Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 4:33:11 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./BaMgxCO3x2.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P 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: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 43 26 7 1428 672 101 Max 44 27 8 1431 692 104 Sum 3115 1911 543 102941 49143 7371 bravais-lattice index = 14 lattice parameter (alat) = 11.7171 a.u. unit-cell volume = 803.6840 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 4 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 386.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.717149 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.673954 celldm(5)= 0.673954 celldm(6)= 0.673954 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.673954 0.738773 0.000000 ) a(3) = ( 0.673954 0.297439 0.676252 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.912261 -0.595358 ) b(2) = ( 0.000000 1.353595 -0.595358 ) b(3) = ( 0.000000 0.000000 1.478740 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 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 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Mg read from file: /users/gautes/Pseudo/Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 99618f2d1dea131ec68d28ce241ef835 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1129 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. # 4 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Ba 10.00 137.32700 Ba( 1.00) Mg 10.00 24.30500 Mg( 1.00) C 4.00 12.01070 C( 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= 267 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 2) = ( 0.0131579 -0.0120034 -0.0078337), wk = 0.0037453 k( 3) = ( 0.0263158 -0.0240069 -0.0156673), wk = 0.0037453 k( 4) = ( 0.0394737 -0.0360103 -0.0235010), wk = 0.0037453 k( 5) = ( 0.0526316 -0.0480137 -0.0313347), wk = 0.0037453 k( 6) = ( 0.0657895 -0.0600172 -0.0391683), wk = 0.0037453 k( 7) = ( 0.0789474 -0.0720206 -0.0470020), wk = 0.0037453 k( 8) = ( 0.0921053 -0.0840240 -0.0548356), wk = 0.0037453 k( 9) = ( 0.1052632 -0.0960275 -0.0626693), wk = 0.0037453 k( 10) = ( 0.1184210 -0.1080309 -0.0705030), wk = 0.0037453 k( 11) = ( 0.1315790 -0.1200343 -0.0783366), wk = 0.0037453 k( 12) = ( 0.1447368 -0.1320377 -0.0861703), wk = 0.0037453 k( 13) = ( 0.1578947 -0.1440412 -0.0940040), wk = 0.0037453 k( 14) = ( 0.1710526 -0.1560446 -0.1018376), wk = 0.0037453 k( 15) = ( 0.1842105 -0.1680480 -0.1096713), wk = 0.0037453 k( 16) = ( 0.1973684 -0.1800515 -0.1175049), wk = 0.0037453 k( 17) = ( 0.2105263 -0.1920549 -0.1253386), wk = 0.0037453 k( 18) = ( 0.2236842 -0.2040583 -0.1331723), wk = 0.0037453 k( 19) = ( 0.2368421 -0.2160618 -0.1410059), wk = 0.0037453 k( 20) = ( 0.2500000 -0.2280652 -0.1488396), wk = 0.0037453 k( 21) = ( 0.2631579 -0.2400686 -0.1566733), wk = 0.0037453 k( 22) = ( 0.2763158 -0.2520721 -0.1645069), wk = 0.0037453 k( 23) = ( 0.2894737 -0.2640755 -0.1723406), wk = 0.0037453 k( 24) = ( 0.3026316 -0.2760789 -0.1801742), wk = 0.0037453 k( 25) = ( 0.3157895 -0.2880823 -0.1880079), wk = 0.0037453 k( 26) = ( 0.3289474 -0.3000858 -0.1958416), wk = 0.0037453 k( 27) = ( 0.3421053 -0.3120892 -0.2036752), wk = 0.0037453 k( 28) = ( 0.3552632 -0.3240926 -0.2115089), wk = 0.0037453 k( 29) = ( 0.3684211 -0.3360961 -0.2193426), wk = 0.0037453 k( 30) = ( 0.3815789 -0.3480995 -0.2271762), wk = 0.0037453 k( 31) = ( 0.3947368 -0.3601029 -0.2350099), wk = 0.0037453 k( 32) = ( 0.4078947 -0.3721064 -0.2428436), wk = 0.0037453 k( 33) = ( 0.4210526 -0.3841098 -0.2506772), wk = 0.0037453 k( 34) = ( 0.4342105 -0.3961132 -0.2585109), wk = 0.0037453 k( 35) = ( 0.4473684 -0.4081167 -0.2663445), wk = 0.0037453 k( 36) = ( 0.4605263 -0.4201201 -0.2741782), wk = 0.0037453 k( 37) = ( 0.4736842 -0.4321235 -0.2820119), wk = 0.0037453 k( 38) = ( 0.4868421 -0.4441270 -0.2898455), wk = 0.0037453 k( 39) = ( 0.5000000 -0.4561304 -0.2976792), wk = 0.0037453 k( 40) = ( 0.5000000 -0.4561304 -0.2976792), wk = 0.0037453 k( 41) = ( 0.5000000 -0.4454543 -0.3140381), wk = 0.0037453 k( 42) = ( 0.5000000 -0.4347781 -0.3303970), wk = 0.0037453 k( 43) = ( 0.5000000 -0.4241020 -0.3467559), wk = 0.0037453 k( 44) = ( 0.5000000 -0.4134259 -0.3631149), wk = 0.0037453 k( 45) = ( 0.5000000 -0.4027497 -0.3794738), wk = 0.0037453 k( 46) = ( 0.5000000 -0.3920736 -0.3958327), wk = 0.0037453 k( 47) = ( 0.5000000 -0.3813975 -0.4121916), wk = 0.0037453 k( 48) = ( 0.5000000 -0.3707213 -0.4285505), wk = 0.0037453 k( 49) = ( 0.5000000 -0.3600452 -0.4449094), wk = 0.0037453 k( 50) = ( 0.5000000 -0.3493691 -0.4612683), wk = 0.0037453 k( 51) = ( 0.5000000 -0.3386929 -0.4776273), wk = 0.0037453 k( 52) = ( 0.5000000 -0.3280168 -0.4939862), wk = 0.0037453 k( 53) = ( 0.5000000 -0.3173407 -0.5103451), wk = 0.0037453 k( 54) = ( 0.5000000 -0.3066645 -0.5267040), wk = 0.0037453 k( 55) = ( 0.5000000 -0.2959884 -0.5430629), wk = 0.0037453 k( 56) = ( 0.5000000 -0.2853123 -0.5594218), wk = 0.0037453 k( 57) = ( 0.5000000 -0.2746361 -0.5757807), wk = 0.0037453 k( 58) = ( 0.5000000 -0.2639600 -0.5921397), wk = 0.0037453 k( 59) = ( 0.5000000 -0.2532839 -0.6084986), wk = 0.0037453 k( 60) = ( 0.5000000 -0.2426077 -0.6248575), wk = 0.0037453 k( 61) = ( 0.5000000 -0.2319316 -0.6412164), wk = 0.0037453 k( 62) = ( 0.5000000 -0.2212555 -0.6575753), wk = 0.0037453 k( 63) = ( 0.5000000 -0.2105793 -0.6739342), wk = 0.0037453 k( 64) = ( 0.5000000 -0.1999032 -0.6902932), wk = 0.0037453 k( 65) = ( 0.5000000 -0.1892271 -0.7066521), wk = 0.0037453 k( 66) = ( 0.5000000 -0.1785509 -0.7230110), wk = 0.0037453 k( 67) = ( 0.5000000 -0.1678748 -0.7393699), wk = 0.0037453 k( 68) = ( 0.7870445 -0.0411922 -0.4513469), wk = 0.0037453 k( 69) = ( 0.7792865 -0.0341149 -0.4352561), wk = 0.0037453 k( 70) = ( 0.7715285 -0.0270377 -0.4191653), wk = 0.0037453 k( 71) = ( 0.7637706 -0.0199604 -0.4030746), wk = 0.0037453 k( 72) = ( 0.7560126 -0.0128831 -0.3869838), wk = 0.0037453 k( 73) = ( 0.7482547 -0.0058058 -0.3708930), wk = 0.0037453 k( 74) = ( 0.7404967 0.0012715 -0.3548023), wk = 0.0037453 k( 75) = ( 0.7327387 0.0083487 -0.3387115), wk = 0.0037453 k( 76) = ( 0.7249808 0.0154260 -0.3226207), wk = 0.0037453 k( 77) = ( 0.7172228 0.0225033 -0.3065300), wk = 0.0037453 k( 78) = ( 0.7094649 0.0295806 -0.2904392), wk = 0.0037453 k( 79) = ( 0.7017069 0.0366579 -0.2743484), wk = 0.0037453 k( 80) = ( 0.6939490 0.0437351 -0.2582577), wk = 0.0037453 k( 81) = ( 0.6861910 0.0508124 -0.2421669), wk = 0.0037453 k( 82) = ( 0.6784330 0.0578897 -0.2260761), wk = 0.0037453 k( 83) = ( 0.6706751 0.0649670 -0.2099854), wk = 0.0037453 k( 84) = ( 0.6629171 0.0720443 -0.1938946), wk = 0.0037453 k( 85) = ( 0.6551592 0.0791215 -0.1778038), wk = 0.0037453 k( 86) = ( 0.6474012 0.0861988 -0.1617131), wk = 0.0037453 k( 87) = ( 0.6396432 0.0932761 -0.1456223), wk = 0.0037453 k( 88) = ( 0.6318853 0.1003534 -0.1295315), wk = 0.0037453 k( 89) = ( 0.6241273 0.1074307 -0.1134408), wk = 0.0037453 k( 90) = ( 0.6163694 0.1145080 -0.0973500), wk = 0.0037453 k( 91) = ( 0.6086114 0.1215852 -0.0812592), wk = 0.0037453 k( 92) = ( 0.6008535 0.1286625 -0.0651685), wk = 0.0037453 k( 93) = ( 0.5930955 0.1357398 -0.0490777), wk = 0.0037453 k( 94) = ( 0.5853375 0.1428171 -0.0329869), wk = 0.0037453 k( 95) = ( 0.5775796 0.1498944 -0.0168962), wk = 0.0037453 k( 96) = ( 0.5698216 0.1569716 -0.0008054), wk = 0.0037453 k( 97) = ( 0.5620637 0.1640489 0.0152854), wk = 0.0037453 k( 98) = ( 0.5543057 0.1711262 0.0313761), wk = 0.0037453 k( 99) = ( 0.5465477 0.1782035 0.0474669), wk = 0.0037453 k( 100) = ( 0.5387898 0.1852808 0.0635577), wk = 0.0037453 k( 101) = ( 0.5310318 0.1923580 0.0796484), wk = 0.0037453 k( 102) = ( 0.5232739 0.1994353 0.0957392), wk = 0.0037453 k( 103) = ( 0.5155159 0.2065126 0.1118300), wk = 0.0037453 k( 104) = ( 0.5077580 0.2135899 0.1279207), wk = 0.0037453 k( 105) = ( 0.5000000 0.2206672 0.1440115), wk = 0.0037453 k( 106) = ( 0.5000000 0.2206672 0.1440115), wk = 0.0037453 k( 107) = ( 0.4827586 0.2130580 0.1390456), wk = 0.0037453 k( 108) = ( 0.4655172 0.2054487 0.1340797), wk = 0.0037453 k( 109) = ( 0.4482759 0.1978395 0.1291138), wk = 0.0037453 k( 110) = ( 0.4310345 0.1902303 0.1241478), wk = 0.0037453 k( 111) = ( 0.4137931 0.1826211 0.1191819), wk = 0.0037453 k( 112) = ( 0.3965517 0.1750119 0.1142160), wk = 0.0037453 k( 113) = ( 0.3793103 0.1674027 0.1092501), wk = 0.0037453 k( 114) = ( 0.3620690 0.1597935 0.1042842), wk = 0.0037453 k( 115) = ( 0.3448276 0.1521843 0.0993183), wk = 0.0037453 k( 116) = ( 0.3275862 0.1445750 0.0943524), wk = 0.0037453 k( 117) = ( 0.3103448 0.1369658 0.0893865), wk = 0.0037453 k( 118) = ( 0.2931034 