080 6.0988 6.0988 6.4371 6.4371 6.7908 6.7908 9.2798 9.2798 9.3578 9.3578 9.4045 9.4045 10.1084 10.1084 k = 0.2857 0.0765 0.0463 ( 4090 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5389 -5.5389 -5.1389 -5.1389 -5.0930 -5.0930 -4.9134 -4.9134 -2.9848 -2.9848 -2.9144 -2.9144 -2.9013 -2.9013 0.9483 0.9483 3.7885 3.7885 4.6470 4.6470 4.8100 4.8100 6.0850 6.0850 6.4327 6.4327 6.6894 6.6894 9.3027 9.3027 9.3591 9.3591 9.4282 9.4282 10.1211 10.1211 k = 0.2619 0.0701 0.0424 ( 4093 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5461 -5.5461 -5.1389 -5.1389 -5.0902 -5.0902 -4.9065 -4.9065 -2.9848 -2.9848 -2.9144 -2.9144 -2.9013 -2.9013 0.9219 0.9219 3.8700 3.8700 4.6505 4.6505 4.8120 4.8120 6.0672 6.0672 6.4282 6.4282 6.5875 6.5875 9.3188 9.3188 9.3605 9.3605 9.4570 9.4570 10.1325 10.1325 k = 0.2381 0.0637 0.0385 ( 4105 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5531 -5.5531 -5.1389 -5.1389 -5.0876 -5.0876 -4.8995 -4.8995 -2.9848 -2.9848 -2.9144 -2.9144 -2.9014 -2.9014 0.8959 0.8959 3.9565 3.9565 4.6544 4.6544 4.8141 4.8141 6.0433 6.0433 6.4237 6.4237 6.4885 6.4885 9.3302 9.3302 9.3618 9.3618 9.4884 9.4884 10.1422 10.1422 k = 0.2143 0.0573 0.0347 ( 4129 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5598 -5.5598 -5.1389 -5.1389 -5.0853 -5.0853 -4.8924 -4.8924 -2.9848 -2.9848 -2.9144 -2.9144 -2.9014 -2.9014 0.8709 0.8709 4.0470 4.0470 4.6587 4.6587 4.8161 4.8161 6.0095 6.0095 6.3972 6.3972 6.4192 6.4192 9.3385 9.3385 9.3630 9.3630 9.5204 9.5204 10.1499 10.1499 k = 0.1905 0.0510 0.0308 ( 4129 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5661 -5.5661 -5.1389 -5.1389 -5.0833 -5.0833 -4.8856 -4.8856 -2.9848 -2.9848 -2.9144 -2.9144 -2.9014 -2.9014 0.8473 0.8473 4.1407 4.1407 4.6637 4.6637 4.8181 4.8181 5.9608 5.9608 6.3196 6.3196 6.4148 6.4148 9.3448 9.3448 9.3643 9.3643 9.5515 9.5515 10.1552 10.1552 k = 0.1667 0.0446 0.0270 ( 4132 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5718 -5.5718 -5.1389 -5.1389 -5.0816 -5.0816 -4.8792 -4.8792 -2.9849 -2.9849 -2.9144 -2.9144 -2.9014 -2.9014 0.8256 0.8256 4.2364 4.2364 4.6698 4.6698 4.8200 4.8200 5.8934 5.8934 6.2604 6.2604 6.4107 6.4107 9.3498 9.3498 9.3654 9.3654 9.5809 9.5809 10.1584 10.1584 k = 0.1429 0.0382 0.0231 ( 4135 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5770 -5.5770 -5.1389 -5.1389 -5.0802 -5.0802 -4.8733 -4.8733 -2.9849 -2.9849 -2.9144 -2.9144 -2.9014 -2.9014 0.8061 0.8061 4.3320 4.3320 4.6781 4.6781 4.8218 4.8218 5.8089 5.8089 6.2193 6.2193 6.4070 6.4070 9.3539 9.3539 9.3664 9.3664 9.6079 9.6079 10.1595 10.1595 k = 0.1190 0.0319 0.0193 ( 4135 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5815 -5.5815 -5.1389 -5.1389 -5.0790 -5.0790 -4.8680 -4.8680 -2.9849 -2.9849 -2.9144 -2.9144 -2.9014 -2.9014 0.7892 0.7892 4.4242 4.4242 4.6911 4.6911 4.8233 4.8233 5.7126 5.7126 6.1919 6.1919 6.4036 6.4036 9.3572 9.3572 9.3673 9.3673 9.6320 9.6320 10.1591 10.1591 k = 0.0952 0.0255 0.0154 ( 4138 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5853 -5.5853 -5.1389 -5.1389 -5.0780 -5.0780 -4.8636 -4.8636 -2.9849 -2.9849 -2.9144 -2.9144 -2.9014 -2.9014 0.7749 0.7749 4.5056 4.5056 4.7146 4.7146 4.8246 4.8246 5.6106 5.6106 6.1737 6.1737 6.4008 6.4008 9.3598 9.3598 9.3680 9.3680 9.6527 9.6527 10.1575 10.1575 k = 0.0714 0.0191 0.0116 ( 4132 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5883 -5.5883 -5.1389 -5.1389 -5.0772 -5.0772 -4.8600 -4.8600 -2.9849 -2.9849 -2.9144 -2.9144 -2.9014 -2.9014 0.7637 0.7637 4.5644 4.5644 4.7578 4.7578 4.8257 4.8257 5.5088 5.5088 6.1615 6.1615 6.3985 6.3985 9.3617 9.3617 9.3686 9.3686 9.6696 9.6696 10.1555 10.1555 k = 0.0476 0.0127 0.0077 ( 4132 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5905 -5.5905 -5.1389 -5.1389 -5.0767 -5.0767 -4.8574 -4.8574 -2.9849 -2.9849 -2.9144 -2.9144 -2.9014 -2.9014 0.7555 0.7555 4.5961 4.5961 4.8201 4.8201 4.8265 4.8265 5.4139 5.4139 6.1538 6.1538 6.3968 6.3968 9.3631 9.3631 9.3690 9.3690 9.6820 9.6820 10.1534 10.1534 k = 0.0238 0.0064 0.0039 ( 4141 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5918 -5.5918 -5.1389 -5.1389 -5.0764 -5.0764 -4.8558 -4.8558 -2.9849 -2.9849 -2.9144 -2.9144 -2.9015 -2.9015 0.7506 0.7506 4.6099 4.6099 4.8270 4.8270 4.8807 4.8807 5.3388 5.3388 6.1494 6.1494 6.3958 6.3958 9.3639 9.3639 9.3693 9.3693 9.6897 9.6897 10.1520 10.1520 k = 0.0000 0.0000 0.0000 ( 4147 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5922 -5.5922 -5.1390 -5.1390 -5.0763 -5.0763 -4.8552 -4.8552 -2.9849 -2.9849 -2.9144 -2.9144 -2.9015 -2.9015 0.7489 0.7489 4.6138 4.6138 4.8271 4.8271 4.9076 4.9076 5.3077 5.3077 6.1480 6.1480 6.3955 6.3955 9.3642 9.3642 9.3693 9.3693 9.6923 9.6923 10.1514 10.1514 k = 0.0000 0.0000 0.0000 ( 4147 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.5922 -5.5922 -5.1390 -5.1390 -5.0763 -5.0763 -4.8552 -4.8552 -2.9849 -2.9849 -2.9144 -2.9144 -2.9015 -2.9015 0.7489 0.7489 4.6138 4.6138 4.8271 4.8271 4.9076 4.9076 5.3077 5.3077 6.1480 6.1480 6.3955 6.3955 9.3642 9.3642 9.3693 9.3693 9.6923 9.6923 10.1514 10.1514 k = 0.0066-0.0114-0.0217 ( 4137 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0693 -15.0693 -5.5914 -5.5914 -5.1390 -5.1390 -5.0765 -5.0765 -4.8551 -4.8551 -2.9848 -2.9848 -2.9144 -2.9144 -2.9014 -2.9014 0.7501 0.7501 4.6112 4.6112 4.8226 4.8226 4.9043 4.9043 5.3163 5.3163 6.1467 6.1467 6.3933 6.3933 9.3652 9.3652 9.3708 9.3708 9.6950 9.6950 10.1462 10.1462 k = 0.0131-0.0228-0.0435 ( 4131 PWs) bands (ev): -35.5857 -35.5857 -16.5502 -16.5502 -15.1457 -15.1457 -15.0696 -15.0696 -5.5891 -5.5891 -5.1392 -5.1392 -5.0770 -5.0770 -4.8545 -4.8545 -2.9846 -2.9846 -2.9142 -2.9142 -2.9014 -2.9014 0.7536 0.7536 4.6030 4.6030 4.8097 4.8097 4.8956 4.8956 5.3403 5.3403 6.1428 6.1428 6.3869 6.3869 9.3662 9.3662 9.3771 9.3771 9.7035 9.7035 10.1308 10.1308 k = 0.0197-0.0342-0.0652 ( 4125 PWs) bands (ev): -35.5857 -35.5857 -16.5504 -16.5504 -15.1458 -15.1458 -15.0702 -15.0702 -5.5852 -5.5852 -5.1395 -5.1395 -5.0779 -5.0779 -4.8537 -4.8537 -2.9842 -2.9842 -2.9139 -2.9139 -2.9013 -2.9013 0.7594 0.7594 4.5884 4.5884 4.7910 4.7910 4.8839 4.8839 5.3757 5.3757 6.1366 6.1366 6.3765 6.3765 9.3664 9.3664 9.3881 9.3881 9.7182 9.7182 10.1056 10.1056 k = 0.0263-0.0456-0.0869 ( 4125 PWs) bands (ev): -35.5856 -35.5856 -16.5507 -16.5507 -15.1458 -15.1458 -15.0710 -15.0710 -5.5798 -5.5798 -5.1400 -5.1400 -5.0791 -5.0791 -4.8525 -4.8525 -2.9837 -2.9837 -2.9136 -2.9136 -2.9011 -2.9011 0.7676 0.7676 4.5666 4.5666 4.7694 4.7694 4.8707 4.8707 5.4185 5.4185 6.1283 6.1283 6.3624 6.3624 9.3666 9.3666 9.4019 9.4019 9.7397 9.7397 10.0717 10.0717 k = 0.0328-0.0570-0.1087 ( 4119 PWs) bands (ev): -35.5855 -35.5855 -16.5510 -16.5510 -15.1459 -15.1459 -15.0720 -15.0720 -5.5728 -5.5728 -5.1407 -5.1407 -5.0805 -5.0805 -4.8510 -4.8510 -2.9831 -2.9831 -2.9131 -2.9131 -2.9010 -2.9010 0.7780 0.7780 4.5373 4.5373 4.7470 4.7470 4.8573 4.8573 5.4653 5.4653 6.1183 6.1183 6.3450 6.3450 9.3673 9.3673 9.4168 9.4168 9.7686 9.7686 10.0304 10.0304 k = 0.0394-0.0683-0.1304 ( 4111 PWs) bands (ev): -35.5854 -35.5854 -16.5515 -16.5515 -15.1461 -15.1461 -15.0733 -15.0733 -5.5644 -5.5644 -5.1415 -5.1415 -5.0821 -5.0821 -4.8492 -4.8492 -2.9823 -2.9823 -2.9125 -2.9125 -2.9007 -2.9007 0.7907 0.7907 4.5015 4.5015 4.7236 4.7236 4.8447 4.8447 5.5135 5.5135 6.1070 6.1070 6.3247 6.3247 9.3686 9.3686 9.4314 9.4314 9.8054 9.8054 9.9830 9.9830 k = 0.0460-0.0797-0.1522 ( 4111 PWs) bands (ev): -35.5853 -35.5853 -16.5520 -16.5520 -15.1462 -15.1462 -15.0747 -15.0747 -5.5546 -5.5546 -5.1426 -5.1426 -5.0839 -5.0839 -4.8472 -4.8472 -2.9815 -2.9815 -2.9120 -2.9120 -2.9004 -2.9004 0.8056 0.8056 4.4610 4.4610 4.6978 4.6978 4.8345 4.8345 5.5611 5.5611 6.0950 6.0950 6.3019 6.3019 9.3709 9.3709 9.4447 9.4447 9.8496 9.8496 9.9314 9.9314 k = 0.0525-0.0911-0.1739 ( 4105 PWs) bands (ev): -35.5852 -35.5852 -16.5526 -16.5526 -15.1464 -15.1464 -15.0763 -15.0763 -5.5433 -5.5433 -5.1439 -5.1439 -5.0858 -5.0858 -4.8449 -4.8449 -2.9805 -2.9805 -2.9113 -2.9113 -2.9000 -2.9000 0.8228 0.8228 4.4175 4.4175 4.6678 4.6678 4.8273 4.8273 5.6064 5.6064 6.0830 6.0830 6.2773 6.2773 9.3744 9.3744 9.4561 9.4561 9.8743 9.8743 9.9032 9.9032 k = 0.0591-0.1025-0.1956 ( 4109 PWs) bands (ev): -35.5851 -35.5851 -16.5533 -16.5533 -15.1466 -15.1466 -15.0781 -15.0781 -5.5307 -5.5307 -5.1454 -5.1454 -5.0877 -5.0877 -4.8425 -4.8425 -2.9794 -2.9794 -2.9107 -2.9107 -2.8994 -2.8994 0.8420 0.8420 4.3726 4.3726 4.6330 4.6330 4.8234 4.8234 5.6477 5.6477 6.0715 6.0715 6.2512 6.2512 9.3793 9.3793 9.4654 9.4654 9.8199 9.8199 9.9589 9.9589 k = 0.0657-0.1139-0.2174 ( 4109 PWs) bands (ev): -35.5850 -35.5850 -16.5541 -16.5541 -15.1469 -15.1469 -15.0801 -15.0801 -5.5168 -5.5168 -5.1472 -5.1472 -5.0895 -5.0895 -4.8399 -4.8399 -2.9782 -2.9782 -2.9100 -2.9100 -2.8988 -2.8988 0.8633 0.8633 4.3273 4.3273 4.5934 4.5934 4.8224 4.8224 5.6833 5.6833 6.0613 6.0613 6.2242 6.2242 9.3859 9.3859 9.4724 9.4724 9.7648 9.7648 10.0198 10.0198 k = 0.0722-0.1253-0.2391 ( 4107 PWs) bands (ev): -35.5848 -35.5848 -16.5549 -16.5549 -15.1472 -15.1472 -15.0821 -15.0821 -5.5018 -5.5018 -5.1492 -5.1492 -5.0913 -5.0913 -4.8372 -4.8372 -2.9770 -2.9770 -2.9094 -2.9094 -2.8979 -2.8979 0.8866 0.8866 4.2824 4.2824 4.5496 4.5496 4.8237 4.8237 5.7116 5.7116 6.0531 6.0531 6.1969 6.1969 9.3939 9.3939 9.4769 9.4769 9.7121 9.7121 10.0827 10.0827 k = 0.0788-0.1367-0.2608 ( 4095 PWs) bands (ev): -35.5846 -35.5846 -16.5558 -16.5558 -15.1476 -15.1476 -15.0843 -15.0843 -5.4855 -5.4855 -5.1516 -5.1516 -5.0929 -5.0929 -4.8343 -4.8343 -2.9757 -2.9757 -2.9089 -2.9089 -2.8969 -2.8969 0.9118 0.9118 4.2386 4.2386 4.5021 4.5021 4.8265 4.8265 5.7310 5.7310 6.0471 6.0471 6.1699 6.1699 9.4028 9.4028 9.4788 9.4788 9.6642 9.6642 10.1446 10.1446 k = 0.0854-0.1481-0.2826 ( 4097 PWs) bands (ev): -35.5845 -35.5845 -16.5567 -16.5567 -15.1480 -15.1480 -15.0866 -15.0866 -5.4683 -5.4683 -5.1542 -5.1542 -5.0942 -5.0942 -4.8314 -4.8314 -2.9743 -2.9743 -2.9084 -2.9084 -2.8958 -2.8958 0.9389 0.9389 4.1961 4.1961 4.4517 4.4517 4.8305 4.8305 5.7405 5.7405 6.0429 6.0429 6.1440 6.1440 9.4108 9.4108 9.4777 9.4777 9.6240 9.6240 10.1996 10.1996 k = 0.0919-0.1595-0.3043 ( 4095 PWs) bands (ev): -35.5843 -35.5843 -16.5577 -16.5577 -15.1485 -15.1485 -15.0890 -15.0890 -5.4500 -5.4500 -5.1571 -5.1571 -5.0954 -5.0954 -4.8285 -4.8285 -2.9729 -2.9729 -2.9081 -2.9081 -2.8944 -2.8944 0.9677 0.9677 4.1555 4.1555 4.3991 4.3991 4.8352 4.8352 5.7400 5.7400 6.0390 6.0390 6.1207 6.1207 9.4135 9.4135 9.4756 9.4756 9.5949 9.5949 10.2344 10.2344 k = 0.0985-0.1709-0.3260 ( 4089 PWs) bands (ev): -35.5841 -35.5841 -16.5588 -16.5588 -15.1490 -15.1490 -15.0914 -15.0914 -5.4309 -5.4309 -5.1602 -5.1602 -5.0962 -5.0962 -4.8255 -4.8255 -2.9715 -2.9715 -2.9077 -2.9077 -2.8930 -2.8930 0.9981 0.9981 4.1168 4.1168 4.3450 4.3450 4.8401 4.8401 5.7303 5.7303 6.0321 6.0321 6.1017 6.1017 9.4036 9.4036 9.4785 9.4785 9.5785 9.5785 10.2290 10.2290 k = 0.1051-0.1823-0.3478 ( 4087 PWs) bands (ev): -35.5839 -35.5839 -16.5599 -16.5599 -15.1496 -15.1496 -15.0939 -15.0939 -5.4111 -5.4111 -5.1635 -5.1635 -5.0967 -5.0967 -4.8225 -4.8225 -2.9700 -2.9700 -2.9075 -2.9075 -2.8914 -2.8914 1.0300 1.0300 4.0802 4.0802 4.2902 4.2902 4.8450 4.8450 5.7128 5.7128 6.0191 6.0191 6.0883 6.0883 9.3816 9.3816 9.4877 9.4877 9.5726 9.5726 10.1900 10.1900 k = 0.1116-0.1937-0.3695 ( 4091 PWs) bands (ev): -35.5837 -35.5837 -16.5610 -16.5610 -15.1503 -15.1503 -15.0964 -15.0964 -5.3907 -5.3907 -5.1670 -5.1670 -5.0969 -5.0969 -4.8195 -4.8195 -2.9685 -2.9685 -2.9073 -2.9073 -2.8897 -2.8897 1.0633 1.0633 4.0459 4.0459 4.2352 4.2352 4.8494 4.8494 5.6888 5.6888 6.0002 6.0002 6.0788 6.0788 9.3542 9.3542 9.4990 9.4990 9.5739 9.5739 10.1427 10.1427 k = 0.1182-0.2050-0.3913 ( 4093 PWs) bands (ev): -35.5834 -35.5834 -16.5622 -16.5622 -15.1511 -15.1511 -15.0989 -15.0989 -5.3699 -5.3699 -5.1705 -5.1705 -5.0967 -5.0967 -4.8166 -4.8166 -2.9670 -2.9670 -2.9071 -2.9071 -2.8879 -2.8879 1.0978 1.0978 4.0139 4.0139 4.1808 4.1808 4.8531 4.8531 5.6598 5.6598 5.9776 5.9776 6.0694 6.0694 9.3257 9.3257 9.5095 9.5095 9.5794 9.5794 10.1012 10.1012 k = 0.1248-0.2164-0.4130 ( 4089 PWs) bands (ev): -35.5832 -35.5832 -16.5634 -16.5634 -15.1520 -15.1520 -15.1014 -15.1014 -5.3489 -5.3489 -5.1740 -5.1740 -5.0960 -5.0960 -4.8137 -4.8137 -2.9655 -2.9655 -2.9070 -2.9070 -2.8861 -2.8861 1.1333 1.1333 3.9844 3.9844 4.1276 4.1276 4.8556 4.8556 5.6270 5.6270 5.9529 5.9529 6.0575 6.0575 9.2983 9.2983 9.5184 9.5184 9.5859 9.5859 10.0721 10.0721 k = 0.1313-0.2278-0.4347 ( 4085 PWs) bands (ev): -35.5830 -35.5830 -16.5647 -16.5647 -15.1529 -15.1529 -15.1038 -15.1038 -5.3278 -5.3278 -5.1775 -5.1775 -5.0948 -5.0948 -4.8108 -4.8108 -2.9640 -2.9640 -2.9069 -2.9069 -2.8842 -2.8842 1.1696 1.1696 3.9572 3.9572 4.0761 4.0761 4.8565 4.8565 5.5912 5.5912 5.9267 5.9267 6.0417 6.0417 9.2726 9.2726 9.5261 9.5261 9.5904 9.5904 10.0592 10.0592 k = 0.1379-0.2392-0.4565 ( 4087 PWs) bands (ev): -35.5828 -35.5828 -16.5659 -16.5659 -15.1539 -15.1539 -15.1062 -15.1062 -5.3070 -5.3070 -5.1808 -5.1808 -5.0930 -5.0930 -4.8080 -4.8080 -2.9624 -2.9624 -2.9068 -2.9068 -2.8823 -2.8823 1.2067 1.2067 3.9324 3.9324 4.0271 4.0271 4.8555 4.8555 5.5534 5.5534 5.8993 5.8993 6.0213 6.0213 9.2488 9.2488 9.5334 9.5334 9.5912 9.5912 10.0637 10.0637 k = 0.1445-0.2506-0.4782 ( 4087 PWs) bands (ev): -35.5825 -35.5825 -16.5672 -16.5672 -15.1550 -15.1550 -15.1085 -15.1085 -5.2869 -5.2869 -5.1838 -5.1838 -5.0904 -5.0904 -4.8053 -4.8053 -2.9609 -2.9609 -2.9067 -2.9067 -2.8805 -2.8805 1.2441 1.2441 3.9098 3.9098 3.9811 3.9811 4.8520 4.8520 5.5142 5.5142 5.8709 5.8709 5.9963 5.9963 9.2268 9.2268 9.5410 9.5410 9.5884 9.5884 10.0849 10.0849 k = 0.1510-0.2620-0.4999 ( 4087 PWs) bands (ev): -35.5823 -35.5823 -16.5685 -16.5685 -15.1562 -15.1562 -15.1108 -15.1108 -5.2679 -5.2679 -5.1863 -5.1863 -5.0868 -5.0868 -4.8027 -4.8027 -2.9594 -2.9594 -2.9067 -2.9067 -2.8786 -2.8786 1.2818 1.2818 3.8893 3.8893 3.9388 3.9388 4.8457 4.8457 5.4741 5.4741 5.8417 5.8417 5.9668 5.9668 9.2067 9.2067 9.5493 9.5493 9.5838 9.5838 10.1201 10.1201 k = 0.1576-0.2734-0.5217 ( 4087 PWs) bands (ev): -35.5821 -35.5821 -16.5697 -16.5697 -15.1574 -15.1574 -15.1129 -15.1129 -5.2509 -5.2509 -5.1879 -5.1879 -5.0819 -5.0819 -4.8002 -4.8002 -2.9579 -2.9579 -2.9066 -2.9066 -2.8769 -2.8769 1.3195 1.3195 3.8700 3.8700 3.9014 3.9014 4.8361 4.8361 5.4337 5.4337 5.8118 5.8118 5.9331 5.9331 9.1883 9.1883 9.5576 9.5576 9.5803 9.5803 10.1662 10.1662 k = 0.1642-0.2848-0.5434 ( 4085 PWs) bands (ev): -35.5819 -35.5819 -16.5710 -16.5710 -15.1587 -15.1587 -15.1150 -15.1150 -5.2368 -5.2368 -5.1881 -5.1881 -5.0754 -5.0754 -4.7977 -4.7977 -2.9564 -2.9564 -2.9065 -2.9065 -2.8752 -2.8752 1.3569 1.3569 3.8495 3.8495 3.8717 3.8717 4.8226 4.8226 5.3934 5.3934 5.7814 5.7814 5.8959 5.8959 9.1715 9.1715 9.5625 9.5625 9.5829 9.5829 10.2202 10.2202 k = 0.1707-0.2962-0.5651 ( 4091 PWs) bands (ev): -35.5816 -35.5816 -16.5723 -16.5723 -15.1601 -15.1601 -15.1170 -15.1170 -5.2270 -5.2270 -5.1859 -5.1859 -5.0669 -5.0669 -4.7954 -4.7954 -2.9549 -2.9549 -2.9064 -2.9064 -2.8735 -2.8735 1.3938 1.3938 3.8257 3.8257 3.8523 3.8523 4.8050 4.8050 5.3535 5.3535 5.7507 5.7507 5.8558 5.8558 9.1564 9.1564 9.5628 9.5628 9.5939 9.5939 10.2796 10.2796 k = 0.1773-0.3076-0.5869 ( 4089 PWs) bands (ev): -35.5814 -35.5814 -16.5735 -16.5735 -15.1614 -15.1614 -15.1189 -15.1189 -5.2217 -5.2217 -5.1813 -5.1813 -5.0562 -5.0562 -4.7932 -4.7932 -2.9533 -2.9533 -2.9063 -2.9063 -2.8720 -2.8720 1.4300 1.4300 3.8027 3.8027 3.8393 3.8393 4.7828 4.7828 5.3145 5.3145 5.7197 5.7197 5.8137 5.8137 9.1428 9.1428 9.5626 9.5626 9.6093 9.6093 10.3417 10.3417 k = 0.1839-0.3190-0.6086 ( 4085 PWs) bands (ev): -35.5812 -35.5812 -16.5747 -16.5747 -15.1628 -15.1628 -15.1208 -15.1208 -5.2198 -5.2198 -5.1756 -5.1756 -5.0435 -5.0435 -4.7911 -4.7911 -2.9518 -2.9518 -2.9061 -2.9061 -2.8706 -2.8706 1.4653 1.4653 3.7837 3.7837 3.8295 3.8295 4.7558 4.7558 5.2766 5.2766 5.6878 5.6878 5.7710 5.7710 9.1308 9.1308 9.5637 9.5637 9.6275 9.6275 10.4041 10.4041 k = 0.1904-0.3304-0.6304 ( 4075 PWs) bands (ev): -35.5810 -35.5810 -16.5759 -16.5759 -15.1641 -15.1641 -15.1226 -15.1226 -5.2198 -5.2198 -5.1701 -5.1701 -5.0289 -5.0289 -4.7891 -4.7891 -2.9503 -2.9503 -2.9059 -2.9059 -2.8693 -2.8693 1.4994 1.4994 3.7699 3.7699 3.8220 3.8220 4.7240 4.7240 5.2400 5.2400 5.6538 5.6538 5.7297 5.7297 9.1199 9.1199 9.5662 9.5662 9.6477 9.6477 10.4641 10.4641 k = 0.1970-0.3417-0.6521 ( 4071 PWs) bands (ev): -35.5808 -35.5808 -16.5771 -16.5771 -15.1654 -15.1654 -15.1243 -15.1243 -5.2205 -5.2205 -5.1656 -5.1656 -5.0128 -5.0128 -4.7872 -4.7872 -2.9488 -2.9488 -2.9057 -2.9057 -2.8682 -2.8682 1.5321 1.5321 3.7617 3.7617 3.8163 3.8163 4.6876 4.6876 5.2050 5.2050 5.6157 5.6157 5.6923 5.6923 9.1101 9.1101 9.5700 9.5700 9.6695 9.6695 10.5184 10.5184 k = 0.2036-0.3531-0.6738 ( 4061 PWs) bands (ev): -35.5806 -35.5806 -16.5782 -16.5782 -15.1667 -15.1667 -15.1259 -15.1259 -5.2216 -5.2216 -5.1622 -5.1622 -4.9959 -4.9959 -4.7854 -4.7854 -2.9473 -2.9473 -2.9054 -2.9054 -2.8672 -2.8672 1.5634 1.5634 3.7594 3.7594 3.8123 3.8123 4.6467 4.6467 5.1718 5.1718 5.5726 5.5726 5.6606 5.6606 9.1010 9.1010 9.5748 9.5748 9.6925 9.6925 10.5636 10.5636 k = 0.2101-0.3645-0.6956 ( 4065 PWs) bands (ev): -35.5804 -35.5804 -16.5793 -16.5793 -15.1679 -15.1679 -15.1276 -15.1276 -5.2226 -5.2226 -5.1598 -5.1598 -4.9784 -4.9784 -4.7837 -4.7837 -2.9458 -2.9458 -2.9052 -2.9052 -2.8664 -2.8664 1.5931 1.5931 3.7628 3.7628 3.8098 3.8098 4.6018 4.6018 5.1406 5.1406 5.5253 5.5253 5.6341 5.6341 9.0922 9.0922 9.5801 9.5801 9.7163 9.7163 10.5962 10.5962 k = 0.2167-0.3759-0.7173 ( 4067 PWs) bands (ev): -35.5802 -35.5802 -16.5803 -16.5803 -15.1690 -15.1690 -15.1292 -15.1292 -5.2236 -5.2236 -5.1581 -5.1581 -4.9610 -4.9610 -4.7822 -4.7822 -2.9442 -2.9442 -2.9048 -2.9048 -2.8658 -2.8658 1.6211 1.6211 3.7717 3.7717 3.8087 3.8087 4.5535 4.5535 5.1115 5.1115 5.4753 5.4753 5.6113 5.6113 9.0833 9.0833 9.5857 9.5857 9.7404 9.7404 10.6135 10.6135 k = 0.2233-0.3873-0.7390 ( 4067 PWs) bands (ev): -35.5800 -35.5800 -16.5813 -16.5813 -15.1700 -15.1700 -15.1307 -15.1307 -5.2243 -5.2243 -5.1572 -5.1572 -4.9437 -4.9437 -4.7807 -4.7807 -2.9427 -2.9427 -2.9044 -2.9044 -2.8653 -2.8653 1.6475 1.6475 3.7851 3.7851 3.8096 3.8096 4.5026 4.5026 5.0846 5.0846 5.4242 5.4242 5.5912 5.5912 9.0739 9.0739 9.5912 9.5912 9.7643 9.7643 10.6139 10.6139 k = 0.2298-0.3987-0.7608 ( 4067 PWs) bands (ev): -35.5798 -35.5798 -16.5822 -16.5822 -15.1709 -15.1709 -15.1323 -15.1323 -5.2248 -5.2248 -5.1568 -5.1568 -4.9270 -4.9270 -4.7793 -4.7793 -2.9412 -2.9412 -2.9039 -2.9039 -2.8650 -2.8650 1.6723 1.6723 3.7980 3.7980 3.8172 3.8172 4.4497 4.4497 5.0599 5.0599 5.3730 5.3730 5.5728 5.5728 9.0634 9.0634 9.5967 9.5967 9.7874 9.7874 10.5976 10.5976 k = 0.2364-0.4101-0.7825 ( 4061 PWs) bands (ev): -35.5797 -35.5797 -16.5831 -16.5831 -15.1717 -15.1717 -15.1338 -15.1338 -5.2250 -5.2250 -5.1569 -5.1569 -4.9110 -4.9110 -4.7779 -4.7779 -2.9396 -2.9396 -2.9034 -2.9034 -2.8649 -2.8649 1.6954 1.6954 3.8029 3.8029 3.8380 3.8380 4.3959 4.3959 5.0374 5.0374 5.3225 5.3225 5.5557 5.5557 9.0513 9.0513 9.6021 9.6021 9.8091 9.8091 10.5677 10.5677 k = 0.2430-0.4215-0.8042 ( 4064 PWs) bands (ev): -35.5795 -35.5795 -16.5839 -16.5839 -15.1723 -15.1723 -15.1353 -15.1353 -5.2249 -5.2249 -5.1574 -5.1574 -4.8958 -4.8958 -4.7766 -4.7766 -2.9381 -2.9381 -2.9028 -2.9028 -2.8649 -2.8649 1.7170 1.7170 3.8048 3.8048 3.8663 3.8663 4.3423 4.3423 5.0165 5.0165 5.2737 5.2737 5.5392 5.5392 9.0372 9.0372 9.6079 9.6079 9.8284 9.8284 10.5297 10.5297 k = 0.2495-0.4329-0.8260 ( 4064 PWs) bands (ev): -35.5794 -35.5794 -16.5846 -16.5846 -15.1728 -15.1728 -15.1368 -15.1368 -5.2245 -5.2245 -5.1582 -5.1582 -4.8817 -4.8817 -4.7754 -4.7754 -2.9366 -2.9366 -2.9022 -2.9022 -2.8651 -2.8651 1.7372 1.7372 3.8061 3.8061 3.8982 3.8982 4.2903 4.2903 4.9967 4.9967 5.2277 5.2277 5.5232 5.5232 9.0206 9.0206 9.6143 9.6143 9.8444 9.8444 10.4885 10.4885 k = 0.2561-0.4443-0.8477 ( 4070 PWs) bands (ev): -35.5793 -35.5793 -16.5853 -16.5853 -15.1732 -15.1732 -15.1384 -15.1384 -5.2238 -5.2238 -5.1594 -5.1594 -4.8687 -4.8687 -4.7741 -4.7741 -2.9351 -2.9351 -2.9015 -2.9015 -2.8655 -2.8655 1.7560 1.7560 3.8072 3.8072 3.9309 3.9309 4.2425 4.2425 4.9768 4.9768 5.1861 5.1861 5.5074 5.5074 9.0014 9.0014 9.6220 9.6220 9.8558 9.8558 10.4480 10.4480 k = 0.2627-0.4557-0.8695 ( 4064 PWs) bands (ev): -35.5792 -35.5792 -16.5860 -16.5860 -15.1734 -15.1734 -15.1398 -15.1398 -5.2228 -5.2228 -5.1608 -5.1608 -4.8570 -4.8570 -4.7729 -4.7729 -2.9337 -2.9337 -2.9008 -2.9008 -2.8661 -2.8661 1.7735 1.7735 3.8080 3.8080 3.9600 3.9600 4.2033 4.2033 4.9552 4.9552 5.1505 5.1505 5.4915 5.4915 8.9795 8.9795 9.6311 9.6311 9.8614 9.8614 10.4115 10.4115 k = 0.2692-0.4671-0.8912 ( 4060 PWs) bands (ev): -35.5791 -35.5791 -16.5865 -16.5865 -15.1734 -15.1734 -15.1413 -15.1413 -5.2214 -5.2214 -5.1626 -5.1626 -4.8465 -4.8465 -4.7715 -4.7715 -2.9322 -2.9322 -2.9000 -2.9000 -2.8667 -2.8667 1.7898 1.7898 3.8086 3.8086 3.9767 3.9767 4.1815 4.1815 4.9301 4.9301 5.1231 5.1231 5.4754 5.4754 8.9552 8.9552 9.6414 9.6414 9.8603 9.8603 10.3815 10.3815 k = 0.2758-0.4784-0.9129 ( 4064 PWs) bands (ev): -35.5790 -35.5790 -16.5870 -16.5870 -15.1734 -15.1734 -15.1428 -15.1428 -5.2197 -5.2197 -5.1646 -5.1646 -4.8373 -4.8373 -4.7701 -4.7701 -2.9309 -2.9309 -2.8991 -2.8991 -2.8675 -2.8675 1.8047 1.8047 3.8088 3.8088 3.9718 3.9718 4.1865 4.1865 4.9005 4.9005 5.1048 5.1048 5.4590 5.4590 8.9289 8.9289 9.6518 9.6518 9.8529 9.8529 10.3594 10.3594 k = 0.2824-0.4898-0.9347 ( 4064 PWs) bands (ev): -35.5789 -35.5789 -16.5875 -16.5875 -15.1732 -15.1732 -15.1442 -15.1442 -5.2177 -5.2177 -5.1668 -5.1668 -4.8296 -4.8296 -4.7686 -4.7686 -2.9295 -2.9295 -2.8983 -2.8983 -2.8684 -2.8684 1.8184 1.8184 3.8088 3.8088 3.9480 3.9480 4.2154 4.2154 4.8669 4.8669 5.0953 5.0953 5.4423 5.4423 8.9012 8.9012 9.6596 9.6596 9.8419 9.8419 10.3456 10.3456 k = 0.2889-0.5012-0.9564 ( 4070 PWs) bands (ev): -35.5788 -35.5788 -16.5878 -16.5878 -15.1728 -15.1728 -15.1456 -15.1456 -5.2154 -5.2154 -5.1694 -5.1694 -4.8232 -4.8232 -4.7671 -4.7671 -2.9283 -2.9283 -2.8974 -2.8974 -2.8694 -2.8694 1.8307 1.8307 3.8084 3.8084 3.9158 3.9158 4.2576 4.2576 4.8307 4.8307 5.0930 5.0930 5.4253 5.4253 8.8729 8.8729 9.6596 9.6596 9.8335 9.8335 10.3392 10.3392 k = 0.2955-0.5126-0.9781 ( 4072 PWs) bands (ev): -35.5788 -35.5788 -16.5881 -16.5881 -15.1724 -15.1724 -15.1469 -15.1469 -5.2129 -5.2129 -5.1721 -5.1721 -4.8180 -4.8180 -4.7654 -4.7654 -2.9272 -2.9272 -2.8965 -2.8965 -2.8704 -2.8704 1.8414 1.8414 3.8077 3.8077 3.8822 3.8822 4.3062 4.3062 4.7935 4.7935 5.0965 5.0965 5.4081 5.4081 8.8447 8.8447 9.6456 9.6456 9.8353 9.8353 10.3385 10.3385 k = 0.3021-0.5240-0.9999 ( 4066 PWs) bands (ev): -35.5787 -35.5787 -16.5884 -16.5884 -15.1719 -15.1719 -15.1481 -15.1481 -5.2100 -5.2100 -5.1751 -5.1751 -4.8141 -4.8141 -4.7638 -4.7638 -2.9262 -2.9262 -2.8957 -2.8957 -2.8713 -2.8713 1.8504 1.8504 3.8066 3.8066 3.8505 3.8505 4.3574 4.3574 4.7568 4.7568 5.1042 5.1042 5.3907 5.3907 8.8175 8.8175 9.6163 9.6163 9.8503 9.8503 10.3415 10.3415 k = 0.3086-0.5354-1.0216 ( 4068 PWs) bands (ev): -35.5787 -35.5787 -16.5886 -16.5886 -15.1714 -15.1714 -15.1493 -15.1493 -5.2069 -5.2069 -5.1783 -5.1783 -4.8112 -4.8112 -4.7623 -4.7623 -2.9253 -2.9253 -2.8949 -2.8949 -2.8723 -2.8723 1.8576 1.8576 3.8045 3.8045 3.8232 3.8232 4.4090 4.4090 4.7217 4.7217 5.1151 5.1151 5.3734 5.3734 8.7919 8.7919 9.5758 9.5758 9.8758 9.8758 10.3462 10.3462 k = 0.3152-0.5468-1.0433 ( 4070 PWs) bands (ev): -35.5786 -35.5786 -16.5888 -16.5888 -15.1709 -15.1709 -15.1502 -15.1502 -5.2035 -5.2035 -5.1818 -5.1818 -4.8092 -4.8092 -4.7610 -4.7610 -2.9246 -2.9246 -2.8942 -2.8942 -2.8731 -2.8731 1.8627 1.8627 3.7948 3.7948 3.8080 3.8080 4.4586 4.4586 4.6902 4.6902 5.1281 5.1281 5.3564 5.3564 8.7687 8.7687 9.5286 9.5286 9.9085 9.9085 10.3509 10.3509 k = 0.3218-0.5582-1.0651 ( 4068 PWs) bands (ev): -35.5786 -35.5786 -16.5889 -16.5889 -15.1705 -15.1705 -15.1509 -15.1509 -5.2000 -5.2000 -5.1854 -5.1854 -4.8079 -4.8079 -4.7601 -4.7601 -2.9241 -2.9241 -2.8936 -2.8936 -2.8737 -2.8737 1.8655 1.8655 3.7781 3.7781 3.8049 3.8049 4.5022 4.5022 4.6657 4.6657 5.1422 5.1422 5.3402 5.3402 8.7482 8.7482 9.4780 9.4780 9.9459 9.9459 10.3542 10.3542 k = 0.3284-0.5696-1.0868 ( 4066 PWs) bands (ev): -35.5786 -35.5786 -16.5889 -16.5889 -15.1702 -15.1702 -15.1514 -15.1514 -5.1965 -5.1965 -5.1891 -5.1891 -4.8073 -4.8073 -4.7594 -4.7594 -2.9238 -2.9238 -2.8932 -2.8932 -2.8741 -2.8741 1.8660 1.8660 3.7658 3.7658 3.8031 3.8031 4.5308 4.5308 4.6571 4.6571 5.1563 5.1563 5.3255 5.3255 8.7307 8.7307 9.4261 9.4261 9.9864 9.9864 10.3552 10.3552 k = 0.3349-0.5810-1.1086 ( 4066 PWs) bands (ev): -35.5786 -35.5786 -16.5889 -16.5889 -15.1701 -15.1701 -15.1515 -15.1515 -5.1951 -5.1951 -5.1906 -5.1906 -4.8071 -4.8071 -4.7592 -4.7592 -2.9237 -2.9237 -2.8930 -2.8930 -2.8742 -2.8742 1.8640 1.8640 3.7592 3.7592 3.8014 3.8014 4.5346 4.5346 4.6739 4.6739 5.1689 5.1689 5.3132 5.3132 8.7164 8.7164 9.3745 9.3745 10.0289 10.0289 10.3534 10.3534 k = 0.3415-0.5924-1.1303 ( 4066 PWs) bands (ev): -35.5786 -35.5786 -16.5889 -16.5889 -15.1703 -15.1703 -15.1512 -15.1512 -5.1986 -5.1986 -5.1873 -5.1873 -4.8074 -4.8074 -4.7593 -4.7593 -2.9240 -2.9240 -2.8929 -2.8929 -2.8740 -2.8740 1.8594 1.8594 3.7586 3.7586 3.7996 3.7996 4.5215 4.5215 4.7080 4.7080 5.1781 5.1781 5.3049 5.3049 8.7049 8.7049 9.3245 9.3245 10.0719 10.0719 10.3489 10.3489 k = 0.6585-0.4586-1.0493 ( 4066 PWs) bands (ev): -35.5786 -35.5786 -16.5889 -16.5889 -15.1703 -15.1703 -15.1512 -15.1512 -5.1986 -5.1986 -5.1873 -5.1873 -4.8074 -4.8074 -4.7593 -4.7593 -2.9240 -2.9240 -2.8929 -2.8929 -2.8740 -2.8740 1.8594 1.8594 3.7586 3.7586 3.7996 3.7996 4.5215 4.5215 4.7080 4.7080 5.1781 5.1781 5.3049 5.3049 8.7049 8.7049 9.3245 9.3245 10.0719 10.0719 10.3489 10.3489 k = 0.6519-0.4339-1.0493 ( 4068 PWs) bands (ev): -35.5786 -35.5786 -16.5888 -16.5888 -15.1708 -15.1708 -15.1505 -15.1505 -5.2031 -5.2031 -5.1832 -5.1832 -4.8079 -4.8079 -4.7599 -4.7599 -2.9245 -2.9245 -2.8928 -2.8928 -2.8736 -2.8736 1.8523 1.8523 3.7639 3.7639 3.7977 3.7977 4.5033 4.5033 4.7477 4.7477 5.1822 5.1822 5.3020 5.3020 8.6959 8.6959 9.2773 9.2773 10.1140 10.1140 10.3428 10.3428 k = 0.6453-0.4092-1.0493 ( 4072 PWs) bands (ev): -35.5786 -35.5786 -16.5887 -16.5887 -15.1715 -15.1715 -15.1495 -15.1495 -5.2078 -5.2078 -5.1788 -5.1788 -4.8088 -4.8088 -4.7608 -4.7608 -2.9253 -2.9253 -2.8929 -2.8929 -2.8729 -2.8729 1.8427 1.8427 3.7744 3.7744 3.7962 3.7962 4.4853 4.4853 4.7876 4.7876 5.1804 5.1804 5.3050 5.3050 8.6885 8.6885 9.2344 9.2344 10.1522 10.1522 10.3369 10.3369 k = 0.6387-0.3845-1.0493 ( 4072 PWs) bands (ev): -35.5787 -35.5787 -16.5886 -16.5886 -15.1723 -15.1723 -15.1482 -15.1482 -5.2127 -5.2127 -5.1743 -5.1743 -4.8098 -4.8098 -4.7620 -4.7620 -2.9265 -2.9265 -2.8929 -2.8929 -2.8721 -2.8721 1.8309 1.8309 3.7851 3.7851 3.7997 3.7997 4.4694 4.4694 4.8256 4.8256 5.1739 5.1739 5.3124 5.3124 8.6815 8.6815 9.1972 9.1972 10.1815 10.1815 10.3347 10.3347 k = 0.6321-0.3598-1.0493 ( 4072 PWs) bands (ev): -35.5787 -35.5787 -16.5885 -16.5885 -15.1734 -15.1734 -15.1467 -15.1467 -5.2178 -5.2178 -5.1697 -5.1697 -4.8110 -4.8110 -4.7636 -4.7636 -2.9279 -2.9279 -2.8929 -2.8929 -2.8712 -2.8712 1.8171 1.8171 3.7854 3.7854 3.8181 3.8181 4.4566 4.4566 4.8612 4.8612 5.1647 5.1647 5.3219 5.3219 8.6737 8.6737 9.1666 9.1666 10.1957 10.1957 10.3404 10.3404 k = 0.6255-0.3352-1.0493 ( 4070 PWs) bands (ev): -35.5787 -35.5787 -16.5883 -16.5883 -15.1745 -15.1745 -15.1450 -15.1450 -5.2231 -5.2231 -5.1651 -5.1651 -4.8123 -4.8123 -4.7654 -4.7654 -2.9296 -2.9296 -2.8928 -2.8928 -2.8702 -2.8702 1.8016 1.8016 3.7819 3.7819 3.8442 3.8442 4.4472 4.4472 4.8937 4.8937 5.1543 5.1543 5.3318 5.3318 8.6637 8.6637 9.1435 9.1435 10.1925 10.1925 10.3543 10.3543 k = 0.6189-0.3105-1.0493 ( 4070 PWs) bands (ev): -35.5788 -35.5788 -16.5881 -16.5881 -15.1756 -15.1756 -15.1432 -15.1432 -5.2284 -5.2284 -5.1606 -5.1606 -4.8137 -4.8137 -4.7675 -4.7675 -2.9314 -2.9314 -2.8927 -2.8927 -2.8692 -2.8692 1.7846 1.7846 3.7772 3.7772 3.8746 3.8746 4.4417 4.4417 4.9233 4.9233 5.1440 5.1440 5.3408 5.3408 8.6507 8.6507 9.1275 9.1275 10.1764 10.1764 10.3715 10.3715 k = 0.6123-0.2858-1.0493 ( 4062 PWs) bands (ev): -35.5788 -35.5788 -16.5879 -16.5879 -15.1768 -15.1768 -15.1413 -15.1413 -5.2337 -5.2337 -5.1560 -5.1560 -4.8151 -4.8151 -4.7697 -4.7697 -2.9334 -2.9334 -2.8925 -2.8925 -2.8681 -2.8681 1.7666 1.7666 3.7716 3.7716 3.9082 3.9082 4.4402 4.4402 4.9498 4.9498 5.1344 5.1344 5.3480 5.3480 8.6344 8.6344 9.1172 9.1172 10.1538 10.1538 10.3881 10.3881 k = 0.6057-0.2611-1.0493 ( 4068 PWs) bands (ev): -35.5789 -35.5789 -16.5877 -16.5877 -15.1780 -15.1780 -15.1394 -15.1394 -5.2391 -5.2391 -5.1515 -5.1515 -4.8165 -4.8165 -4.7721 -4.7721 -2.9356 -2.9356 -2.8922 -2.8922 -2.8670 -2.8670 1.7479 1.7479 3.7651 3.7651 3.9442 3.9442 4.4427 4.4427 4.9733 4.9733 5.1263 5.1263 5.3529 5.3529 8.6153 8.6153 9.1101 9.1101 10.1303 10.1303 10.4044 10.4044 k = 0.5991-0.2364-1.0493 ( 4064 PWs) bands (ev): -35.5789 -35.5789 -16.5875 -16.5875 -15.1792 -15.1792 -15.1374 -15.1374 -5.2445 -5.2445 -5.1471 -5.1471 -4.8179 -4.8179 -4.7746 -4.7746 -2.9378 -2.9378 -2.8919 -2.8919 -2.8660 -2.8660 1.7287 1.7287 3.7580 3.7580 3.9816 3.9816 4.4492 4.4492 4.9939 4.9939 5.1200 5.1200 5.3552 5.3552 8.5943 8.5943 9.1030 9.1030 10.1106 10.1106 10.4216 10.4216 k = 0.5925-0.2117-1.0493 ( 4068 PWs) bands (ev): -35.5790 -35.5790 -16.5873 -16.5873 -15.1803 -15.1803 -15.1354 -15.1354 -5.2498 -5.2498 -5.1429 -5.1429 -4.8192 -4.8192 -4.7771 -4.7771 -2.9401 -2.9401 -2.8916 -2.8916 -2.8650 -2.8650 1.7094 1.7094 3.7504 3.7504 4.0195 4.0195 4.4597 4.4597 5.0115 5.0115 5.1161 5.1161 5.3548 5.3548 8.5724 8.5724 9.0922 9.0922 10.0989 10.0989 10.4411 10.4411 k = 0.5859-0.1871-1.0493 ( 4064 PWs) bands (ev): -35.5790 -35.5790 -16.5871 -16.5871 -15.1814 -15.1814 -15.1335 -15.1335 -5.2550 -5.2550 -5.1387 -5.1387 -4.8204 -4.8204 -4.7797 -4.7797 -2.9423 -2.9423 -2.8913 -2.8913 -2.8640 -2.8640 1.6903 1.6903 3.7423 3.7423 4.0570 4.0570 4.4739 4.4739 5.0257 5.0257 5.1151 5.1151 5.3518 5.3518 8.5506 8.5506 9.0751 9.0751 10.0982 10.0982 10.4632 10.4632 k = 0.5793-0.1624-1.0493 ( 4060 PWs) bands (ev): -35.5791 -35.5791 -16.5869 -16.5869 -15.1825 -15.1825 -15.1316 -15.1316 -5.2600 -5.2600 -5.1348 -5.1348 -4.8214 -4.8214 -4.7824 -4.7824 -2.9445 -2.9445 -2.8909 -2.8909 -2.8631 -2.8631 1.6716 1.6716 3.7340 3.7340 4.0933 4.0933 4.4917 4.4917 5.0363 5.0363 5.1175 5.1175 5.3464 5.3464 8.5295 8.5295 9.0499 9.0499 10.1101 10.1101 10.4879 10.4879 k = 0.5727-0.1377-1.0493 ( 4056 PWs) bands (ev): -35.5791 -35.5791 -16.5867 -16.5867 -15.1835 -15.1835 -15.1298 -15.1298 -5.2649 -5.2649 -5.1311 -5.1311 -4.8224 -4.8224 -4.7850 -4.7850 -2.9467 -2.9467 -2.8906 -2.8906 -2.8623 -2.8623 1.6537 1.6537 3.7256 3.7256 4.1276 4.1276 4.5128 4.5128 5.0429 5.0429 5.1232 5.1232 5.3394 5.3394 8.5098 8.5098 9.0165 9.0165 10.1347 10.1347 10.5149 10.5149 k = 0.5660-0.1130-1.0493 ( 4056 PWs) bands (ev): -35.5791 -35.5791 -16.5865 -16.5865 -15.1844 -15.1844 -15.1281 -15.1281 -5.2695 -5.2695 -5.1276 -5.1276 -4.8231 -4.8231 -4.7876 -4.7876 -2.9487 -2.9487 -2.8903 -2.8903 -2.8615 -2.8615 1.6366 1.6366 3.7173 3.7173 4.1592 4.1592 4.5371 4.5371 5.0460 5.0460 5.1308 5.1308 5.3318 5.3318 8.4917 8.4917 8.9760 8.9760 10.1710 10.1710 10.5433 10.5433 k = 0.5594-0.0883-1.0493 ( 4058 PWs) bands (ev): -35.5792 -35.5792 -16.5863 -16.5863 -15.1853 -15.1853 -15.1265 -15.1265 -5.2738 -5.2738 -5.1244 -5.1244 -4.8237 -4.8237 -4.7901 -4.7901 -2.9507 -2.9507 -2.8899 -2.8899 -2.8608 -2.8608 