0.1293566 0.0844205), wk = 0.0037453 k( 119) = ( 0.2758621 0.1217474 0.0794546), wk = 0.0037453 k( 120) = ( 0.2586207 0.1141382 0.0744887), wk = 0.0037453 k( 121) = ( 0.2413793 0.1065290 0.0695228), wk = 0.0037453 k( 122) = ( 0.2241379 0.0989198 0.0645569), wk = 0.0037453 k( 123) = ( 0.2068966 0.0913106 0.0595910), wk = 0.0037453 k( 124) = ( 0.1896552 0.0837013 0.0546251), wk = 0.0037453 k( 125) = ( 0.1724138 0.0760921 0.0496591), wk = 0.0037453 k( 126) = ( 0.1551724 0.0684829 0.0446932), wk = 0.0037453 k( 127) = ( 0.1379310 0.0608737 0.0397273), wk = 0.0037453 k( 128) = ( 0.1206897 0.0532645 0.0347614), wk = 0.0037453 k( 129) = ( 0.1034483 0.0456553 0.0297955), wk = 0.0037453 k( 130) = ( 0.0862069 0.0380461 0.0248296), wk = 0.0037453 k( 131) = ( 0.0689655 0.0304369 0.0198637), wk = 0.0037453 k( 132) = ( 0.0517241 0.0228276 0.0148977), wk = 0.0037453 k( 133) = ( 0.0344828 0.0152184 0.0099318), wk = 0.0037453 k( 134) = ( 0.0172414 0.0076092 0.0049659), wk = 0.0037453 k( 135) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 136) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 137) = ( 0.0079217 -0.0072267 -0.0164304), wk = 0.0037453 k( 138) = ( 0.0158435 -0.0144534 -0.0328609), wk = 0.0037453 k( 139) = ( 0.0237652 -0.0216800 -0.0492913), wk = 0.0037453 k( 140) = ( 0.0316869 -0.0289067 -0.0657218), wk = 0.0037453 k( 141) = ( 0.0396086 -0.0361334 -0.0821522), wk = 0.0037453 k( 142) = ( 0.0475304 -0.0433601 -0.0985827), wk = 0.0037453 k( 143) = ( 0.0554521 -0.0505868 -0.1150131), wk = 0.0037453 k( 144) = ( 0.0633738 -0.0578135 -0.1314435), wk = 0.0037453 k( 145) = ( 0.0712955 -0.0650401 -0.1478740), wk = 0.0037453 k( 146) = ( 0.0792173 -0.0722668 -0.1643044), wk = 0.0037453 k( 147) = ( 0.0871390 -0.0794935 -0.1807349), wk = 0.0037453 k( 148) = ( 0.0950607 -0.0867202 -0.1971653), wk = 0.0037453 k( 149) = ( 0.1029825 -0.0939469 -0.2135958), wk = 0.0037453 k( 150) = ( 0.1109042 -0.1011736 -0.2300262), wk = 0.0037453 k( 151) = ( 0.1188259 -0.1084002 -0.2464566), wk = 0.0037453 k( 152) = ( 0.1267476 -0.1156269 -0.2628871), wk = 0.0037453 k( 153) = ( 0.1346694 -0.1228536 -0.2793175), wk = 0.0037453 k( 154) = ( 0.1425911 -0.1300803 -0.2957480), wk = 0.0037453 k( 155) = ( 0.1505128 -0.1373070 -0.3121784), wk = 0.0037453 k( 156) = ( 0.1584346 -0.1445336 -0.3286088), wk = 0.0037453 k( 157) = ( 0.1663563 -0.1517603 -0.3450393), wk = 0.0037453 k( 158) = ( 0.1742780 -0.1589870 -0.3614697), wk = 0.0037453 k( 159) = ( 0.1821997 -0.1662137 -0.3779002), wk = 0.0037453 k( 160) = ( 0.1901215 -0.1734404 -0.3943306), wk = 0.0037453 k( 161) = ( 0.1980432 -0.1806671 -0.4107611), wk = 0.0037453 k( 162) = ( 0.2059649 -0.1878937 -0.4271915), wk = 0.0037453 k( 163) = ( 0.2138867 -0.1951204 -0.4436219), wk = 0.0037453 k( 164) = ( 0.2218084 -0.2023471 -0.4600524), wk = 0.0037453 k( 165) = ( 0.2297301 -0.2095738 -0.4764828), wk = 0.0037453 k( 166) = ( 0.2376518 -0.2168005 -0.4929133), wk = 0.0037453 k( 167) = ( 0.2455736 -0.2240271 -0.5093437), wk = 0.0037453 k( 168) = ( 0.2534953 -0.2312538 -0.5257741), wk = 0.0037453 k( 169) = ( 0.2614170 -0.2384805 -0.5422046), wk = 0.0037453 k( 170) = ( 0.2693388 -0.2457072 -0.5586350), wk = 0.0037453 k( 171) = ( 0.2772605 -0.2529339 -0.5750655), wk = 0.0037453 k( 172) = ( 0.2851822 -0.2601606 -0.5914959), wk = 0.0037453 k( 173) = ( 0.2931040 -0.2673872 -0.6079264), wk = 0.0037453 k( 174) = ( 0.3010257 -0.2746139 -0.6243568), wk = 0.0037453 k( 175) = ( 0.3089474 -0.2818406 -0.6407872), wk = 0.0037453 k( 176) = ( 0.3168691 -0.2890673 -0.6572177), wk = 0.0037453 k( 177) = ( 0.3247909 -0.2962940 -0.6736481), wk = 0.0037453 k( 178) = ( 0.3327126 -0.3035206 -0.6900786), wk = 0.0037453 k( 179) = ( 0.3406343 -0.3107473 -0.7065090), wk = 0.0037453 k( 180) = ( 0.3485560 -0.3179740 -0.7229394), wk = 0.0037453 k( 181) = ( 0.3564778 -0.3252007 -0.7393699), wk = 0.0037453 k( 182) = ( 0.6435222 -0.1045335 -0.5953584), wk = 0.0037453 k( 183) = ( 0.6359684 -0.0874177 -0.5953584), wk = 0.0037453 k( 184) = ( 0.6284146 -0.0703019 -0.5953584), wk = 0.0037453 k( 185) = ( 0.6208608 -0.0531860 -0.5953584), wk = 0.0037453 k( 186) = ( 0.6133070 -0.0360702 -0.5953584), wk = 0.0037453 k( 187) = ( 0.6057532 -0.0189544 -0.5953584), wk = 0.0037453 k( 188) = ( 0.5981994 -0.0018386 -0.5953584), wk = 0.0037453 k( 189) = ( 0.5906456 0.0152773 -0.5953584), wk = 0.0037453 k( 190) = ( 0.5830918 0.0323931 -0.5953584), wk = 0.0037453 k( 191) = ( 0.5755380 0.0495089 -0.5953584), wk = 0.0037453 k( 192) = ( 0.5679842 0.0666247 -0.5953584), wk = 0.0037453 k( 193) = ( 0.5604304 0.0837406 -0.5953584), wk = 0.0037453 k( 194) = ( 0.5528766 0.1008564 -0.5953584), wk = 0.0037453 k( 195) = ( 0.5453228 0.1179722 -0.5953584), wk = 0.0037453 k( 196) = ( 0.5377690 0.1350880 -0.5953584), wk = 0.0037453 k( 197) = ( 0.5302152 0.1522039 -0.5953584), wk = 0.0037453 k( 198) = ( 0.5226614 0.1693197 -0.5953584), wk = 0.0037453 k( 199) = ( 0.5151076 0.1864355 -0.5953584), wk = 0.0037453 k( 200) = ( 0.5075538 0.2035513 -0.5953584), wk = 0.0037453 k( 201) = ( 0.5000000 0.2206672 -0.5953584), wk = 0.0037453 k( 202) = ( 0.5000000 0.2206672 -0.5953584), wk = 0.0037453 k( 203) = ( 0.5130475 0.2264255 -0.5822664), wk = 0.0037453 k( 204) = ( 0.5260949 0.2321838 -0.5691745), wk = 0.0037453 k( 205) = ( 0.5391424 0.2379421 -0.5560825), wk = 0.0037453 k( 206) = ( 0.5521899 0.2437004 -0.5429906), wk = 0.0037453 k( 207) = ( 0.5652374 0.2494587 -0.5298986), wk = 0.0037453 k( 208) = ( 0.5782848 0.2552170 -0.5168066), wk = 0.0037453 k( 209) = ( 0.5913323 0.2609753 -0.5037147), wk = 0.0037453 k( 210) = ( 0.6043798 0.2667336 -0.4906227), wk = 0.0037453 k( 211) = ( 0.6174273 0.2724919 -0.4775308), wk = 0.0037453 k( 212) = ( 0.6304747 0.2782502 -0.4644388), wk = 0.0037453 k( 213) = ( 0.6435222 0.2840085 -0.4513469), wk = 0.0037453 k( 214) = ( 0.6435222 0.2840085 -0.4513469), wk = 0.0037453 k( 215) = ( 0.6390372 0.2820290 -0.4327419), wk = 0.0037453 k( 216) = ( 0.6345521 0.2800496 -0.4141370), wk = 0.0037453 k( 217) = ( 0.6300670 0.2780702 -0.3955320), wk = 0.0037453 k( 218) = ( 0.6255820 0.2760908 -0.3769271), wk = 0.0037453 k( 219) = ( 0.6210969 0.2741114 -0.3583221), wk = 0.0037453 k( 220) = ( 0.6166118 0.2721320 -0.3397172), wk = 0.0037453 k( 221) = ( 0.6121267 0.2701525 -0.3211122), wk = 0.0037453 k( 222) = ( 0.6076417 0.2681731 -0.3025073), wk = 0.0037453 k( 223) = ( 0.6031566 0.2661937 -0.2839023), wk = 0.0037453 k( 224) = ( 0.5986715 0.2642143 -0.2652974), wk = 0.0037453 k( 225) = ( 0.5941865 0.2622349 -0.2466924), wk = 0.0037453 k( 226) = ( 0.5897014 0.2602555 -0.2280875), wk = 0.0037453 k( 227) = ( 0.5852163 0.2582761 -0.2094825), wk = 0.0037453 k( 228) = ( 0.5807313 0.2562966 -0.1908776), wk = 0.0037453 k( 229) = ( 0.5762462 0.2543172 -0.1722726), wk = 0.0037453 k( 230) = ( 0.5717611 0.2523378 -0.1536677), wk = 0.0037453 k( 231) = ( 0.5672760 0.2503584 -0.1350627), wk = 0.0037453 k( 232) = ( 0.5627910 0.2483790 -0.1164578), wk = 0.0037453 k( 233) = ( 0.5583059 0.2463996 -0.0978528), wk = 0.0037453 k( 234) = ( 0.5538208 0.2444202 -0.0792479), wk = 0.0037453 k( 235) = ( 0.5493358 0.2424407 -0.0606429), wk = 0.0037453 k( 236) = ( 0.5448507 0.2404613 -0.0420380), wk = 0.0037453 k( 237) = ( 0.5403656 0.2384819 -0.0234330), wk = 0.0037453 k( 238) = ( 0.5358806 0.2365025 -0.0048281), wk = 0.0037453 k( 239) = ( 0.5313955 0.2345231 0.0137769), wk = 0.0037453 k( 240) = ( 0.5269104 0.2325437 0.0323818), wk = 0.0037453 k( 241) = ( 0.5224254 0.2305642 0.0509868), wk = 0.0037453 k( 242) = ( 0.5179403 0.2285848 0.0695917), wk = 0.0037453 k( 243) = ( 0.5134552 0.2266054 0.0881967), wk = 0.0037453 k( 244) = ( 0.5089701 0.2246260 0.1068016), wk = 0.0037453 k( 245) = ( 0.5044851 0.2226466 0.1254066), wk = 0.0037453 k( 246) = ( 0.5000000 0.2206672 0.1440115), wk = 0.0037453 k( 247) = ( 0.5000000 -0.4561304 -0.2976792), wk = 0.0037453 k( 248) = ( 0.5143522 -0.4450970 -0.2904786), wk = 0.0037453 k( 249) = ( 0.5287044 -0.4340637 -0.2832780), wk = 0.0037453 k( 250) = ( 0.5430567 -0.4230303 -0.2760775), wk = 0.0037453 k( 251) = ( 0.5574089 -0.4119970 -0.2688769), wk = 0.0037453 k( 252) = ( 0.5717611 -0.4009636 -0.2616763), wk = 0.0037453 k( 253) = ( 0.5861133 -0.3899302 -0.2544757), wk = 0.0037453 k( 254) = ( 0.6004656 -0.3788969 -0.2472752), wk = 0.0037453 k( 255) = ( 0.6148178 -0.3678635 -0.2400746), wk = 0.0037453 k( 256) = ( 0.6291700 -0.3568302 -0.2328740), wk = 0.0037453 k( 257) = ( 0.6435222 -0.3457968 -0.2256734), wk = 0.0037453 k( 258) = ( 0.6578744 -0.3347634 -0.2184729), wk = 0.0037453 k( 259) = ( 0.6722267 -0.3237301 -0.2112723), wk = 0.0037453 k( 260) = ( 0.6865789 -0.3126967 -0.2040717), wk = 0.0037453 k( 261) = ( 0.7009311 -0.3016634 -0.1968711), wk = 0.0037453 k( 262) = ( 0.7152833 -0.2906300 -0.1896706), wk = 0.0037453 k( 263) = ( 0.7296356 -0.2795966 -0.1824700), wk = 0.0037453 k( 264) = ( 0.7439878 -0.2685633 -0.1752694), wk = 0.0037453 k( 265) = ( 0.7583400 -0.2575299 -0.1680688), wk = 0.0037453 k( 266) = ( 0.7726922 -0.2464966 -0.1608683), wk = 0.0037453 k( 267) = ( 0.7870445 -0.2354632 -0.1536677), wk = 0.0037453 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 2) = ( 0.0131579 0.0000000 0.0000000), wk = 0.0037453 k( 3) = ( 0.0263158 0.0000000 0.0000000), wk = 0.0037453 k( 4) = ( 0.0394737 0.0000000 0.0000000), wk = 0.0037453 k( 5) = ( 0.0526316 0.0000000 0.0000000), wk = 0.0037453 k( 6) = ( 0.0657895 0.0000000 0.0000000), wk = 0.0037453 k( 7) = ( 0.0789474 0.0000000 -0.0000000), wk = 0.0037453 k( 8) = ( 0.0921053 0.0000000 0.0000000), wk = 0.0037453 k( 9) = ( 0.1052632 0.0000000 0.0000000), wk = 0.0037453 k( 10) = ( 0.1184210 0.0000000 0.0000000), wk = 0.0037453 k( 11) = ( 0.1315790 0.0000000 -0.0000000), wk = 0.0037453 k( 12) = ( 0.1447368 0.0000000 -0.0000000), wk = 0.0037453 k( 13) = ( 0.1578947 0.0000000 -0.0000000), wk = 0.0037453 k( 14) = ( 0.1710526 0.0000000 0.0000000), wk = 0.0037453 k( 15) = ( 0.1842105 0.0000000 -0.0000000), wk = 0.0037453 k( 16) = ( 0.1973684 0.0000000 0.0000000), wk = 0.0037453 k( 17) = ( 0.2105263 0.0000000 0.0000000), wk = 0.0037453 k( 18) = ( 0.2236842 0.0000000 0.0000000), wk = 0.0037453 k( 19) = ( 0.2368421 0.0000000 0.0000000), wk = 0.0037453 k( 20) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0037453 k( 21) = ( 0.2631579 0.0000000 0.0000000), wk = 0.0037453 k( 22) = ( 0.2763158 0.0000000 0.0000000), wk = 0.0037453 k( 23) = ( 0.2894737 0.0000000 -0.0000000), wk = 0.0037453 k( 24) = ( 0.3026316 0.0000000 0.0000000), wk = 0.0037453 k( 25) = ( 0.3157895 0.0000000 0.0000000), wk = 0.0037453 k( 26) = ( 0.3289474 0.0000000 0.0000000), wk = 0.0037453 k( 27) = ( 0.3421053 0.0000000 0.0000000), wk = 0.0037453 k( 28) = ( 0.3552632 0.0000000 0.0000000), wk = 0.0037453 k( 29) = ( 0.3684211 0.0000000 0.0000000), wk = 0.0037453 k( 30) = ( 0.3815789 0.0000000 0.0000000), wk = 0.0037453 k( 31) = ( 0.3947368 0.0000000 0.0000000), wk = 0.0037453 k( 32) = ( 0.4078947 0.0000000 0.0000000), wk = 0.0037453 k( 33) = ( 0.4210526 0.0000000 0.0000000), wk = 0.0037453 k( 34) = ( 0.4342105 0.0000000 -0.0000000), wk = 0.0037453 k( 35) = ( 0.4473684 0.0000000 0.0000000), wk = 0.0037453 k( 36) = ( 0.4605263 0.0000000 0.0000000), wk = 0.0037453 k( 37) = ( 0.4736842 0.0000000 0.0000000), wk = 0.0037453 k( 38) = ( 0.4868421 0.0000000 -0.0000000), wk = 0.0037453 k( 39) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0037453 k( 40) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0037453 k( 41) = ( 0.5000000 0.0078872 -0.0078872), wk = 0.0037453 k( 42) = ( 0.5000000 0.0157745 -0.0157745), wk = 0.0037453 k( 43) = ( 0.5000000 0.0236617 -0.0236617), wk = 0.0037453 k( 44) = ( 0.5000000 0.0315490 -0.0315490), wk = 0.0037453 k( 45) = ( 0.5000000 0.0394362 -0.0394362), wk = 0.0037453 k( 46) = ( 0.5000000 0.0473235 -0.0473234), wk = 0.0037453 k( 47) = ( 0.5000000 0.0552107 -0.0552107), wk = 0.0037453 k( 48) = ( 0.5000000 0.0630979 -0.0630979), wk = 0.0037453 k( 49) = ( 0.5000000 0.0709852 -0.0709852), wk = 0.0037453 k( 50) = ( 0.5000000 0.0788724 -0.0788724), wk = 0.0037453 k( 51) = ( 0.5000000 0.0867597 -0.0867597), wk = 0.0037453 k( 52) = ( 0.5000000 0.0946469 -0.0946469), wk = 0.0037453 k( 53) = ( 0.5000000 0.1025342 -0.1025342), wk = 0.0037453 k( 54) = ( 0.5000000 0.1104214 -0.1104214), wk = 0.0037453 k( 55) = ( 0.5000000 0.1183086 -0.1183086), wk = 0.0037453 k( 56) = ( 0.5000000 0.1261959 -0.1261959), wk = 0.0037453 k( 57) = ( 0.5000000 0.1340831 -0.1340831), wk = 0.0037453 k( 58) = ( 0.5000000 0.1419704 -0.1419704), wk = 0.0037453 k( 59) = ( 0.5000000 0.1498576 -0.1498576), wk = 0.0037453 k( 60) = ( 0.5000000 0.1577449 -0.1577448), wk = 0.0037453 k( 61) = ( 0.5000000 0.1656321 -0.1656321), wk = 0.0037453 k( 62) = ( 0.5000000 0.1735193 -0.1735193), wk = 0.0037453 k( 63) = ( 0.5000000 0.1814066 -0.1814066), wk = 0.0037453 k( 64) = ( 0.5000000 0.1892938 -0.1892938), wk = 0.0037453 k( 65) = ( 0.5000000 0.1971811 -0.1971811), wk = 0.0037453 k( 66) = ( 0.5000000 0.2050683 -0.2050683), wk = 0.0037453 k( 67) = ( 0.5000000 0.2129555 -0.2129555), wk = 0.0037453 k( 68) = ( 0.7870445 0.5000000 0.2129555), wk = 0.0037453 k( 69) = ( 0.7792865 0.5000000 0.2207135), wk = 0.0037453 k( 70) = ( 0.7715285 0.5000000 0.2284715), wk = 0.0037453 k( 71) = ( 0.7637706 0.5000000 0.2362294), wk = 0.0037453 k( 72) = ( 0.7560126 0.5000000 0.2439874), wk = 0.0037453 k( 73) = ( 0.7482547 0.5000000 0.2517453), wk = 0.0037453 k( 74) = ( 0.7404967 0.5000000 0.2595033), wk = 0.0037453 k( 75) = ( 0.7327387 0.5000000 0.2672613), wk = 0.0037453 k( 76) = ( 0.7249808 0.5000000 0.2750192), wk = 0.0037453 k( 77) = ( 0.7172228 0.5000000 0.2827772), wk = 0.0037453 k( 78) = ( 0.7094649 0.5000000 0.2905351), wk = 0.0037453 k( 79) = ( 0.7017069 0.5000000 0.2982931), wk = 0.0037453 k( 80) = ( 0.6939490 0.5000000 0.3060510), wk = 0.0037453 k( 81) = ( 0.6861910 0.5000000 0.3138090), wk = 0.0037453 k( 82) = ( 0.6784330 0.5000000 0.3215670), wk = 0.0037453 k( 83) = ( 0.6706751 0.5000000 0.3293249), wk = 0.0037453 k( 84) = ( 0.6629171 0.5000000 0.3370829), wk = 0.0037453 k( 85) = ( 0.6551592 0.5000000 0.3448408), wk = 0.0037453 k( 86) = ( 0.6474012 0.5000000 0.3525988), wk = 0.0037453 k( 87) = ( 0.6396432 0.5000000 0.3603567), wk = 0.0037453 k( 88) = ( 0.6318853 0.5000000 0.3681147), wk = 0.0037453 k( 89) = ( 0.6241273 0.5000000 0.3758727), wk = 0.0037453 k( 90) = ( 0.6163694 0.5000000 0.3836306), wk = 0.0037453 k( 91) = ( 0.6086114 0.5000000 0.3913886), wk = 0.0037453 k( 92) = ( 0.6008535 0.5000000 0.3991465), wk = 0.0037453 k( 93) = ( 0.5930955 0.5000000 0.4069045), wk = 0.0037453 k( 94) = ( 0.5853375 0.5000000 0.4146625), wk = 0.0037453 k( 95) = ( 0.5775796 0.5000000 0.4224204), wk = 0.0037453 k( 96) = ( 0.5698216 0.5000000 0.4301784), wk = 0.0037453 k( 97) = ( 0.5620637 0.5000000 0.4379363), wk = 0.0037453 k( 98) = ( 0.5543057 0.5000000 0.4456943), wk = 0.0037453 k( 99) = ( 0.5465477 0.5000000 0.4534523), wk = 0.0037453 k( 100) = ( 0.5387898 0.5000000 0.4612102), wk = 0.0037453 k( 101) = ( 0.5310318 0.5000000 0.4689682), wk = 0.0037453 k( 102) = ( 0.5232739 0.5000000 0.4767261), wk = 0.0037453 k( 103) = ( 0.5155159 0.5000000 0.4844841), wk = 0.0037453 k( 104) = ( 0.5077580 0.5000000 0.4922420), wk = 0.0037453 k( 105) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037453 k( 106) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037453 k( 107) = ( 0.4827586 0.4827586 0.4827586), wk = 0.0037453 k( 108) = ( 0.4655172 0.4655172 0.4655172), wk = 0.0037453 k( 109) = ( 0.4482759 0.4482759 0.4482759), wk = 0.0037453 k( 110) = ( 0.4310345 0.4310345 0.4310345), wk = 0.0037453 k( 111) = ( 0.4137931 0.4137931 0.4137931), wk = 0.0037453 k( 112) = ( 0.3965517 0.3965517 0.3965517), wk = 0.0037453 k( 113) = ( 0.3793103 0.3793103 0.3793103), wk = 0.0037453 k( 114) = ( 0.3620690 0.3620690 0.3620690), wk = 0.0037453 k( 115) = ( 0.3448276 0.3448276 0.3448276), wk = 0.0037453 k( 116) = ( 0.3275862 0.3275862 0.3275862), wk = 0.0037453 k( 117) = ( 0.3103448 0.3103448 0.3103448), wk = 0.0037453 k( 118) = ( 0.2931034 0.2931035 0.2931034), wk = 0.0037453 k( 119) = ( 0.2758621 0.2758621 0.2758621), wk = 0.0037453 k( 120) = ( 0.2586207 0.2586207 0.2586207), wk = 0.0037453 k( 121) = ( 0.2413793 0.2413793 0.2413793), wk = 0.0037453 k( 122) = ( 0.2241379 0.2241379 0.2241379), wk = 0.0037453 k( 123) = ( 0.2068966 0.2068966 0.2068966), wk = 0.0037453 k( 124) = ( 0.1896552 0.1896552 0.1896552), wk = 0.0037453 k( 125) = ( 0.1724138 0.1724138 0.1724138), wk = 0.0037453 k( 126) = ( 0.1551724 0.1551724 0.1551724), wk = 0.0037453 k( 127) = ( 0.1379310 0.1379310 0.1379310), wk = 0.0037453 k( 128) = ( 0.1206897 0.1206897 0.1206897), wk = 0.0037453 k( 129) = ( 0.1034483 0.1034483 0.1034483), wk = 0.0037453 k( 130) = ( 0.0862069 0.0862069 0.0862069), wk = 0.0037453 k( 131) = ( 0.0689655 0.0689655 0.0689655), wk = 0.0037453 k( 132) = ( 0.0517241 0.0517241 0.0517241), wk = 0.0037453 k( 133) = ( 0.0344828 0.0344828 0.0344828), wk = 0.0037453 k( 134) = ( 0.0172414 0.0172414 0.0172414), wk = 0.0037453 k( 135) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 136) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 137) = ( 0.0079217 0.0000000 -0.0079217), wk = 0.0037453 k( 138) = ( 0.0158435 0.0000000 -0.0158435), wk = 0.0037453 k( 139) = ( 0.0237652 0.0000000 -0.0237652), wk = 0.0037453 k( 140) = ( 0.0316869 0.0000000 -0.0316869), wk = 0.0037453 k( 141) = ( 0.0396086 0.0000000 -0.0396086), wk = 0.0037453 k( 142) = ( 0.0475304 0.0000000 -0.0475304), wk = 0.0037453 k( 143) = ( 0.0554521 0.0000000 -0.0554521), wk = 0.0037453 k( 144) = ( 0.0633738 0.0000000 -0.0633738), wk = 0.0037453 k( 145) = ( 0.0712955 -0.0000000 -0.0712955), wk = 0.0037453 k( 146) = ( 0.0792173 0.0000000 -0.0792173), wk = 0.0037453 k( 147) = ( 0.0871390 0.0000000 -0.0871390), wk = 0.0037453 k( 148) = ( 0.0950607 0.0000000 -0.0950607), wk = 0.0037453 k( 149) = ( 0.1029825 0.0000000 -0.1029825), wk = 0.0037453 k( 150) = ( 0.1109042 0.0000000 -0.1109042), wk = 0.0037453 k( 151) = ( 0.1188259 0.0000000 -0.1188259), wk = 0.0037453 k( 152) = ( 0.1267476 0.0000000 -0.1267476), wk = 0.0037453 k( 153) = ( 0.1346694 0.0000000 -0.1346694), wk = 0.0037453 k( 154) = ( 0.1425911 0.0000000 -0.1425911), wk = 0.0037453 k( 155) = ( 0.1505128 0.0000000 -0.1505128), wk = 0.0037453 k( 156) = ( 0.1584346 0.0000000 -0.1584346), wk = 0.0037453 k( 157) = ( 0.1663563 -0.0000000 -0.1663563), wk = 0.0037453 k( 158) = ( 0.1742780 0.0000000 -0.1742780), wk = 0.0037453 k( 159) = ( 0.1821997 0.0000000 -0.1821997), wk = 0.0037453 k( 160) = ( 0.1901215 0.0000000 -0.1901215), wk = 0.0037453 k( 161) = ( 0.1980432 0.0000000 -0.1980432), wk = 0.0037453 k( 162) = ( 0.2059649 0.0000000 -0.2059649), wk = 0.0037453 k( 163) = ( 0.2138867 0.0000000 -0.2138867), wk = 0.0037453 k( 164) = ( 0.2218084 0.0000000 -0.2218084), wk = 0.0037453 k( 165) = ( 0.2297301 0.0000000 -0.2297301), wk = 0.0037453 k( 166) = ( 0.2376518 0.0000000 -0.2376518), wk = 0.0037453 k( 167) = ( 0.2455736 0.0000000 -0.2455736), wk = 0.0037453 k( 168) = ( 0.2534953 0.0000000 -0.2534953), wk = 0.0037453 k( 169) = ( 0.2614170 0.0000000 -0.2614170), wk = 0.0037453 k( 170) = ( 0.2693388 0.0000000 -0.2693388), wk = 0.0037453 k( 171) = ( 0.2772605 0.0000000 -0.2772605), wk = 0.0037453 k( 172) = ( 0.2851822 0.0000000 -0.2851822), wk = 0.0037453 k( 173) = ( 0.2931040 0.0000000 -0.2931039), wk = 0.0037453 k( 174) = ( 0.3010257 0.0000000 -0.3010257), wk = 0.0037453 k( 175) = ( 0.3089474 0.0000000 -0.3089474), wk = 0.0037453 k( 176) = ( 0.3168691 0.0000000 -0.3168691), wk = 0.0037453 k( 177) = ( 0.3247909 0.0000000 -0.3247909), wk = 0.0037453 k( 178) = ( 0.3327126 0.0000000 -0.3327126), wk = 0.0037453 k( 179) = ( 0.3406343 0.0000000 -0.3406343), wk = 0.0037453 k( 180) = ( 0.3485560 0.0000000 -0.3485560), wk = 0.0037453 k( 181) = ( 0.3564778 0.0000000 -0.3564778), wk = 0.0037453 k( 182) = ( 0.6435222 0.3564778 -0.0000000), wk = 0.0037453 k( 183) = ( 0.6359684 0.3640316 -0.0000000), wk = 0.0037453 k( 184) = ( 0.6284146 0.3715854 -0.0000000), wk = 0.0037453 k( 185) = ( 0.6208608 0.3791392 -0.0000000), wk = 0.0037453 k( 186) = ( 0.6133070 0.3866930 -0.0000000), wk = 0.0037453 k( 187) = ( 0.6057532 0.3942468 -0.0000000), wk = 0.0037453 k( 188) = ( 0.5981994 0.4018006 -0.0000000), wk = 0.0037453 k( 189) = ( 0.5906456 0.4093544 0.0000000), wk = 0.0037453 k( 190) = ( 0.5830918 0.4169082 -0.0000000), wk = 0.0037453 k( 191) = ( 0.5755380 0.4244620 -0.0000000), wk = 0.0037453 k( 192) = ( 0.5679842 0.4320158 -0.0000000), wk = 0.0037453 k( 193) = ( 0.5604304 0.4395696 -0.0000000), wk = 0.0037453 k( 194) = ( 0.5528766 0.4471234 0.0000000), wk = 0.0037453 k( 195) = ( 0.5453228 0.4546772 -0.0000000), wk = 0.0037453 k( 196) = ( 0.5377690 0.4622310 -0.0000000), wk = 0.0037453 k( 197) = ( 0.5302152 0.4697848 -0.0000000), wk = 0.0037453 k( 198) = ( 0.5226614 0.4773386 -0.0000000), wk = 0.0037453 k( 199) = ( 0.5151076 0.4848924 0.0000000), wk = 0.0037453 k( 200) = ( 0.5075538 0.4924462 -0.0000000), wk = 0.0037453 k( 201) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0037453 k( 202) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0037453 k( 203) = ( 0.5130475 0.5130475 0.0193596), wk = 0.0037453 k( 204) = ( 0.5260949 0.5260949 0.0387192), wk = 0.0037453 k( 205) = ( 0.5391424 0.5391424 0.0580788), wk = 0.0037453 k( 206) = ( 0.5521899 0.5521899 0.0774384), wk = 0.0037453 k( 207) = ( 0.5652374 0.5652374 0.0967980), wk = 0.0037453 k( 208) = ( 0.5782848 0.5782848 0.1161576), wk = 0.0037453 k( 209) = ( 0.5913323 0.5913323 0.1355172), wk = 0.0037453 k( 210) = ( 0.6043798 0.6043798 0.1548768), wk = 0.0037453 k( 211) = ( 0.6174273 0.6174273 0.1742364), wk = 0.0037453 k( 212) = ( 0.6304747 0.6304747 0.1935959), wk = 0.0037453 k( 213) = ( 0.6435222 0.6435222 0.2129555), wk = 0.0037453 k( 214) = ( 0.6435222 0.6435222 0.2129555), wk = 0.0037453 k( 215) = ( 0.6390372 0.6390372 0.2219257), wk = 0.0037453 k( 216) = ( 0.6345521 0.6345521 0.2308958), wk = 0.0037453 k( 217) = ( 0.6300670 0.6300670 0.2398660), wk = 0.0037453 k( 218) = ( 0.6255820 0.6255820 0.2488361), wk = 0.0037453 k( 219) = ( 0.6210969 0.6210969 0.2578062), wk = 0.0037453 k( 220) = ( 0.6166118 0.6166118 0.2667764), wk = 0.0037453 k( 221) = ( 0.6121267 0.6121267 0.2757465), wk = 0.0037453 k( 222) = ( 0.6076417 0.6076417 0.2847167), wk = 0.0037453 k( 223) = ( 0.6031566 0.6031566 0.2936868), wk = 0.0037453 k( 224) = ( 0.5986715 0.5986715 0.3026569), wk = 0.0037453 k( 225) = ( 0.5941865 0.5941865 0.3116271), wk = 0.0037453 k( 226) = ( 0.5897014 0.5897014 0.3205972), wk = 0.0037453 k( 227) = ( 0.5852163 0.5852163 0.3295673), wk = 0.0037453 k( 228) = ( 0.5807313 0.5807313 0.3385375), wk = 0.0037453 k( 229) = ( 0.5762462 0.5762462 0.3475076), wk = 0.0037453 k( 230) = ( 0.5717611 0.5717611 0.3564778), wk = 0.0037453 k( 231) = ( 0.5672760 0.5672760 0.3654479), wk = 0.0037453 k( 232) = ( 0.5627910 0.5627910 0.3744181), wk = 0.0037453 k( 233) = ( 0.5583059 0.5583059 0.3833882), wk = 0.0037453 k( 234) = ( 0.5538208 0.5538208 0.3923583), wk = 0.0037453 k( 235) = ( 0.5493358 0.5493358 0.4013285), wk = 0.0037453 k( 236) = ( 0.5448507 0.5448507 0.4102986), wk = 0.0037453 k( 237) = ( 0.5403656 0.5403656 0.4192687), wk = 0.0037453 k( 238) = ( 0.5358806 0.5358806 0.4282389), wk = 0.0037453 k( 239) = ( 0.5313955 0.5313955 0.4372090), wk = 0.0037453 k( 240) = ( 0.5269104 0.5269104 0.4461792), wk = 0.0037453 k( 241) = ( 0.5224254 0.5224254 0.4551493), wk = 0.0037453 k( 242) = ( 0.5179403 0.5179403 0.4641194), wk = 0.0037453 k( 243) = ( 0.5134552 0.5134552 0.4730896), wk = 0.0037453 k( 244) = ( 0.5089701 0.5089701 0.4820597), wk = 0.0037453 k( 245) = ( 0.5044851 0.5044851 0.4910299), wk = 0.0037453 k( 246) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037453 k( 247) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0037453 k( 248) = ( 0.5143522 0.0178239 0.0178239), wk = 0.0037453 k( 249) = ( 0.5287044 0.0356478 0.0356478), wk = 0.0037453 k( 250) = ( 0.5430567 0.0534717 0.0534717), wk = 0.0037453 k( 251) = ( 0.5574089 0.0712956 0.0712955), wk = 0.0037453 k( 252) = ( 0.5717611 0.0891194 0.0891194), wk = 0.0037453 k( 253) = ( 0.5861133 0.1069433 0.1069433), wk = 0.0037453 k( 254) = ( 0.6004656 0.1247672 0.1247672), wk = 0.0037453 k( 255) = ( 0.6148178 0.1425911 0.1425911), wk = 0.0037453 k( 256) = ( 0.6291700 0.1604150 0.1604150), wk = 0.0037453 k( 257) = ( 0.6435222 0.1782389 0.1782389), wk = 0.0037453 k( 258) = ( 0.6578744 0.1960628 0.1960628), wk = 0.0037453 k( 259) = ( 0.6722267 0.2138867 0.2138867), wk = 0.0037453 k( 260) = ( 0.6865789 0.2317106 0.2317106), wk = 0.0037453 k( 261) = ( 0.7009311 0.2495344 0.2495344), wk = 0.0037453 k( 262) = ( 0.7152833 0.2673583 0.2673583), wk = 0.0037453 k( 263) = ( 0.7296356 0.2851822 0.2851822), wk = 0.0037453 k( 264) = ( 0.7439878 0.3030061 0.3030061), wk = 0.0037453 k( 265) = ( 0.7583400 0.3208300 0.3208300), wk = 0.0037453 k( 266) = ( 0.7726922 0.3386539 0.3386539), wk = 0.0037453 k( 267) = ( 0.7870445 0.3564778 0.3564778), wk = 0.0037453 Dense grid: 102941 G-vectors FFT dimensions: ( 75, 75, 75) Smooth grid: 49143 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.20 Mb ( 172, 76) NL pseudopotentials 0.21 Mb ( 86, 161) Each V/rho on FFT grid 0.17 Mb ( 11250) Each G-vector array 0.01 Mb ( 1430) G-vector shells 0.01 Mb ( 1261) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.80 Mb ( 172, 304) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.37 Mb ( 161, 2, 76) Check: negative/imaginary core charge= -0.000008 0.000000 The potential is recalculated from file : ./BaMgxCO3x2.