1.6207 1.6207 3.7093 3.7093 4.1878 4.1878 4.5641 4.5641 5.0461 5.0461 5.1383 5.1383 5.3251 5.3251 8.4754 8.4754 8.9303 8.9303 10.2168 10.2168 10.5725 10.5725 k = 0.5528-0.0637-1.0493 ( 4056 PWs) bands (ev): -35.5792 -35.5792 -16.5861 -16.5861 -15.1861 -15.1861 -15.1250 -15.1250 -5.2778 -5.2778 -5.1214 -5.1214 -4.8241 -4.8241 -4.7926 -4.7926 -2.9524 -2.9524 -2.8897 -2.8897 -2.8601 -2.8601 1.6060 1.6060 3.7017 3.7017 4.2129 4.2129 4.5938 4.5938 5.0438 5.0438 5.1432 5.1432 5.3215 5.3215 8.4612 8.4612 8.8817 8.8817 10.2698 10.2698 10.6012 10.6012 k = 0.5462-0.0390-1.0493 ( 4060 PWs) bands (ev): -35.5793 -35.5793 -16.5860 -16.5860 -15.1868 -15.1868 -15.1237 -15.1237 -5.2814 -5.2814 -5.1188 -5.1188 -4.8244 -4.8244 -4.7949 -4.7949 -2.9541 -2.9541 -2.8894 -2.8894 -2.8596 -2.8596 1.5927 1.5927 3.6947 3.6947 4.2344 4.2344 4.6256 4.6256 5.0388 5.0388 5.1434 5.1434 5.3226 5.3226 8.4489 8.4489 8.8326 8.8326 10.3277 10.3277 10.6287 10.6287 k = 0.5396-0.0143-1.0493 ( 4060 PWs) bands (ev): -35.5793 -35.5793 -16.5858 -16.5858 -15.1874 -15.1874 -15.1225 -15.1225 -5.2847 -5.2847 -5.1164 -5.1164 -4.8245 -4.8245 -4.7971 -4.7971 -2.9555 -2.9555 -2.8892 -2.8892 -2.8591 -2.8591 1.5810 1.5810 3.6884 3.6884 4.2525 4.2525 4.6594 4.6594 5.0306 5.0306 5.1388 5.1388 5.3289 5.3289 8.4386 8.4386 8.7851 8.7851 10.3885 10.3885 10.6538 10.6538 k = 0.5330 0.0104-1.0493 ( 4054 PWs) bands (ev): -35.5793 -35.5793 -16.5857 -16.5857 -15.1880 -15.1880 -15.1215 -15.1215 -5.2875 -5.2875 -5.1144 -5.1144 -4.8245 -4.8245 -4.7991 -4.7991 -2.9568 -2.9568 -2.8890 -2.8890 -2.8586 -2.8586 1.5709 1.5709 3.6829 3.6829 4.2672 4.2672 4.6946 4.6946 5.0182 5.0182 5.1312 5.1312 5.3390 5.3390 8.4301 8.4301 8.7413 8.7413 10.4499 10.4499 10.6759 10.6759 k = 0.5264 0.0351-1.0493 ( 4048 PWs) bands (ev): -35.5793 -35.5793 -16.5856 -16.5856 -15.1884 -15.1884 -15.1206 -15.1206 -5.2898 -5.2898 -5.1128 -5.1128 -4.8243 -4.8243 -4.8008 -4.8008 -2.9578 -2.9578 -2.8888 -2.8888 -2.8583 -2.8583 1.5625 1.5625 3.6783 3.6783 4.2788 4.2788 4.7308 4.7308 5.0008 5.0008 5.1229 5.1229 5.3508 5.3508 8.4234 8.4234 8.7029 8.7029 10.5103 10.5103 10.6942 10.6942 k = 0.5198 0.0598-1.0493 ( 4048 PWs) bands (ev): -35.5794 -35.5794 -16.5856 -16.5856 -15.1887 -15.1887 -15.1200 -15.1200 -5.2916 -5.2916 -5.1115 -5.1115 -4.8241 -4.8241 -4.8023 -4.8023 -2.9586 -2.9586 -2.8886 -2.8886 -2.8580 -2.8580 1.5559 1.5559 3.6747 3.6747 4.2874 4.2874 4.7674 4.7674 4.9783 4.9783 5.1159 5.1159 5.3622 5.3622 8.4183 8.4183 8.6713 8.6713 10.5678 10.5678 10.7081 10.7081 k = 0.5132 0.0844-1.0493 ( 4044 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1890 -15.1890 -15.1195 -15.1195 -5.2929 -5.2929 -5.1105 -5.1105 -4.8239 -4.8239 -4.8034 -4.8034 -2.9592 -2.9592 -2.8885 -2.8885 -2.8578 -2.8578 1.5512 1.5512 3.6720 3.6720 4.2935 4.2935 4.8036 4.8036 4.9515 4.9515 5.1110 5.1110 5.3716 5.3716 8.4148 8.4148 8.6478 8.6478 10.6205 10.6205 10.7167 10.7167 k = 0.5066 0.1091-1.0493 ( 4048 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1891 -15.1891 -15.1192 -15.1192 -5.2937 -5.2937 -5.1100 -5.1100 -4.8238 -4.8238 -4.8041 -4.8041 -2.9596 -2.9596 -2.8885 -2.8885 -2.8577 -2.8577 1.5483 1.5483 3.6704 3.6704 4.2970 4.2970 4.8374 4.8374 4.9232 4.9232 5.1081 5.1081 5.3776 5.3776 8.4127 8.4127 8.6334 8.6334 10.6663 10.6663 10.7169 10.7169 k = 0.5000 0.1338-1.0493 ( 4052 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1892 -15.1892 -15.1191 -15.1191 -5.2940 -5.2940 -5.1098 -5.1098 -4.8237 -4.8237 -4.8043 -4.8043 -2.9597 -2.9597 -2.8885 -2.8885 -2.8577 -2.8577 1.5474 1.5474 3.6699 3.6699 4.2982 4.2982 4.8568 4.8568 4.9055 4.9055 5.1072 5.1072 5.3797 5.3797 8.4121 8.4121 8.6285 8.6285 10.6992 10.6992 10.7024 10.7024 k = 0.5000 0.1338-1.0493 ( 4052 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1892 -15.1892 -15.1191 -15.1191 -5.2940 -5.2940 -5.1098 -5.1098 -4.8237 -4.8237 -4.8043 -4.8043 -2.9597 -2.9597 -2.8885 -2.8885 -2.8577 -2.8577 1.5474 1.5474 3.6699 3.6699 4.2982 4.2982 4.8568 4.8568 4.9055 4.9055 5.1072 5.1072 5.3797 5.3797 8.4121 8.4121 8.6285 8.6285 10.6992 10.6992 10.7024 10.7024 k = 0.5198 0.1391-1.0392 ( 4051 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1892 -15.1892 -15.1191 -15.1191 -5.2938 -5.2938 -5.1098 -5.1098 -4.8272 -4.8272 -4.8011 -4.8011 -2.9597 -2.9597 -2.8885 -2.8885 -2.8576 -2.8576 1.5480 1.5480 3.6671 3.6671 4.2959 4.2959 4.8569 4.8569 4.9096 4.9096 5.1068 5.1068 5.3813 5.3813 8.4135 8.4135 8.6291 8.6291 10.6809 10.6809 10.7180 10.7180 k = 0.5396 0.1444-1.0291 ( 4049 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1892 -15.1892 -15.1191 -15.1191 -5.2933 -5.2933 -5.1098 -5.1098 -4.8345 -4.8345 -4.7947 -4.7947 -2.9597 -2.9597 -2.8885 -2.8885 -2.8576 -2.8576 1.5499 1.5499 3.6587 3.6587 4.2896 4.2896 4.8562 4.8562 4.9218 4.9218 5.1062 5.1062 5.3861 5.3861 8.4176 8.4176 8.6311 8.6311 10.6586 10.6586 10.7324 10.7324 k = 0.5594 0.1497-1.0190 ( 4047 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1891 -15.1891 -15.1191 -15.1191 -5.2924 -5.2924 -5.1098 -5.1098 -4.8430 -4.8430 -4.7875 -4.7875 -2.9597 -2.9597 -2.8885 -2.8885 -2.8575 -2.8575 1.5530 1.5530 3.6449 3.6449 4.2806 4.2806 4.8536 4.8536 4.9402 4.9402 5.1070 5.1070 5.3939 5.3939 8.4243 8.4243 8.6344 8.6344 10.6338 10.6338 10.7435 10.7435 k = 0.5793 0.1550-1.0089 ( 4042 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1891 -15.1891 -15.1191 -15.1191 -5.2911 -5.2911 -5.1098 -5.1098 -4.8521 -4.8521 -4.7802 -4.7802 -2.9596 -2.9596 -2.8885 -2.8885 -2.8574 -2.8574 1.5574 1.5574 3.6260 3.6260 4.2705 4.2705 4.8487 4.8487 4.9597 4.9597 5.1127 5.1127 5.4050 5.4050 8.4336 8.4336 8.6390 8.6390 10.6067 10.6067 10.7505 10.7505 k = 0.5991 0.1603-0.9988 ( 4044 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1890 -15.1890 -15.1191 -15.1191 -5.2896 -5.2896 -5.1098 -5.1098 -4.8614 -4.8614 -4.7732 -4.7732 -2.9596 -2.9596 -2.8885 -2.8885 -2.8572 -2.8572 1.5629 1.5629 3.6024 3.6024 4.2607 4.2607 4.8417 4.8417 4.9736 4.9736 5.1279 5.1279 5.4193 5.4193 8.4453 8.4453 8.6449 8.6449 10.5774 10.5774 10.7532 10.7532 k = 0.6189 0.1656-0.9886 ( 4046 PWs) bands (ev): -35.5794 -35.5794 -16.5853 -16.5853 -15.1889 -15.1889 -15.1191 -15.1191 -5.2877 -5.2877 -5.1098 -5.1098 -4.8710 -4.8710 -4.7665 -4.7665 -2.9596 -2.9596 -2.8885 -2.8885 -2.8570 -2.8570 1.5695 1.5695 3.5747 3.5747 4.2524 4.2524 4.8327 4.8327 4.9777 4.9777 5.1548 5.1548 5.4373 5.4373 8.4590 8.4590 8.6521 8.6521 10.5462 10.5462 10.7531 10.7531 k = 0.6387 0.1709-0.9785 ( 4048 PWs) bands (ev): -35.5794 -35.5794 -16.5853 -16.5853 -15.1888 -15.1888 -15.1191 -15.1191 -5.2854 -5.2854 -5.1098 -5.1098 -4.8806 -4.8806 -4.7601 -4.7601 -2.9596 -2.9596 -2.8885 -2.8885 -2.8568 -2.8568 1.5771 1.5771 3.5437 3.5437 4.2462 4.2462 4.8215 4.8215 4.9730 4.9730 5.1903 5.1903 5.4595 5.4595 8.4746 8.4746 8.6608 8.6608 10.5135 10.5135 10.7513 10.7513 k = 0.6585 0.1762-0.9684 ( 4052 PWs) bands (ev): -35.5794 -35.5794 -16.5852 -16.5852 -15.1887 -15.1887 -15.1191 -15.1191 -5.2829 -5.2829 -5.1098 -5.1098 -4.8904 -4.8904 -4.7541 -4.7541 -2.9595 -2.9595 -2.8885 -2.8885 -2.8566 -2.8566 1.5857 1.5857 3.5100 3.5100 4.2426 4.2426 4.8082 4.8082 4.9626 4.9626 5.2295 5.2295 5.4868 5.4868 8.4917 8.4917 8.6709 8.6709 10.4797 10.4797 10.7485 10.7485 k = 0.6585 0.1762-0.9684 ( 4052 PWs) bands (ev): -35.5794 -35.5794 -16.5852 -16.5852 -15.1887 -15.1887 -15.1191 -15.1191 -5.2829 -5.2829 -5.1098 -5.1098 -4.8904 -4.8904 -4.7541 -4.7541 -2.9595 -2.9595 -2.8885 -2.8885 -2.8566 -2.8566 1.5857 1.5857 3.5100 3.5100 4.2426 4.2426 4.8082 4.8082 4.9626 4.9626 5.2295 5.2295 5.4868 5.4868 8.4917 8.4917 8.6709 8.6709 10.4797 10.4797 10.7485 10.7485 k = 0.6547 0.1752-0.9434 ( 4054 PWs) bands (ev): -35.5795 -35.5795 -16.5850 -16.5850 -15.1882 -15.1882 -15.1190 -15.1190 -5.2835 -5.2835 -5.1099 -5.1099 -4.8902 -4.8902 -4.7581 -4.7581 -2.9596 -2.9596 -2.8887 -2.8887 -2.8572 -2.8572 1.5781 1.5781 3.4927 3.4927 4.3134 4.3134 4.8197 4.8197 4.9734 4.9734 5.1917 5.1917 5.4649 5.4649 8.4921 8.4921 8.6819 8.6819 10.4825 10.4825 10.7438 10.7438 k = 0.6510 0.1742-0.9184 ( 4054 PWs) bands (ev): -35.5795 -35.5795 -16.5846 -16.5846 -15.1875 -15.1875 -15.1189 -15.1189 -5.2839 -5.2839 -5.1101 -5.1101 -4.8907 -4.8907 -4.7633 -4.7633 -2.9596 -2.9596 -2.8890 -2.8890 -2.8580 -2.8580 1.5693 1.5693 3.4794 3.4794 4.3838 4.3838 4.8308 4.8308 4.9852 4.9852 5.1525 5.1525 5.4489 5.4489 8.4955 8.4955 8.6952 8.6952 10.4838 10.4838 10.7296 10.7296 k = 0.6472 0.1732-0.8935 ( 4058 PWs) bands (ev): -35.5796 -35.5796 -16.5842 -16.5842 -15.1866 -15.1866 -15.1188 -15.1188 -5.2842 -5.2842 -5.1103 -5.1103 -4.8917 -4.8917 -4.7698 -4.7698 -2.9597 -2.9597 -2.8893 -2.8893 -2.8590 -2.8590 1.5595 1.5595 3.4709 3.4709 4.4526 4.4526 4.8403 4.8403 4.9970 4.9970 5.1151 5.1151 5.4383 5.4383 8.5023 8.5023 8.7110 8.7110 10.4827 10.4827 10.7124 10.7124 k = 0.6434 0.1722-0.8685 ( 4054 PWs) bands (ev): -35.5797 -35.5797 -16.5837 -16.5837 -15.1855 -15.1855 -15.1187 -15.1187 -5.2845 -5.2845 -5.1105 -5.1105 -4.8933 -4.8933 -4.7774 -4.7774 -2.9597 -2.9597 -2.8897 -2.8897 -2.8602 -2.8602 1.5485 1.5485 3.4675 3.4675 4.5178 4.5178 4.8467 4.8467 5.0054 5.0054 5.0858 5.0858 5.4324 5.4324 8.5128 8.5128 8.7294 8.7294 10.4783 10.4783 10.6945 10.6945 k = 0.6396 0.1712-0.8435 ( 4052 PWs) bands (ev): -35.5798 -35.5798 -16.5831 -16.5831 -15.1842 -15.1842 -15.1185 -15.1185 -5.2848 -5.2848 -5.1107 -5.1107 -4.8954 -4.8954 -4.7861 -4.7861 -2.9598 -2.9598 -2.8901 -2.8901 -2.8615 -2.8615 1.5362 1.5362 3.4696 3.4696 4.5769 4.5769 4.8487 4.8487 5.0019 5.0019 5.0770 5.0770 5.4311 5.4311 8.5273 8.5273 8.7509 8.7509 10.4700 10.4700 10.6763 10.6763 k = 0.6359 0.1702-0.8185 ( 4054 PWs) bands (ev): -35.5799 -35.5799 -16.5824 -16.5824 -15.1828 -15.1828 -15.1183 -15.1183 -5.2851 -5.2851 -5.1110 -5.1110 -4.8979 -4.8979 -4.7957 -4.7957 -2.9599 -2.9599 -2.8907 -2.8907 -2.8629 -2.8629 1.5227 1.5227 3.4776 3.4776 4.6252 4.6252 4.8462 4.8462 4.9884 4.9884 5.0909 5.0909 5.4343 5.4343 8.5456 8.5456 8.7759 8.7759 10.4574 10.4574 10.6573 10.6573 k = 0.6321 0.1691-0.7935 ( 4051 PWs) bands (ev): -35.5800 -35.5800 -16.5816 -16.5816 -15.1812 -15.1812 -15.1181 -15.1181 -5.2855 -5.2855 -5.1114 -5.1114 -4.9010 -4.9010 -4.8062 -4.8062 -2.9600 -2.9600 -2.8913 -2.8913 -2.8644 -2.8644 1.5080 1.5080 3.4916 3.4916 4.6556 4.6556 4.8431 4.8431 4.9773 4.9773 5.1177 5.1177 5.4421 5.4421 8.5675 8.5675 8.8050 8.8050 10.4408 10.4408 10.6366 10.6366 k = 0.6283 0.1681-0.7685 ( 4052 PWs) bands (ev): -35.5802 -35.5802 -16.5808 -16.5808 -15.1795 -15.1795 -15.1178 -15.1178 -5.2860 -5.2860 -5.1117 -5.1117 -4.9046 -4.9046 -4.8174 -4.8174 -2.9601 -2.9601 -2.8920 -2.8920 -2.8660 -2.8660 1.4921 1.4921 3.5115 3.5115 4.6612 4.6612 4.8464 4.8464 4.9723 4.9723 5.1530 5.1530 5.4549 5.4549 8.5924 8.5924 8.8390 8.8390 10.4210 10.4210 10.6134 10.6134 k = 0.6245 0.1671-0.7435 ( 4052 PWs) bands (ev): -35.5803 -35.5803 -16.5799 -16.5799 -15.1777 -15.1777 -15.1174 -15.1174 -5.2867 -5.2867 -5.1121 -5.1121 -4.9089 -4.9089 -4.8289 -4.8289 -2.9603 -2.9603 -2.8927 -2.8927 -2.8678 -2.8678 1.4751 1.4751 3.5372 3.5372 4.6439 4.6439 4.8564 4.8564 4.9718 4.9718 5.1953 5.1953 5.4735 5.4735 8.6196 8.6196 8.8787 8.8787 10.3990 10.3990 10.5873 10.5873 k = 0.6208 0.1661-0.7186 ( 4058 PWs) bands (ev): -35.5805 -35.5805 -16.5789 -16.5789 -15.1758 -15.1758 -15.1170 -15.1170 -5.2876 -5.2876 -5.1126 -5.1126 -4.9139 -4.9139 -4.8406 -4.8406 -2.9605 -2.9605 -2.8935 -2.8935 -2.8696 -2.8696 1.4572 1.4572 3.5684 3.5684 4.6130 4.6130 4.8669 4.8669 4.9740 4.9740 5.2425 5.2425 5.4989 5.4989 8.6482 8.6482 8.9247 8.9247 10.3758 10.3758 10.5585 10.5585 k = 0.6170 0.1651-0.6936 ( 4068 PWs) bands (ev): -35.5807 -35.5807 -16.5779 -16.5779 -15.1738 -15.1738 -15.1165 -15.1165 -5.2889 -5.2889 -5.1131 -5.1131 -4.9199 -4.9199 -4.8521 -4.8521 -2.9607 -2.9607 -2.8943 -2.8943 -2.8715 -2.8715 1.4386 1.4386 3.6045 3.6045 4.5758 4.5758 4.8739 4.8739 4.9773 4.9773 5.2918 5.2918 5.5323 5.5323 8.6774 8.6774 8.9778 8.9778 10.3522 10.3522 10.5276 10.5276 k = 0.6132 0.1641-0.6686 ( 4066 PWs) bands (ev): -35.5809 -35.5809 -16.5768 -16.5768 -15.1718 -15.1718 -15.1158 -15.1158 -5.2904 -5.2904 -5.1136 -5.1136 -4.9270 -4.9270 -4.8630 -4.8630 -2.9610 -2.9610 -2.8952 -2.8952 -2.8735 -2.8735 1.4193 1.4193 3.6448 3.6448 4.5368 4.5368 4.8767 4.8767 4.9803 4.9803 5.3402 5.3402 5.5749 5.5749 8.7067 8.7067 9.0378 9.0378 10.3289 10.3289 10.4952 10.4952 k = 0.6095 0.1631-0.6436 ( 4066 PWs) bands (ev): -35.5811 -35.5811 -16.5757 -16.5757 -15.1698 -15.1698 -15.1151 -15.1151 -5.2924 -5.2924 -5.1141 -5.1141 -4.9355 -4.9355 -4.8730 -4.8730 -2.9614 -2.9614 -2.8961 -2.8961 -2.8754 -2.8754 1.3997 1.3997 3.6883 3.6883 4.4987 4.4987 4.8758 4.8758 4.9822 4.9822 5.3858 5.3858 5.6270 5.6270 8.7355 8.7355 9.1046 9.1046 10.3066 10.3066 10.4621 10.4621 k = 0.6057 0.1621-0.6186 ( 4070 PWs) bands (ev): -35.5813 -35.5813 -16.5745 -16.5745 -15.1677 -15.1677 -15.1143 -15.1143 -5.2949 -5.2949 -5.1147 -5.1147 -4.9454 -4.9454 -4.8817 -4.8817 -2.9618 -2.9618 -2.8970 -2.8970 -2.8774 -2.8774 1.3799 1.3799 3.7332 3.7332 4.4638 4.4638 4.8721 4.8721 4.9826 4.9826 5.4279 5.4279 5.6880 5.6880 8.7638 8.7638 9.1773 9.1773 10.2858 10.2858 10.4289 10.4289 k = 0.6019 0.1611-0.5936 ( 4074 PWs) bands (ev): -35.5815 -35.5815 -16.5733 -16.5733 -15.1657 -15.1657 -15.1133 -15.1133 -5.2979 -5.2979 -5.1154 -5.1154 -4.9565 -4.9565 -4.8893 -4.8893 -2.9622 -2.9622 -2.8979 -2.8979 -2.8794 -2.8794 1.3600 1.3600 3.7775 3.7775 4.4348 4.4348 4.8661 4.8661 4.9812 4.9812 5.4675 5.4675 5.7558 5.7558 8.7914 8.7914 9.2548 9.2548 10.2665 10.2665 10.3967 10.3967 k = 0.5981 0.1601-0.5687 ( 4078 PWs) bands (ev): -35.5817 -35.5817 -16.5721 -16.5721 -15.1637 -15.1637 -15.1122 -15.1122 -5.3016 -5.3016 -5.1161 -5.1161 -4.9684 -4.9684 -4.8957 -4.8957 -2.9628 -2.9628 -2.8988 -2.8988 -2.8814 -2.8814 1.3404 1.3404 3.8180 3.8180 4.4149 4.4149 4.8585 4.8585 4.9783 4.9783 5.5054 5.5054 5.8287 5.8287 8.8184 8.8184 9.3356 9.3356 10.2484 10.2484 10.3668 10.3668 k = 0.5944 0.1590-0.5437 ( 4076 PWs) bands (ev): -35.5819 -35.5819 -16.5708 -16.5708 -15.1617 -15.1617 -15.1110 -15.1110 -5.3060 -5.3060 -5.1168 -5.1168 -4.9809 -4.9809 -4.9013 -4.9013 -2.9634 -2.9634 -2.8997 -2.8997 -2.8834 -2.8834 1.3211 1.3211 3.8506 3.8506 4.4079 4.4079 4.8496 4.8496 4.9739 4.9739 5.5428 5.5428 5.9050 5.9050 8.8447 8.8447 9.4177 9.4177 10.2301 10.2301 10.3420 10.3420 k = 0.5906 0.1580-0.5187 ( 4084 PWs) bands (ev): -35.5821 -35.5821 -16.5696 -16.5696 -15.1599 -15.1599 -15.1096 -15.1096 -5.3111 -5.3111 -5.1176 -5.1176 -4.9936 -4.9936 -4.9062 -4.9062 -2.9641 -2.9641 -2.9006 -2.9006 -2.8854 -2.8854 1.3023 1.3023 3.8715 3.8715 4.4178 4.4178 4.8399 4.8399 4.9683 4.9683 5.5800 5.5800 5.9834 5.9834 8.8704 8.8704 9.4986 9.4986 10.2085 10.2085 10.3260 10.3260 k = 0.5868 0.1570-0.4937 ( 4087 PWs) bands (ev): -35.5824 -35.5824 -16.5683 -16.5683 -15.1582 -15.1582 -15.1080 -15.1080 -5.3170 -5.3170 -5.1184 -5.1184 -5.0061 -5.0061 -4.9106 -4.9106 -2.9649 -2.9649 -2.9014 -2.9014 -2.8873 -2.8873 1.2841 1.2841 3.8784 3.8784 4.4463 4.4463 4.8295 4.8295 4.9617 4.9617 5.6176 5.6176 6.0631 6.0631 8.8955 8.8955 9.5755 9.5755 10.1814 10.1814 10.3221 10.3221 k = 0.5830 0.1560-0.4687 ( 4088 PWs) bands (ev): -35.5826 -35.5826 -16.5671 -16.5671 -15.1566 -15.1566 -15.1063 -15.1063 -5.3238 -5.3238 -5.1192 -5.1192 -5.0181 -5.0181 -4.9145 -4.9145 -2.9657 -2.9657 -2.9021 -2.9021 -2.8891 -2.8891 1.2666 1.2666 3.8719 3.8719 4.4925 4.4925 4.8190 4.8190 4.9544 4.9544 5.6558 5.6558 6.1432 6.1432 8.9199 8.9199 9.6455 9.6455 10.1486 10.1486 10.3298 10.3298 k = 0.5793 0.1550-0.4437 ( 4078 PWs) bands (ev): -35.5828 -35.5828 -16.5658 -16.5658 -15.1552 -15.1552 -15.1044 -15.1044 -5.3313 -5.3313 -5.1201 -5.1201 -5.0295 -5.0295 -4.9181 -4.9181 -2.9666 -2.9666 -2.9028 -2.9028 -2.8909 -2.8909 1.2499 1.2499 3.8549 3.8549 4.5528 4.5528 4.8089 