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.1 secs Computing kpt #: 2 total cpu time spent up to now is 5.5 secs Computing kpt #: 3 total cpu time spent up to now is 6.8 secs Computing kpt #: 4 total cpu time spent up to now is 8.1 secs Computing kpt #: 5 total cpu time spent up to now is 9.3 secs Computing kpt #: 6 total cpu time spent up to now is 10.7 secs Computing kpt #: 7 total cpu time spent up to now is 11.9 secs Computing kpt #: 8 total cpu time spent up to now is 13.2 secs Computing kpt #: 9 total cpu time spent up to now is 14.7 secs Computing kpt #: 10 total cpu time spent up to now is 16.0 secs Computing kpt #: 11 total cpu time spent up to now is 17.3 secs Computing kpt #: 12 total cpu time spent up to now is 19.0 secs Computing kpt #: 13 total cpu time spent up to now is 20.5 secs Computing kpt #: 14 total cpu time spent up to now is 22.2 secs Computing kpt #: 15 total cpu time spent up to now is 24.2 secs Computing kpt #: 16 total cpu time spent up to now is 26.2 secs Computing kpt #: 17 total cpu time spent up to now is 28.2 secs Computing kpt #: 18 total cpu time spent up to now is 30.1 secs Computing kpt #: 19 total cpu time spent up to now is 32.0 secs Computing kpt #: 20 total cpu time spent up to now is 33.9 secs Computing kpt #: 21 total cpu time spent up to now is 35.7 secs Computing kpt #: 22 total cpu time spent up to now is 37.6 secs Computing kpt #: 23 total cpu time spent up to now is 39.8 secs Computing kpt #: 24 total cpu time spent up to now is 42.0 secs Computing kpt #: 25 total cpu time spent up to now is 44.1 secs Computing kpt #: 26 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 48.2 secs Computing kpt #: 27 total cpu time spent up to now is 50.2 secs Computing kpt #: 28 total cpu time spent up to now is 52.6 secs Computing kpt #: 29 total cpu time spent up to now is 54.9 secs Computing kpt #: 30 total cpu time spent up to now is 57.3 secs Computing kpt #: 31 total cpu time spent up to now is 60.1 secs Computing kpt #: 32 total cpu time spent up to now is 62.3 secs Computing kpt #: 33 total cpu time spent up to now is 64.4 secs Computing kpt #: 34 total cpu time spent up to now is 66.5 secs Computing kpt #: 35 total cpu time spent up to now is 68.6 secs Computing kpt #: 36 total cpu time spent up to now is 70.9 secs Computing kpt #: 37 total cpu time spent up to now is 73.0 secs Computing kpt #: 38 total cpu time spent up to now is 75.2 secs Computing kpt #: 39 total cpu time spent up to now is 77.1 secs Computing kpt #: 40 total cpu time spent up to now is 79.1 secs Computing kpt #: 41 total cpu time spent up to now is 81.2 secs Computing kpt #: 42 total cpu time spent up to now is 83.4 secs Computing kpt #: 43 total cpu time spent up to now is 85.3 secs Computing kpt #: 44 total cpu time spent up to now is 87.2 secs Computing kpt #: 45 total cpu time spent up to now is 89.1 secs Computing kpt #: 46 total cpu time spent up to now is 91.0 secs Computing kpt #: 47 total cpu time spent up to now is 92.8 secs Computing kpt #: 48 total cpu time spent up to now is 94.7 secs Computing kpt #: 49 total cpu time spent up to now is 96.6 secs Computing kpt #: 50 total cpu time spent up to now is 98.5 secs Computing kpt #: 51 total cpu time spent up to now is 100.5 secs Computing kpt #: 52 total cpu time spent up to now is 102.5 secs Computing kpt #: 53 total cpu time spent up to now is 104.3 secs Computing kpt #: 54 total cpu time spent up to now is 106.3 secs Computing kpt #: 55 total cpu time spent up to now is 108.3 secs Computing kpt #: 56 total cpu time spent up to now is 110.2 secs Computing kpt #: 57 total cpu time spent up to now is 112.1 secs Computing kpt #: 58 total cpu time spent up to now is 114.2 secs Computing kpt #: 59 total cpu time spent up to now is 116.2 secs Computing kpt #: 60 total cpu time spent up to now is 118.4 secs Computing kpt #: 61 total cpu time spent up to now is 120.5 secs Computing kpt #: 62 total cpu time spent up to now is 122.6 secs Computing kpt #: 63 total cpu time spent up to now is 124.4 secs Computing kpt #: 64 total cpu time spent up to now is 126.4 secs Computing kpt #: 65 total cpu time spent up to now is 128.4 secs Computing kpt #: 66 total cpu time spent up to now is 130.7 secs Computing kpt #: 67 total cpu time spent up to now is 132.9 secs Computing kpt #: 68 total cpu time spent up to now is 135.4 secs Computing kpt #: 69 total cpu time spent up to now is 137.3 secs Computing kpt #: 70 total cpu time spent up to now is 139.3 secs Computing kpt #: 71 total cpu time spent up to now is 141.3 secs Computing kpt #: 72 total cpu time spent up to now is 142.9 secs Computing kpt #: 73 total cpu time spent up to now is 144.9 secs Computing kpt #: 74 total cpu time spent up to now is 146.9 secs Computing kpt #: 75 total cpu time spent up to now is 148.7 secs Computing kpt #: 76 total cpu time spent up to now is 150.6 secs Computing kpt #: 77 total cpu time spent up to now is 152.4 secs Computing kpt #: 78 total cpu time spent up to now is 154.5 secs Computing kpt #: 79 total cpu time spent up to now is 156.4 secs Computing kpt #: 80 total cpu time spent up to now is 158.3 secs Computing kpt #: 81 total cpu time spent up to now is 160.4 secs Computing kpt #: 82 total cpu time spent up to now is 162.3 secs Computing kpt #: 83 total cpu time spent up to now is 164.0 secs Computing kpt #: 84 total cpu time spent up to now is 166.0 secs Computing kpt #: 85 total cpu time spent up to now is 167.7 secs Computing kpt #: 86 total cpu time spent up to now is 170.2 secs Computing kpt #: 87 total cpu time spent up to now is 172.1 secs Computing kpt #: 88 total cpu time spent up to now is 174.1 secs Computing kpt #: 89 total cpu time spent up to now is 176.3 secs Computing kpt #: 90 total cpu time spent up to now is 178.3 secs Computing kpt #: 91 total cpu time spent up to now is 180.3 secs Computing kpt #: 92 total cpu time spent up to now is 182.2 secs Computing kpt #: 93 total cpu time spent up to now is 184.1 secs Computing kpt #: 94 total cpu time spent up to now is 185.9 secs Computing kpt #: 95 total cpu time spent up to now is 187.7 secs Computing kpt #: 96 total cpu time spent up to now is 189.5 secs Computing kpt #: 97 total cpu time spent up to now is 191.2 secs Computing kpt #: 98 total cpu time spent up to now is 192.7 secs Computing kpt #: 99 total cpu time spent up to now is 194.3 secs Computing kpt #: 100 total cpu time spent up to now is 195.8 secs Computing kpt #: 101 total cpu time spent up to now is 197.3 secs Computing kpt #: 102 total cpu time spent up to now is 198.8 secs Computing kpt #: 103 total cpu time spent up to now is 200.3 secs Computing kpt #: 104 total cpu time spent up to now is 201.8 secs Computing kpt #: 105 total cpu time spent up to now is 203.4 secs Computing kpt #: 106 total cpu time spent up to now is 205.7 secs Computing kpt #: 107 total cpu time spent up to now is 207.2 secs Computing kpt #: 108 total cpu time spent up to now is 208.7 secs Computing kpt #: 109 total cpu time spent up to now is 210.3 secs Computing kpt #: 110 total cpu time spent up to now is 211.9 secs Computing kpt #: 111 total cpu time spent up to now is 213.4 secs Computing kpt #: 112 total cpu time spent up to now is 214.9 secs Computing kpt #: 113 total cpu time spent up to now is 216.4 secs Computing kpt #: 114 total cpu time spent up to now is 218.0 secs Computing kpt #: 115 total cpu time spent up to now is 219.7 secs Computing kpt #: 116 total cpu time spent up to now is 221.0 secs Computing kpt #: 117 total cpu time spent up to now is 222.5 secs Computing kpt #: 118 total cpu time spent up to now is 224.1 secs Computing kpt #: 119 total cpu time spent up to now is 225.8 secs Computing kpt #: 120 total cpu time spent up to now is 227.2 secs Computing kpt #: 121 total cpu time spent up to now is 228.6 secs Computing kpt #: 122 total cpu time spent up to now is 229.9 secs Computing kpt #: 123 total cpu time spent up to now is 231.0 secs Computing kpt #: 124 total cpu time spent up to now is 232.5 secs Computing kpt #: 125 total cpu time spent up to now is 234.0 secs Computing kpt #: 126 total cpu time spent up to now is 235.3 secs Computing kpt #: 127 total cpu time spent up to now is 236.5 secs Computing kpt #: 128 total cpu time spent up to now is 237.8 secs Computing kpt #: 129 total cpu time spent up to now is 239.0 secs Computing kpt #: 130 total cpu time spent up to now is 240.2 secs Computing kpt #: 131 total cpu time spent up to now is 241.5 secs Computing kpt #: 132 total cpu time spent up to now is 242.7 secs Computing kpt #: 133 total cpu time spent up to now is 243.9 secs Computing kpt #: 134 total cpu time spent up to now is 245.2 secs Computing kpt #: 135 total cpu time spent up to now is 246.5 secs Computing kpt #: 136 total cpu time spent up to now is 247.8 secs Computing kpt #: 137 total cpu time spent up to now is 249.0 secs Computing kpt #: 138 total cpu time spent up to now is 250.2 secs Computing kpt #: 139 total cpu time spent up to now is 251.5 secs Computing kpt #: 140 total cpu time spent up to now is 252.8 secs Computing kpt #: 141 total cpu time spent up to now is 254.0 secs Computing kpt #: 142 total cpu time spent up to now is 255.3 secs Computing kpt #: 143 total cpu time spent up to now is 256.5 secs Computing kpt #: 144 total cpu time spent up to now is 257.7 secs Computing kpt #: 145 total cpu time spent up to now is 258.9 secs Computing kpt #: 146 total cpu time spent up to now is 260.1 secs Computing kpt #: 147 total cpu time spent up to now is 261.6 secs Computing kpt #: 148 total cpu time spent up to now is 263.3 secs Computing kpt #: 149 total cpu time spent up to now is 264.9 secs Computing kpt #: 150 total cpu time spent up to now is 266.9 secs Computing kpt #: 151 total cpu time spent up to now is 268.8 secs Computing kpt #: 152 total cpu time spent up to now is 270.7 secs Computing kpt #: 153 total cpu time spent up to now is 272.8 secs Computing kpt #: 154 total cpu time spent up to now is 274.8 secs Computing kpt #: 155 total cpu time spent up to now is 277.1 secs Computing kpt #: 156 total cpu time spent up to now is 279.1 secs Computing kpt #: 157 total cpu time spent up to now is 281.1 secs Computing kpt #: 158 total cpu time spent up to now is 282.8 secs Computing kpt #: 159 total cpu time spent up to now is 284.6 secs Computing kpt #: 160 total cpu time spent up to now is 286.5 secs Computing kpt #: 161 total cpu time spent up to now is 288.3 secs Computing kpt #: 162 total cpu time spent up to now is 290.0 secs Computing kpt #: 163 total cpu time spent up to now is 291.9 secs Computing kpt #: 164 total cpu time spent up to now is 293.7 secs Computing kpt #: 165 total cpu time spent up to now is 295.7 secs Computing kpt #: 166 total cpu time spent up to now is 297.8 secs Computing kpt #: 167 total cpu time spent up to now is 300.0 secs Computing kpt #: 168 total cpu time spent up to now is 302.0 secs Computing kpt #: 169 total cpu time spent up to now is 304.0 secs Computing kpt #: 170 total cpu time spent up to now is 305.9 secs Computing kpt #: 171 total cpu time spent up to now is 308.0 secs Computing kpt #: 172 total cpu time spent up to now is 310.4 secs Computing kpt #: 173 total cpu time spent up to now is 312.4 secs Computing kpt #: 174 total cpu time spent up to now is 314.5 secs Computing kpt #: 175 total cpu time spent up to now is 316.6 secs Computing kpt #: 176 total cpu time spent up to now is 318.7 secs Computing kpt #: 177 total cpu time spent up to now is 320.5 secs Computing kpt #: 178 total cpu time spent up to now is 322.3 secs Computing kpt #: 179 total cpu time spent up to now is 324.4 secs Computing kpt #: 180 total cpu time spent up to now is 326.4 secs Computing kpt #: 181 total cpu time spent up to now is 328.4 secs Computing kpt #: 182 total cpu time spent up to now is 330.4 secs Computing kpt #: 183 total cpu time spent up to now is 332.4 secs Computing kpt #: 184 total cpu time spent up to now is 334.5 secs Computing kpt #: 185 total cpu time spent up to now is 336.3 secs Computing kpt #: 186 total cpu time spent up to now is 337.9 secs Computing kpt #: 187 total cpu time spent up to now is 339.5 secs Computing kpt #: 188 total cpu time spent up to now is 341.1 secs Computing kpt #: 189 total cpu time spent up to now is 342.7 secs Computing kpt #: 190 total cpu time spent up to now is 344.3 secs Computing kpt #: 191 total cpu time spent up to now is 346.0 secs Computing kpt #: 192 total cpu time spent up to now is 347.8 secs Computing kpt #: 193 total cpu time spent up to now is 349.6 secs Computing kpt #: 194 total cpu time spent up to now is 351.6 secs Computing kpt #: 195 total cpu time spent up to now is 353.4 secs Computing kpt #: 196 total cpu time spent up to now is 355.2 secs Computing kpt #: 197 total cpu time spent up to now is 357.1 secs Computing kpt #: 198 total cpu time spent up to now is 359.0 secs Computing kpt #: 199 total cpu time spent up to now is 361.1 secs Computing kpt #: 200 total cpu time spent up to now is 362.4 secs Computing kpt #: 201 total cpu time spent up to now is 363.5 secs Computing kpt #: 202 total cpu time spent up to now is 364.6 secs Computing kpt #: 203 total cpu time spent up to now is 366.5 secs Computing kpt #: 204 total cpu time spent up to now is 367.8 secs Computing kpt #: 205 total cpu time spent up to now is 370.1 secs Computing kpt #: 206 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 373.8 secs Computing kpt #: 207 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 377.4 secs Computing kpt #: 208 total cpu time spent up to now is 380.2 secs Computing kpt #: 209 total cpu time spent up to now is 382.4 secs Computing kpt #: 210 total cpu time spent up to now is 384.5 secs Computing kpt #: 211 total cpu time spent up to now is 386.5 secs Computing kpt #: 212 total cpu time spent up to now is 388.5 secs Computing kpt #: 213 total cpu time spent up to now is 390.6 secs Computing kpt #: 214 total cpu time spent up to now is 392.8 secs Computing kpt #: 215 total cpu time spent up to now is 394.8 secs Computing kpt #: 216 total cpu time spent up to now is 396.7 secs Computing kpt #: 217 total cpu time spent up to now is 399.5 secs Computing kpt #: 218 total cpu time spent up to now is 401.4 secs Computing kpt #: 219 total cpu time spent up to now is 403.3 secs Computing kpt #: 220 total cpu time spent up to now is 405.4 secs Computing kpt #: 221 total cpu time spent up to now is 407.5 secs Computing kpt #: 222 total cpu time spent up to now is 409.2 secs Computing kpt #: 223 total cpu time spent up to now is 411.0 secs Computing kpt #: 224 total cpu time spent up to now is 412.7 secs Computing kpt #: 225 total cpu time spent up to now is 414.6 secs Computing kpt #: 226 total cpu time spent up to now is 416.6 secs Computing kpt #: 227 total cpu time spent up to now is 418.4 secs Computing kpt #: 228 total cpu time spent up to now is 420.3 secs Computing kpt #: 229 total cpu time spent up to now is 422.2 secs Computing kpt #: 230 total cpu time spent up to now is 424.0 secs Computing kpt #: 231 total cpu time spent up to now is 425.9 secs Computing kpt #: 232 total cpu time spent up to now is 427.7 secs Computing kpt #: 233 total cpu time spent up to now is 429.5 secs Computing kpt #: 234 total cpu time spent up to now is 431.4 secs Computing kpt #: 235 total cpu time spent up to now is 433.1 secs Computing kpt #: 236 total cpu time spent up to now is 434.9 secs Computing kpt #: 237 total cpu time spent up to now is 436.6 secs Computing kpt #: 238 total cpu time spent up to now is 438.3 secs Computing kpt #: 239 total cpu time spent up to now is 439.9 secs Computing kpt #: 240 total cpu time spent up to now is 441.7 secs Computing kpt #: 241 total cpu time spent up to now is 443.4 secs Computing kpt #: 242 total cpu time spent up to now is 444.9 secs Computing kpt #: 243 total cpu time spent up to now is 446.5 secs Computing kpt #: 244 total cpu time spent up to now is 448.1 secs Computing kpt #: 245 total cpu time spent up to now is 449.5 secs Computing kpt #: 246 total cpu time spent up to now is 450.9 secs Computing kpt #: 247 total cpu time spent up to now is 453.0 secs Computing kpt #: 248 total cpu time spent up to now is 455.1 secs Computing kpt #: 249 total cpu time spent up to now is 457.1 secs Computing kpt #: 250 total cpu time spent up to now is 459.1 secs Computing kpt #: 251 total cpu time spent up to now is 461.2 secs Computing kpt #: 252 total cpu time spent up to now is 463.2 secs Computing kpt #: 253 total cpu time spent up to now is 465.2 secs Computing kpt #: 254 total cpu time spent up to now is 467.3 secs Computing kpt #: 255 total cpu time spent up to now is 469.4 secs Computing kpt #: 256 total cpu time spent up to now is 471.1 secs Computing kpt #: 257 total cpu time spent up to now is 473.0 secs Computing kpt #: 258 total cpu time spent up to now is 475.1 secs Computing kpt #: 259 total cpu time spent up to now is 477.6 secs Computing kpt #: 260 total cpu time spent up to now is 479.6 secs Computing kpt #: 261 total cpu time spent up to now is 481.7 secs Computing kpt #: 262 total cpu time spent up to now is 483.8 secs Computing kpt #: 263 total cpu time spent up to now is 485.9 secs Computing kpt #: 264 total cpu time spent up to now is 487.9 secs Computing kpt #: 265 total cpu time spent up to now is 489.6 secs Computing kpt #: 266 total cpu time spent up to now is 491.7 secs Computing kpt #: 267 total cpu time spent up to now is 493.7 secs ethr = 1.56E-08, avg # of iterations = 38.8 total cpu time spent up to now is 493.