4.8089 4.9468 4.9468 5.6946 5.6946 6.2234 6.2234 8.9437 8.9437 9.7063 9.7063 10.1116 10.1116 10.3456 10.3456 k = 0.5755 0.1540-0.4188 ( 4082 PWs) bands (ev): -35.5830 -35.5830 -16.5645 -16.5645 -15.1538 -15.1538 -15.1024 -15.1024 -5.3397 -5.3397 -5.1211 -5.1211 -5.0402 -5.0402 -4.9214 -4.9214 -2.9676 -2.9676 -2.9035 -2.9035 -2.8926 -2.8926 1.2342 1.2342 3.8306 3.8306 4.6220 4.6220 4.8006 4.8006 4.9394 4.9394 5.7339 5.7339 6.3031 6.3031 8.9669 8.9669 9.7565 9.7565 10.0715 10.0715 10.3623 10.3623 k = 0.5717 0.1530-0.3938 ( 4083 PWs) bands (ev): -35.5833 -35.5833 -16.5633 -16.5633 -15.1527 -15.1527 -15.1003 -15.1003 -5.3488 -5.3488 -5.1220 -5.1220 -5.0501 -5.0501 -4.9244 -4.9244 -2.9687 -2.9687 -2.9042 -2.9042 -2.8942 -2.8942 1.2194 1.2194 3.8017 3.8017 4.6911 4.6911 4.7993 4.7993 4.9335 4.9335 5.7739 5.7739 6.3818 6.3818 8.9894 8.9894 9.7964 9.7964 10.0294 10.0294 10.3707 10.3707 k = 0.5679 0.1520-0.3688 ( 4077 PWs) bands (ev): -35.5835 -35.5835 -16.5621 -16.5621 -15.1516 -15.1516 -15.0980 -15.0980 -5.3586 -5.3586 -5.1230 -5.1230 -5.0591 -5.0591 -4.9272 -4.9272 -2.9698 -2.9698 -2.9048 -2.9048 -2.8956 -2.8956 1.2055 1.2055 3.7702 3.7702 4.7335 4.7335 4.8252 4.8252 4.9335 4.9335 5.8143 5.8143 6.4593 6.4593 9.0114 9.0114 9.8269 9.8269 9.9863 9.9863 10.3624 10.3624 k = 0.5642 0.1510-0.3438 ( 4084 PWs) bands (ev): -35.5837 -35.5837 -16.5610 -16.5610 -15.1507 -15.1507 -15.0958 -15.0958 -5.3689 -5.3689 -5.1241 -5.1241 -5.0672 -5.0672 -4.9297 -4.9297 -2.9709 -2.9709 -2.9053 -2.9053 -2.8970 -2.8970 1.1926 1.1926 3.7373 3.7373 4.7382 4.7382 4.8670 4.8670 4.9602 4.9602 5.8551 5.8551 6.5352 6.5352 9.0328 9.0328 9.8477 9.8477 9.9446 9.9446 10.3344 10.3344 k = 0.5604 0.1500-0.3188 ( 4086 PWs) bands (ev): -35.5839 -35.5839 -16.5598 -16.5598 -15.1499 -15.1499 -15.0934 -15.0934 -5.3796 -5.3796 -5.1251 -5.1251 -5.0744 -5.0744 -4.9321 -4.9321 -2.9721 -2.9721 -2.9060 -2.9060 -2.8981 -2.8981 1.1808 1.1808 3.7042 3.7042 4.7315 4.7315 4.8776 4.8776 5.0334 5.0334 5.8961 5.8961 6.6092 6.6092 9.0537 9.0537 9.8510 9.8510 9.9142 9.9142 10.2888 10.2888 k = 0.5566 0.1489-0.2938 ( 4078 PWs) bands (ev): -35.5841 -35.5841 -16.5587 -16.5587 -15.1492 -15.1492 -15.0910 -15.0910 -5.3905 -5.3905 -5.1262 -5.1262 -5.0808 -5.0808 -4.9342 -4.9342 -2.9733 -2.9733 -2.9066 -2.9066 -2.8991 -2.8991 1.1699 1.1699 3.6713 3.6713 4.7222 4.7222 4.8741 4.8741 5.1262 5.1262 5.9373 5.9373 6.6809 6.6809 9.0741 9.0741 9.8224 9.8224 9.9107 9.9107 10.2297 10.2297 k = 0.5528 0.1479-0.2688 ( 4078 PWs) bands (ev): -35.5843 -35.5843 -16.5577 -16.5577 -15.1486 -15.1486 -15.0887 -15.0887 -5.4016 -5.4016 -5.1273 -5.1273 -5.0864 -5.0864 -4.9362 -4.9362 -2.9745 -2.9745 -2.9073 -2.9073 -2.8999 -2.8999 1.1600 1.1600 3.6393 3.6393 4.7123 4.7123 4.8674 4.8674 5.2251 5.2251 5.9784 5.9784 6.7500 6.7500 9.0940 9.0940 9.7787 9.7787 9.9179 9.9179 10.1614 10.1614 k = 0.5491 0.1469-0.2439 ( 4074 PWs) bands (ev): -35.5845 -35.5845 -16.5567 -16.5567 -15.1481 -15.1481 -15.0864 -15.0864 -5.4126 -5.4126 -5.1284 -5.1284 -5.0913 -5.0913 -4.9380 -4.9380 -2.9757 -2.9757 -2.9080 -2.9080 -2.9005 -2.9005 1.1511 1.1511 3.6084 3.6084 4.7023 4.7023 4.8597 4.8597 5.3261 5.3261 6.0194 6.0194 6.8162 6.8162 9.1134 9.1134 9.7314 9.7314 9.9217 9.9217 10.0901 10.0901 k = 0.5453 0.1459-0.2189 ( 4077 PWs) bands (ev): -35.5846 -35.5846 -16.5557 -16.5557 -15.1476 -15.1476 -15.0841 -15.0841 -5.4234 -5.4234 -5.1296 -5.1296 -5.0956 -5.0956 -4.9396 -4.9396 -2.9768 -2.9768 -2.9087 -2.9087 -2.9009 -2.9009 1.1431 1.1431 3.5790 3.5790 4.6926 4.6926 4.8520 4.8520 5.4275 5.4275 6.0602 6.0602 6.8793 6.8793 9.1321 9.1321 9.6835 9.6835 9.9083 9.9083 10.0299 10.0299 k = 0.5415 0.1449-0.1939 ( 4079 PWs) bands (ev): -35.5848 -35.5848 -16.5549 -16.5549 -15.1473 -15.1473 -15.0820 -15.0820 -5.4338 -5.4338 -5.1307 -5.1307 -5.0992 -5.0992 -4.9410 -4.9410 -2.9780 -2.9780 -2.9095 -2.9095 -2.9012 -2.9012 1.1359 1.1359 3.5513 3.5513 4.6834 4.6834 4.8443 4.8443 5.5277 5.5277 6.1006 6.1006 6.9389 6.9389 9.1500 9.1500 9.6359 9.6359 9.8568 9.8568 10.0034 10.0034 k = 0.5377 0.1439-0.1689 ( 4084 PWs) bands (ev): -35.5850 -35.5850 -16.5540 -16.5540 -15.1469 -15.1469 -15.0799 -15.0799 -5.4438 -5.4438 -5.1319 -5.1319 -5.1024 -5.1024 -4.9423 -4.9423 -2.9790 -2.9790 -2.9103 -2.9103 -2.9014 -2.9014 1.1296 1.1296 3.5255 3.5255 4.6747 4.6747 4.8371 4.8371 5.6252 5.6252 6.1408 6.1408 6.9947 6.9947 9.1666 9.1666 9.5895 9.5895 9.7791 9.7791 10.0010 10.0010 k = 0.5340 0.1429-0.1439 ( 4090 PWs) bands (ev): -35.5851 -35.5851 -16.5533 -16.5533 -15.1467 -15.1467 -15.0780 -15.0780 -5.4531 -5.4531 -5.1330 -5.1330 -5.1050 -5.1050 -4.9434 -4.9434 -2.9800 -2.9800 -2.9110 -2.9110 -2.9015 -2.9015 1.1240 1.1240 3.5018 3.5018 4.6667 4.6667 4.8303 4.8303 5.7186 5.7186 6.1807 6.1807 7.0465 7.0465 9.1812 9.1812 9.5444 9.5444 9.6949 9.6949 10.0054 10.0054 k = 0.5302 0.1419-0.1189 ( 4086 PWs) bands (ev): -35.5852 -35.5852 -16.5526 -16.5526 -15.1464 -15.1464 -15.0763 -15.0763 -5.4618 -5.4618 -5.1341 -5.1341 -5.1072 -5.1072 -4.9444 -4.9444 -2.9810 -2.9810 -2.9117 -2.9117 -2.9015 -2.9015 1.1192 1.1192 3.4802 3.4802 4.6594 4.6594 4.8241 4.8241 5.8061 5.8061 6.2205 6.2205 7.0940 7.0940 9.1927 9.1927 9.5009 9.5009 9.6128 9.6128 10.0113 10.0113 k = 0.5264 0.1409-0.0940 ( 4082 PWs) bands (ev): -35.5853 -35.5853 -16.5520 -16.5520 -15.1462 -15.1462 -15.0746 -15.0746 -5.4697 -5.4697 -5.1351 -5.1351 -5.1090 -5.1090 -4.9452 -4.9452 -2.9818 -2.9818 -2.9123 -2.9123 -2.9015 -2.9015 1.1151 1.1151 3.4610 3.4610 4.6528 4.6528 4.8185 4.8185 5.8858 5.8858 6.2603 6.2603 7.1369 7.1369 9.1989 9.1989 9.4588 9.4588 9.5390 9.5390 10.0171 10.0171 k = 0.5226 0.1399-0.0690 ( 4084 PWs) bands (ev): -35.5854 -35.5854 -16.5515 -16.5515 -15.1461 -15.1461 -15.0732 -15.0732 -5.4766 -5.4766 -5.1360 -5.1360 -5.1105 -5.1105 -4.9460 -4.9460 -2.9826 -2.9826 -2.9128 -2.9128 -2.9015 -2.9015 1.1117 1.1117 3.4441 3.4441 4.6471 4.6471 4.8135 4.8135 5.9560 5.9560 6.3000 6.3000 7.1751 7.1751 9.1964 9.1964 9.4186 9.4186 9.4792 9.4792 10.0222 10.0222 k = 0.5189 0.1388-0.0440 ( 4080 PWs) bands (ev): -35.5855 -35.5855 -16.5510 -16.5510 -15.1460 -15.1460 -15.0720 -15.0720 -5.4827 -5.4827 -5.1369 -5.1369 -5.1117 -5.1117 -4.9466 -4.9466 -2.9832 -2.9832 -2.9133 -2.9133 -2.9014 -2.9014 1.1088 1.1088 3.4297 3.4297 4.6422 4.6422 4.8092 4.8092 6.0151 6.0151 6.3389 6.3389 7.2081 7.2081 9.1811 9.1811 9.3852 9.3852 9.4352 9.4352 10.0265 10.0265 k = 0.5151 0.1378-0.0190 ( 4080 PWs) bands (ev): -35.5856 -35.5856 -16.5507 -16.5507 -15.1459 -15.1459 -15.0710 -15.0710 -5.4877 -5.4877 -5.1376 -5.1376 -5.1127 -5.1127 -4.9471 -4.9471 -2.9838 -2.9838 -2.9137 -2.9137 -2.9014 -2.9014 1.1066 1.1066 3.4178 3.4178 4.6381 4.6381 4.8057 4.8057 6.0626 6.0626 6.3758 6.3758 7.2357 7.2357 9.1531 9.1531 9.3646 9.3646 9.4034 9.4034 10.0299 10.0299 k = 0.5113 0.1368 0.0060 ( 4075 PWs) bands (ev): -35.5856 -35.5856 -16.5504 -16.5504 -15.1458 -15.1458 -15.0702 -15.0702 -5.4916 -5.4916 -5.1381 -5.1381 -5.1134 -5.1134 -4.9474 -4.9474 -2.9842 -2.9842 -2.9140 -2.9140 -2.9013 -2.9013 1.1048 1.1048 3.4085 3.4085 4.6349 4.6349 4.8030 4.8030 6.0984 6.0984 6.4084 6.4084 7.2577 7.2577 9.1199 9.1199 9.3553 9.3553 9.3802 9.3802 10.0324 10.0324 k = 0.5075 0.1358 0.0310 ( 4069 PWs) bands (ev): -35.5857 -35.5857 -16.5501 -16.5501 -15.1457 -15.1457 -15.0696 -15.0696 -5.4944 -5.4944 -5.1385 -5.1385 -5.1138 -5.1138 -4.9477 -4.9477 -2.9845 -2.9845 -2.9142 -2.9142 -2.9013 -2.9013 1.1036 1.1036 3.4018 3.4018 4.6326 4.6326 4.8010 4.8010 6.1232 6.1232 6.4341 6.4341 7.2737 7.2737 9.0904 9.0904 9.3522 9.3522 9.3641 9.3641 10.0342 10.0342 k = 0.5038 0.1348 0.0560 ( 4072 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0693 -15.0693 -5.4962 -5.4962 -5.1388 -5.1388 -5.1141 -5.1141 -4.9479 -4.9479 -2.9847 -2.9847 -2.9143 -2.9143 -2.9013 -2.9013 1.1029 1.1029 3.3978 3.3978 4.6312 4.6312 4.7998 4.7998 6.1377 6.1377 6.4507 6.4507 7.2834 7.2834 9.0705 9.0705 