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6169 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3556 -19.3556 -16.2716 -16.2716 -16.1377 -16.1377 -12.8966 -12.8966 -12.8962 -12.8962 -12.8474 -12.8474 -12.8462 -12.8462 -5.9967 -5.9967 -4.1093 -4.1093 -4.0856 -4.0856 -2.9747 -2.9747 -2.2634 -2.2634 -0.8288 -0.8288 -0.2420 -0.2420 -0.2313 -0.2313 -0.2199 -0.2199 -0.1548 -0.1548 0.6795 0.6795 3.5505 3.5505 3.5627 3.5627 4.0551 4.0551 4.0619 4.0619 4.3521 4.3521 4.3619 4.3619 4.5558 4.5558 4.6354 4.6354 5.9559 5.9559 6.2694 6.2694 11.0256 11.0256 11.4606 11.4606 11.4636 11.4636 12.5214 12.5214 13.5610 13.5610 13.6892 13.6892 k = 0.0132-0.0120-0.0078 ( 6172 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3555 -19.3555 -16.2715 -16.2715 -16.1377 -16.1377 -12.8968 -12.8968 -12.8963 -12.8963 -12.8476 -12.8476 -12.8464 -12.8464 -5.9966 -5.9966 -4.1091 -4.1091 -4.0856 -4.0856 -2.9732 -2.9732 -2.2630 -2.2630 -0.8276 -0.8276 -0.2421 -0.2421 -0.2319 -0.2319 -0.2193 -0.2193 -0.1551 -0.1551 0.6788 0.6788 3.5504 3.5504 3.5626 3.5626 4.0549 4.0549 4.0617 4.0617 4.3518 4.3518 4.3617 4.3617 4.5547 4.5547 4.6343 4.6343 5.9547 5.9547 6.2683 6.2683 11.0268 11.0268 11.4590 11.4590 11.4681 11.4681 12.5223 12.5223 13.5610 13.5610 13.6893 13.6893 k = 0.0263-0.0240-0.0157 ( 6176 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3552 -19.3552 -16.2715 -16.2715 -16.1376 -16.1376 -12.8976 -12.8976 -12.8964 -12.8964 -12.8481 -12.8481 -12.8467 -12.8467 -5.9964 -5.9964 -4.1087 -4.1087 -4.0854 -4.0854 -2.9687 -2.9687 -2.2618 -2.2618 -0.8241 -0.8241 -0.2426 -0.2426 -0.2328 -0.2328 -0.2177 -0.2177 -0.1561 -0.1561 0.6764 0.6764 3.5501 3.5501 3.5623 3.5623 4.0545 4.0545 4.0612 4.0612 4.3510 4.3510 4.3611 4.3611 4.5515 4.5515 4.6310 4.6310 5.9513 5.9513 6.2652 6.2652 11.0303 11.0303 11.4585 11.4585 11.4771 11.4771 12.5248 12.5248 13.5610 13.5610 13.6894 13.6894 k = 0.0395-0.0360-0.0235 ( 6179 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3548 -19.3548 -16.2713 -16.2713 -16.1375 -16.1375 -12.8991 -12.8991 -12.8966 -12.8966 -12.8491 -12.8491 -12.8471 -12.8471 -5.9960 -5.9960 -4.1080 -4.1080 -4.0851 -4.0851 -2.9613 -2.9613 -2.2597 -2.2597 -0.8183 -0.8183 -0.2450 -0.2450 -0.2324 -0.2324 -0.2159 -0.2159 -0.1575 -0.1575 0.6726 0.6726 3.5496 3.5496 3.5619 3.5619 4.0537 4.0537 4.0605 4.0605 4.3494 4.3494 4.3604 4.3604 4.5457 4.5457 4.6259 4.6259 5.9456 5.9456 6.2600 6.2600 11.0362 11.0362 11.4599 11.4599 11.4898 11.4898 12.5291 12.5291 13.5608 13.5608 13.6898 13.6898 k = 0.0526-0.0480-0.0313 ( 6177 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3542 -19.3542 -16.2711 -16.2711 -16.1374 -16.1374 -12.9011 -12.9011 -12.8968 -12.8968 -12.8506 -12.8506 -12.8476 -12.8476 -5.9954 -5.9954 -4.1071 -4.1071 -4.0846 -4.0846 -2.9509 -2.9509 -2.2567 -2.2567 -0.8102 -0.8102 -0.2494 -0.2494 -0.2305 -0.2305 -0.2140 -0.2140 -0.1592 -0.1592 0.6672 0.6672 3.5487 3.5487 3.5615 3.5615 4.0524 4.0524 4.0596 4.0596 4.3468 4.3468 4.3597 4.3597 4.5370 4.5370 4.6195 4.6195 5.9377 5.9377 6.2528 6.2528 11.0444 11.0444 11.4628 11.4628 11.5065 11.5065 12.5351 12.5351 13.5602 13.5602 13.6908 13.6908 k = 0.0658-0.0600-0.0392 ( 6179 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3535 -19.3535 -16.2708 -16.2708 -16.1372 -16.1372 -12.9038 -12.9038 -12.8969 -12.8969 -12.8525 -12.8525 -12.8481 -12.8481 -5.9947 -5.9947 -4.1061 -4.1061 -4.0837 -4.0837 -2.9378 -2.9378 -2.2528 -2.2528 -0.7998 -0.7998 -0.2557 -0.2557 -0.2278 -0.2278 -0.2120 -0.2120 -0.1605 -0.1605 0.6605 0.6605 3.5475 3.5475 3.5610 3.5610 4.0504 4.0504 4.0588 4.0588 4.3433 4.3433 4.3592 4.3592 4.5249 4.5249 4.6126 4.6126 5.9277 5.9277 6.2436 6.2436 11.0547 11.0547 11.4671 11.4671 11.5269 11.5269 12.5429 12.5429 13.5588 13.5588 13.6927 13.6927 k = 0.0789-0.0720-0.0470 ( 6180 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3526 -19.3526 -16.2704 -16.2704 -16.1370 -16.1370 -12.9070 -12.9070 -12.8972 -12.8972 -12.8549 -12.8549 -12.8487 -12.8487 -5.9939 -5.9939 -4.1052 -4.1052 -4.0824 -4.0824 -2.9220 -2.9220 -2.2479 -2.2479 -0.7873 -0.7873 -0.2636 -0.2636 -0.2252 -0.2252 -0.2097 -0.2097 -0.1612 -0.1612 0.6523 0.6523 3.5458 3.5458 3.5605 3.5605 4.0474 4.0474 4.0580 4.0580 4.3388 4.3388 4.3588 4.3588 4.5092 4.5092 4.6055 4.6055 5.9157 5.9157 6.2325 6.2325 11.0671 11.0671 11.4727 11.4727 11.5510 11.5510 12.5524 12.5524 13.5565 13.5565 13.6958 13.6958 k = 0.0921-0.0840-0.0548 ( 6176 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3516 -19.3516 -16.2700 -16.2700 -16.1368 -16.1368 -12.9108 -12.9108 -12.8974 -12.8974 -12.8575 -12.8575 -12.8494 -12.8494 -5.9929 -5.9929 -4.1044 -4.1044 -4.0805 -4.0805 -2.9035 -2.9035 -2.2419 -2.2419 -0.7728 -0.7728 -0.2734 -0.2734 -0.2239 -0.2239 -0.2061 -0.2061 -0.1608 -0.1608 0.6428 0.6428 3.5437 3.5437 3.5600 3.5600 4.0435 4.0435 4.0575 4.0575 4.3335 4.3335 4.3586 4.3586 4.4899 4.4899 4.5987 4.5987 5.9018 5.9018 6.2195 6.2195 11.0814 11.0814 11.4795 11.4795 11.5785 11.5785 12.5639 12.5639 13.5529 13.5529 13.7005 13.7005 k = 0.1053-0.0960-0.0627 ( 6170 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3504 -19.3504 -16.2694 -16.2694 -16.1366 -16.1366 -12.9152 -12.9152 -12.8977 -12.8977 -12.8605 -12.8605 -12.8502 -12.8502 -5.9918 -5.9918 -4.1039 -4.1039 -4.0779 -4.0779 -2.8827 -2.8827 -2.2348 -2.2348 -0.7562 -0.7562 -0.2851 -0.2851 -0.2244 -0.2244 -0.2010 -0.2010 -0.1590 -0.1590 0.6322 0.6322 3.5412 3.5412 3.5594 3.5594 4.0383 4.0383 4.0571 4.0571 4.3275 4.3275 4.3584 4.3584 4.4673 4.4673 4.5922 4.5922 5.8862 5.8862 6.2046 6.2046 11.0975 11.0975 11.4876 11.4876 11.6088 11.6088 12.5773 12.5773 13.5481 13.5481 13.7067 13.7067 k = 0.1184-0.1080-0.0705 ( 6163 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3491 -19.3491 -16.2687 -16.2687 -16.1365 -16.1365 -12.9202 -12.9202 -12.8981 -12.8981 -12.8637 -12.8637 -12.8511 -12.8511 -5.9906 -5.9906 -4.1035 -4.1035 -4.0746 -4.0746 -2.8596 -2.8596 -2.2264 -2.2264 -0.7378 -0.7378 -0.2987 -0.2987 -0.2267 -0.2267 -0.1947 -0.1947 -0.1558 -0.1558 0.6203 0.6203 3.5382 3.5382 3.5588 3.5588 4.0320 4.0320 4.0569 4.0569 4.3206 4.3206 4.3583 4.3583 4.4421 4.4421 4.5860 4.5860 5.8690 5.8690 6.1880 6.1880 11.1151 11.1151 11.4970 11.4970 11.6415 11.6415 12.5928 12.5928 13.5420 13.5420 13.7146 13.7146 k = 0.1316-0.1200-0.0783 ( 6158 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3477 -19.3477 -16.2679 -16.2679 -16.1364 -16.1364 -12.9258 -12.9258 -12.8984 -12.8984 -12.8671 -12.8671 -12.8520 -12.8520 -5.9892 -5.9892 -4.1034 -4.1034 -4.0708 -4.0708 -2.8345 -2.8345 -2.2167 -2.2167 -0.7177 -0.7177 -0.3142 -0.3142 -0.2302 -0.2302 -0.1878 -0.1878 -0.1510 -0.1510 0.6074 0.6074 3.5349 3.5349 3.5581 3.5581 4.0241 4.0241 4.0569 4.0569 4.3127 4.3127 4.3579 4.3579 4.4152 4.4152 4.5798 4.5798 5.8503 5.8503 6.1697 6.1697 11.1340 11.1340 11.5077 11.5077 11.6761 11.6761 12.6106 12.6106 13.5350 13.5350 13.7241 13.7241 k = 0.1447-0.1320-0.0862 ( 6158 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3461 -19.3461 -16.2670 -16.2670 -16.1363 -16.1363 -12.9318 -12.9318 -12.8987 -12.8987 -12.8707 -12.8707 -12.8531 -12.8531 -5.9878 -5.9878 -4.1033 -4.1033 -4.0663 -4.0663 -2.8073 -2.8073 -2.2057 -2.2057 -0.6959 -0.6959 -0.3315 -0.3315 -0.2349 -0.2349 -0.1805 -0.1805 -0.1447 -0.1447 0.5936 0.5936 3.5313 3.5313 3.5571 3.5571 4.0146 4.0146 4.0571 4.0571 4.3032 4.3032 4.3567 4.3567 4.3888 4.3888 4.5737 4.5737 5.8304 5.8304 6.1499 6.1499 11.1541 11.1541 11.5197 11.5197 11.7118 11.7118 12.6308 12.6308 13.5271 13.5271 13.7349 13.7349 k = 0.1579-0.1440-0.0940 ( 6168 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3445 -19.3445 -16.2660 -16.2660 -16.1364 -16.1364 -12.9384 -12.9384 -12.8991 -12.8991 -12.8743 -12.8743 -12.8542 -12.8542 -5.9863 -5.9863 -4.1034 -4.1034 -4.0614 -4.0614 -2.7785 -2.7785 -2.1932 -2.1932 -0.6729 -0.6729 -0.3504 -0.3504 -0.2405 -0.2405 -0.1732 -0.1732 -0.1369 -0.1369 0.5788 0.5788 3.5274 3.5274 3.5559 3.5559 4.0033 4.0033 4.0576 4.0576 4.2906 4.2906 4.3504 4.3504 4.3689 4.3689 4.5675 4.5675 5.8095 5.8095 6.1286 6.1286 11.1750 11.1750 11.5331 11.5331 11.7480 11.7480 12.6537 12.6537 13.5188 13.5188 13.7468 13.7468 k = 0.1711-0.1560-0.1018 ( 6170 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3427 -19.3427 -16.2648 -16.2648 -16.1365 -16.1365 -12.9455 -12.9455 -12.8995 -12.8995 -12.8781 -12.8781 -12.8554 -12.8554 -5.9846 -5.9846 -4.1034 -4.1034 -4.0561 -4.0561 -2.7480 -2.7480 -2.1791 -2.1791 -0.6486 -0.6486 -0.3707 -0.3707 -0.2471 -0.2471 -0.1661 -0.1661 -0.1276 -0.1276 0.5632 0.5632 3.5234 3.5234 3.5544 3.5544 3.9898 3.9898 4.0584 4.0584 4.2727 4.2727 4.3344 