9.3515 9.3515 9.3546 9.3546 10.0352 10.0352 k = 0.5000 0.1338 0.0809 ( 4082 PWs) bands (ev): -35.5857 -35.5857 -16.5500 -16.5500 -15.1457 -15.1457 -15.0692 -15.0692 -5.4967 -5.4967 -5.1389 -5.1389 -5.1142 -5.1142 -4.9479 -4.9479 -2.9847 -2.9847 -2.9144 -2.9144 -2.9013 -2.9013 1.1026 1.1026 3.3965 3.3965 4.6308 4.6308 4.7994 4.7994 6.1424 6.1424 6.4563 6.4563 7.2867 7.2867 9.0636 9.0636 9.3512 9.3512 9.3516 9.3516 10.0355 10.0355 k = 0.5000-0.8673-0.5247 ( 4058 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1892 -15.1892 -15.1191 -15.1191 -5.2312 -5.2312 -5.1084 -5.1084 -5.0037 -5.0037 -4.6952 -4.6952 -2.9588 -2.9588 -2.8883 -2.8883 -2.8498 -2.8498 1.8059 1.8059 3.0277 3.0277 4.1863 4.1863 4.4946 4.4946 4.7917 4.7917 5.5273 5.5273 6.2755 6.2755 8.6513 8.6513 8.8298 8.8298 10.0554 10.0554 10.5559 10.5559 k = 0.5226-0.8578-0.5189 ( 4062 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1892 -15.1892 -15.1191 -15.1191 -5.2318 -5.2318 -5.1084 -5.1084 -5.0028 -5.0028 -4.6955 -4.6955 -2.9588 -2.9588 -2.8883 -2.8883 -2.8499 -2.8499 1.8036 1.8036 3.0321 3.0321 4.1843 4.1843 4.4982 4.4982 4.7926 4.7926 5.5260 5.5260 6.2693 6.2693 8.6507 8.6507 8.8283 8.8283 10.0583 10.0583 10.5579 10.5579 k = 0.5453-0.8482-0.5131 ( 4064 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1892 -15.1892 -15.1191 -15.1191 -5.2333 -5.2333 -5.1085 -5.1085 -5.0002 -5.0002 -4.6964 -4.6964 -2.9588 -2.9588 -2.8883 -2.8883 -2.8500 -2.8500 1.7969 1.7969 3.0452 3.0452 4.1789 4.1789 4.5086 4.5086 4.7953 4.7953 5.5222 5.5222 6.2506 6.2506 8.6489 8.6489 8.8235 8.8235 10.0670 10.0670 10.5637 10.5637 k = 0.5679-0.8387-0.5073 ( 4056 PWs) bands (ev): -35.5794 -35.5794 -16.5855 -16.5855 -15.1892 -15.1892 -15.1191 -15.1191 -5.2358 -5.2358 -5.1086 -5.1086 -4.9960 -4.9960 -4.6979 -4.6979 -2.9589 -2.9589 -2.8883 -2.8883 -2.8503 -2.8503 1.7862 1.7862 3.0663 3.0663 4.1709 4.1709 4.5247 4.5247 4.7999 4.7999 5.5158 5.5158 6.2199 6.2199 8.6458 8.6458 8.8158 8.8158 10.0814 10.0814 10.5733 10.5733 k = 0.5906-0.8291-0.5015 ( 4057 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1892 -15.1892 -15.1191 -15.1191 -5.2391 -5.2391 -5.1087 -5.1087 -4.9903 -4.9903 -4.7000 -4.7000 -2.9589 -2.9589 -2.8883 -2.8883 -2.8506 -2.8506 1.7720 1.7720 3.0947 3.0947 4.1617 4.1617 4.5454 4.5454 4.8064 4.8064 5.5070 5.5070 6.1782 6.1782 8.6413 8.6413 8.8053 8.8053 10.1011 10.1011 10.5861 10.5861 k = 0.6132-0.8195-0.4958 ( 4055 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1891 -15.1891 -15.1191 -15.1191 -5.2430 -5.2430 -5.1089 -5.1089 -4.9833 -4.9833 -4.7028 -4.7028 -2.9589 -2.9589 -2.8883 -2.8883 -2.8510 -2.8510 1.7551 1.7551 3.1294 3.1294 4.1526 4.1526 4.5695 4.5695 4.8147 4.8147 5.4957 5.4957 6.1262 6.1262 8.6353 8.6353 8.7924 8.7924 10.1260 10.1260 10.6018 10.6018 k = 0.6359-0.8100-0.4900 ( 4052 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1891 -15.1891 -15.1191 -15.1191 -5.2474 -5.2474 -5.1090 -5.1090 -4.9752 -4.9752 -4.7061 -4.7061 -2.9590 -2.9590 -2.8883 -2.8883 -2.8515 -2.8515 1.7362 1.7362 3.1692 3.1692 4.1449 4.1449 4.5958 4.5958 4.8248 4.8248 5.4820 5.4820 6.0653 6.0653 8.6274 8.6274 8.7775 8.7775 10.1556 10.1556 10.6197 10.6197 k = 0.6585-0.8004-0.4842 ( 4046 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1891 -15.1891 -15.1191 -15.1191 -5.2522 -5.2522 -5.1092 -5.1092 -4.9662 -4.9662 -4.7101 -4.7101 -2.9591 -2.9591 -2.8883 -2.8883 -2.8521 -2.8521 1.7160 1.7160 3.2128 3.2128 4.1395 4.1395 4.6236 4.6236 4.8368 4.8368 5.4659 5.4659 5.9968 5.9968 8.6176 8.6176 8.7615 8.7615 10.1892 10.1892 10.6390 10.6390 k = 0.6812-0.7909-0.4784 ( 4053 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1890 -15.1890 -15.1191 -15.1191 -5.2570 -5.2570 -5.1093 -5.1093 -4.9564 -4.9564 -4.7146 -4.7146 -2.9591 -2.9591 -2.8884 -2.8884 -2.8527 -2.8527 1.6952 1.6952 3.2589 3.2589 4.1376 4.1376 4.6520 4.6520 4.8506 4.8506 5.4472 5.4472 5.9222 5.9222 8.6054 8.6054 8.7451 8.7451 10.2264 10.2264 10.6589 10.6589 k = 0.7038-0.7813-0.4726 ( 4056 PWs) bands (ev): -35.5794 -35.5794 -16.5854 -16.5854 -15.1890 -15.1890 -15.1191 -15.1191 -5.2619 -5.2619 -5.1094 -5.1094 -4.9461 -4.9461 -4.7198 -4.7198 -2.9592 -2.9592 -2.8884 -2.8884 -2.8534 -2.8534 1.6744 1.6744 3.3060 3.3060 4.1401 4.1401 4.6805 4.6805 4.8662 4.8662 5.4257 5.4257 5.8432 5.8432 8.5907 8.5907 8.7291 8.7291 10.2663 10.2663 10.6786 10.6786 k = 0.7265-0.7718-0.4669 ( 4055 PWs) bands (ev): -35.5794 -35.5794 -16.5853 -16.5853 -15.1890 -15.1890 -15.1191 -15.1191 -5.2667 -5.2667 -5.1095 -5.1095 -4.9354 -4.9354 -4.7255 -4.7255 -2.9593 -2.9593 -2.8884 -2.8884 -2.8541 -2.8541 1.6542 1.6542 3.3527 3.3527 4.1480 4.1480 4.7085 4.7085 4.8835 4.8835 5.4006 5.4006 5.7621 5.7621 8.5737 8.5737 8.7142 8.7142 10.3083 10.3083 10.6973 10.6973 k = 0.7491-0.7622-0.4611 ( 4055 PWs) bands (ev): -35.5794 -35.5794 -16.5853 -16.5853 -15.1889 -15.1889 -15.1191 -15.1191 -5.2712 -5.2712 -5.1096 -5.1096 -4.9243 -4.9243 -4.7318 -4.7318 -2.9593 -2.9593 -2.8884 -2.8884 -2.8547 -2.8547 1.6348 1.6348 3.3975 3.3975 4.1619 4.1619 4.7355 4.7355 4.9023 4.9023 5.3707 5.3707 5.6818 5.6818 8.5545 8.5545 8.7009 8.7009 10.3515 10.3515 10.7142 10.7142 k = 0.7717-0.7526-0.4553 ( 4051 PWs) bands (ev): -35.5794 -35.5794 -16.5853 -16.5853 -15.1888 -15.1888 -15.1191 -15.1191 -5.2755 -5.2755 -5.1097 -5.1097 -4.9131 -4.9131 -4.7387 -4.7387 -2.9594 -2.9594 -2.8885 -2.8885 -2.8554 -2.8554 1.6168 1.6168 3.4392 3.4392 4.1825 4.1825 4.7612 4.7612 4.9223 4.9223 5.3338 5.3338 5.6060 5.6060 8.5339 8.5339 8.6893 8.6893 10.3950 10.3950 10.7289 10.7289 k = 0.7944-0.7431-0.4495 ( 4053 PWs) bands (ev): -35.5794 -35.5794 -16.5853 -16.5853 -15.1888 -15.1888 -15.1191 -15.1191 -5.2794 -5.2794 -5.1097 -5.1097 -4.9017 -4.9017 -4.7461 -4.7461 -2.9595 -2.9595 -2.8885 -2.8885 -2.8560 -2.8560 1.6003 1.6003 3.4769 3.4769 4.2096 4.2096 4.7855 4.7855 4.9428 4.9428 5.2871 5.2871 5.5398 5.5398 8.5127 8.5127 8.6793 8.6793 10.4381 10.4381 10.7407 10.7407 k = 0.8170-0.7335-0.4437 ( 4052 PWs) bands (ev): -35.5794 -35.5794 -16.5852 -16.5852 -15.1887 -15.1887 -15.1191 -15.1191 -5.2829 -5.2829 -5.1098 -5.1098 -4.8904 -4.8904 -4.7541 -4.7541 -2.9595 -2.9595 -2.8885 -2.8885 -2.8566 -2.8566 1.5857 1.5857 3.5100 3.5100 4.2426 4.2426 4.8082 4.8082 4.9626 4.9626 5.2295 5.2295 5.4868 5.4868 8.4917 8.4917 8.6709 8.6709 10.4797 10.4797 10.7485 10.7485 Writing output data file YTlSe2.save init_run : 0.46s CPU 1.01s WALL ( 1 calls) electrons : 175.80s CPU 178.94s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.15s WALL ( 1 calls) potinit : 0.04s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 175.78s CPU 178.93s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.05s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.05s WALL ( 290 calls) cegterg : 157.22s CPU 158.58s WALL ( 388 calls) Called by sum_band: Called by *egterg: h_psi : 128.52s CPU 130.13s WALL ( 6276 calls) s_psi : 3.44s CPU 3.35s WALL ( 6276 calls) g_psi : 0.16s CPU 0.16s WALL ( 5598 calls) cdiaghg : 32.24s CPU 32.15s WALL ( 5888 calls) cegterg:over : 3.55s CPU 3.54s WALL ( 5598 calls) cegterg:upda : 3.24s CPU 3.25s WALL ( 5598 calls) cegterg:last : 1.46s CPU 1.57s WALL ( 968 calls) cdiaghg:chol : 1.73s CPU 1.81s WALL ( 5888 calls) cdiaghg:inve : 0.97s CPU 1.02s WALL ( 5888 calls) cdiaghg:para : 1.84s CPU 1.85s WALL ( 11776 calls) Called by h_psi: h_psi:vloc : 122.85s CPU 124.47s WALL ( 6276 calls) h_psi:vnl : 5.56s CPU 5.51s WALL ( 6276 calls) add_vuspsi : 2.69s CPU 2.68s WALL ( 6276 calls) General routines calbec : 2.86s CPU 2.81s WALL ( 6276 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 112.91s CPU 114.66s WALL ( 559284 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.12s CPU 0.14s WALL ( 580 calls) Parallel routines fft_scatter : 26.72s CPU 27.25s WALL ( 559307 calls) PWSCF : 3m 9.52s CPU 3m33.03s WALL This run was terminated on: 21:22:55 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=