4.3344 4.3635 4.3635 4.5612 4.5612 5.7876 5.7876 6.1059 6.1059 11.1965 11.1965 11.5479 11.5479 11.7839 11.7839 12.6795 12.6795 13.5103 13.5103 13.7596 13.7596 k = 0.1842-0.1680-0.1097 ( 6162 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3409 -19.3409 -16.2634 -16.2634 -16.1367 -16.1367 -12.9531 -12.9531 -12.8998 -12.8998 -12.8819 -12.8819 -12.8567 -12.8567 -5.9829 -5.9829 -4.1035 -4.1035 -4.0505 -4.0505 -2.7161 -2.7161 -2.1636 -2.1636 -0.6234 -0.6234 -0.3920 -0.3920 -0.2548 -0.2548 -0.1592 -0.1592 -0.1170 -0.1170 0.5469 0.5469 3.5193 3.5193 3.5525 3.5525 3.9740 3.9740 4.0595 4.0595 4.2485 4.2485 4.3201 4.3201 4.3626 4.3626 4.5548 4.5548 5.7651 5.7651 6.0820 6.0820 11.2183 11.2183 11.5641 11.5641 11.8186 11.8186 12.7084 12.7084 13.5019 13.5019 13.7730 13.7730 k = 0.1974-0.1801-0.1175 ( 6164 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3390 -19.3390 -16.2619 -16.2619 -16.1370 -16.1370 -12.9610 -12.9610 -12.9002 -12.9002 -12.8856 -12.8856 -12.8581 -12.8581 -5.9812 -5.9812 -4.1035 -4.1035 -4.0446 -4.0446 -2.6829 -2.6829 -2.1465 -2.1465 -0.5978 -0.5978 -0.4138 -0.4138 -0.2634 -0.2634 -0.1524 -0.1524 -0.1054 -0.1054 0.5299 0.5299 3.5151 3.5151 3.5502 3.5502 3.9555 3.9555 4.0609 4.0609 4.2201 4.2201 4.3098 4.3098 4.3626 4.3626 4.5481 4.5481 5.7421 5.7421 6.0571 6.0571 11.2403 11.2403 11.5817 11.5817 11.8514 11.8514 12.7406 12.7406 13.4939 13.4939 13.7869 13.7869 k = 0.2105-0.1921-0.1253 ( 6168 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3371 -19.3371 -16.2602 -16.2602 -16.1375 -16.1375 -12.9693 -12.9693 -12.9005 -12.9005 -12.8894 -12.8894 -12.8595 -12.8595 -5.9794 -5.9794 -4.1034 -4.1034 -4.0385 -4.0385 -2.6487 -2.6487 -2.1279 -2.1279 -0.5729 -0.5729 -0.4352 -0.4352 -0.2732 -0.2732 -0.1457 -0.1457 -0.0928 -0.0928 0.5123 0.5123 3.5109 3.5109 3.5474 3.5474 3.9341 3.9341 4.0627 4.0627 4.1903 4.1903 4.3020 4.3020 4.3630 4.3630 4.5413 4.5413 5.7188 5.7188 6.0311 6.0311 11.2621 11.2621 11.6006 11.6006 11.8817 11.8817 12.7761 12.7761 13.4867 13.4867 13.8009 13.8009 k = 0.2237-0.2041-0.1332 ( 6173 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3351 -19.3351 -16.2584 -16.2584 -16.1381 -16.1381 -12.9779 -12.9779 -12.9009 -12.9009 -12.8931 -12.8931 -12.8610 -12.8610 -5.9776 -5.9776 -4.1033 -4.1033 -4.0322 -4.0322 -2.6134 -2.6134 -2.1079 -2.1079 -0.5511 -0.5511 -0.4536 -0.4536 -0.2841 -0.2841 -0.1390 -0.1390 -0.0796 -0.0796 0.4942 0.4942 3.5068 3.5068 3.5442 3.5442 3.9097 3.9097 4.0648 4.0648 4.1609 4.1609 4.2956 4.2956 4.3634 4.3634 4.5344 4.5344 5.6955 5.6955 6.0044 6.0044 11.2835 11.2835 11.6209 11.6209 11.9088 11.9088 12.8148 12.8148 13.4805 13.4805 13.8148 13.8148 k = 0.2368-0.2161-0.1410 ( 6173 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3330 -19.3330 -16.2564 -16.2564 -16.1389 -16.1389 -12.9867 -12.9867 -12.9012 -12.9012 -12.8966 -12.8966 -12.8625 -12.8625 -5.9757 -5.9757 -4.1031 -4.1031 -4.0259 -4.0259 -2.5773 -2.5773 -2.0864 -2.0864 -0.5395 -0.5395 -0.4619 -0.4619 -0.2961 -0.2961 -0.1323 -0.1323 -0.0659 -0.0659 0.4756 0.4756 3.5029 3.5029 3.5406 3.5406 3.8823 3.8823 4.0670 4.0670 4.1332 4.1332 4.2901 4.2901 4.3640 4.3640 4.5273 4.5273 5.6722 5.6722 5.9770 5.9770 11.3044 11.3044 11.6424 11.6424 11.9323 11.9323 12.8563 12.8563 13.4756 13.4756 13.8282 13.8282 k = 0.2500-0.2281-0.1488 ( 6172 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3310 -19.3310 -16.2542 -16.2542 -16.1398 -16.1398 -12.9957 -12.9957 -12.9015 -12.9015 -12.9001 -12.9001 -12.8641 -12.8641 -5.9739 -5.9739 -4.1028 -4.1028 -4.0195 -4.0195 -2.5405 -2.5405 -2.0638 -2.0638 -0.5462 -0.5462 -0.4520 -0.4520 -0.3091 -0.3091 -0.1256 -0.1256 -0.0518 -0.0518 0.4566 0.4566 3.4990 3.4990 3.5365 3.5365 3.8520 3.8520 4.0689 4.0689 4.1083 4.1083 4.2850 4.2850 4.3647 4.3647 4.5200 4.5200 5.6493 5.6493 5.9491 5.9491 11.3246 11.3246 11.6649 11.6649 11.9520 11.9520 12.8999 12.8999 13.4725 13.4725 13.8407 13.8407 k = 0.2632-0.2401-0.1567 ( 6172 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3290 -19.3290 -16.2518 -16.2518 -16.1409 -16.1409 -13.0047 -13.0047 -12.9036 -12.9036 -12.9016 -12.9016 -12.8657 -12.8657 -5.9720 -5.9720 -4.1025 -4.1025 -4.0131 -4.0131 -2.5030 -2.5030 -2.0401 -2.0401 -0.5652 -0.5652 -0.4302 -0.4302 -0.3231 -0.3231 -0.1189 -0.1189 -0.0375 -0.0375 0.4374 0.4374 3.4954 3.4954 3.5320 3.5320 3.8193 3.8193 4.0673 4.0673 4.0895 4.0895 4.2803 4.2803 4.3654 4.3654 4.5127 4.5127 5.6269 5.6269 5.9209 5.9209 11.3439 11.3439 11.6884 11.6884 11.9679 11.9679 12.9448 12.9448 13.4716 13.4716 13.8517 13.8517 k = 0.2763-0.2521-0.1645 ( 6166 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3269 -19.3269 -16.2493 -16.2493 -16.1422 -16.1422 -13.0138 -13.0138 -12.9068 -12.9068 -12.9018 -12.9018 -12.8673 -12.8673 -5.9702 -5.9702 -4.1021 -4.1021 -4.0069 -4.0069 -2.4651 -2.4651 -2.0155 -2.0155 -0.5886 -0.5886 -0.4047 -0.4047 -0.3376 -0.3376 -0.1123 -0.1123 -0.0231 -0.0231 0.4180 0.4180 3.4919 3.4919 3.5271 3.5271 3.7848 3.7848 4.0545 4.0545 4.0845 4.0845 4.2757 4.2757 4.3663 4.3663 4.5053 4.5053 5.6050 5.6050 5.8926 5.8926 11.3622 11.3622 11.7125 11.7125 11.9799 11.9799 12.9894 12.9894 13.4733 13.4733 13.8600 13.8600 k = 0.2895-0.2641-0.1723 ( 6165 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3249 -19.3249 -16.2466 -16.2466 -16.1436 -16.1436 -13.0228 -13.0228 -12.9099 -12.9099 -12.9019 -12.9019 -12.8690 -12.8690 -5.9684 -5.9684 -4.1016 -4.1016 -4.0007 -4.0007 -2.4267 -2.4267 -1.9904 -1.9904 -0.6136 -0.6136 -0.3814 -0.3814 -0.3494 -0.3494 -0.1057 -0.1057 -0.0087 -0.0087 0.3984 0.3984 3.4885 3.4885 3.5219 3.5219 3.7491 3.7491 4.0368 4.0368 4.0868 4.0868 4.2712 4.2712 4.3672 4.3672 4.4978 4.4978 5.5841 5.5841 5.8642 5.8642 11.3796 11.3796 11.7370 11.7370 11.9885 11.9885 13.0324 13.0324 13.4780 13.4780 13.8643 13.8644 k = 0.3026-0.2761-0.1802 ( 6161 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3230 -19.3230 -16.2438 -16.2438 -16.1452 -16.1452 -13.0318 -13.0318 -12.9128 -12.9128 -12.9020 -12.9020 -12.8707 -12.8707 -5.9667 -5.9667 -4.1011 -4.1011 -3.9947 -3.9947 -2.3880 -2.3880 -1.9650 -1.9650 -0.6390 -0.6390 -0.3802 -0.3802 -0.3396 -0.3396 -0.0992 -0.0992 0.0055 0.0055 0.3788 0.3788 3.4851 3.4851 3.5164 3.5164 3.7130 3.7130 4.0198 4.0198 4.0907 4.0907 4.2667 4.2667 4.3682 4.3682 4.4904 4.4904 5.5640 5.5640 5.8361 5.8361 11.3958 11.3958 11.7615 11.7615 11.9940 11.9940 13.0719 13.0719 13.4858 13.4858 13.8650 13.8650 k = 0.3158-0.2881-0.1880 ( 6166 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3211 -19.3211 -16.2409 -16.2409 -16.1470 -16.1470 -13.0405 -13.0405 -12.9156 -12.9156 -12.9020 -12.9020 -12.8724 -12.8724 -5.9650 -5.9650 -4.1006 -4.1006 -3.9888 -3.9888 -2.3491 -2.3491 -1.9397 -1.9397 -0.6643 -0.6643 -0.3957 -0.3957 -0.3142 -0.3142 -0.0929 -0.0929 0.0194 0.0194 0.3593 0.3593 3.4817 3.4817 3.5108 3.5108 3.6771 3.6771 4.0041 4.0041 4.0952 4.0952 4.2621 4.2621 4.3692 4.3692 4.4830 4.4830 5.5450 5.5450 5.8084 5.8084 11.4110 11.4110 11.7859 11.7859 11.9967 11.9967 13.1065 13.1065 13.4966 13.4966 13.8655 13.8655 k = 0.3289-0.3001-0.1958 ( 6160 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3192 -19.3192 -16.2378 -16.2378 -16.1490 -16.1490 -13.0490 -13.0490 -12.9182 -12.9182 -12.9020 -12.9020 -12.8741 -12.8741 -5.9634 -5.9634 -4.1001 -4.1001 -3.9833 -3.9833 -2.3101 -2.3101 -1.9149 -1.9149 -0.6890 -0.6890 -0.4139 -0.4139 -0.2873 -0.2873 -0.0868 -0.0868 0.0329 0.0329 0.3400 0.3400 3.4780 3.4780 3.5050 3.5050 3.6422 3.6422 3.9899 3.9899 4.1001 4.1001 4.2574 4.2574 4.3704 4.3704 4.4757 4.4757 5.5272 5.5272 5.7812 5.7812 11.4250 11.4250 11.8095 11.8095 11.9974 11.9974 13.1351 13.1351 13.5091 13.5091 13.8704 13.8704 k = 0.3421-0.3121-0.2037 ( 6154 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3175 -19.3175 -16.2345 -16.2345 -16.1511 -16.1511 -13.0572 -13.0572 -12.9206 -12.9206 -12.9018 -12.9018 -12.8758 -12.8758 -5.9619 -5.9619 -4.0995 -4.0995 -3.9779 -3.9779 -2.2712 -2.2712 -1.8910 -1.8910 -0.7128 -0.7128 -0.4330 -0.4330 -0.2609 -0.2609 -0.0809 -0.0809 0.0459 0.0459 0.3212 0.3212 3.4738 3.4738 3.4992 3.4992 3.6091 3.6091 3.9772 3.9772 4.1051 4.1051 4.2527 4.2527 4.3716 4.3716 4.4685 4.4685 5.5108 5.5108 5.7548 5.7548 11.4379 11.4379 11.8321 11.8321 11.9966 11.9966 13.1574 13.1574 13.5219 13.5219 13.8824 13.8824 k = 0.3553-0.3241-0.2115 ( 6156 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3158 -19.3158 -16.2312 -16.2312 -16.1534 -16.1534 -13.0649 -13.0649 -12.9228 -12.9228 -12.9016 -12.9016 -12.8775 -12.8775 -5.9605 -5.9605 -4.0990 -4.0990 -3.9729 -3.9729 -2.2324 -2.2324 -1.8684 -1.8684 -0.7356 -0.7356 -0.4525 -0.4525 -0.2354 -0.2354 -0.0753 -0.0753 0.0584 0.0584 0.3028 0.3028 3.4684 3.4684 3.4933 3.4933 3.5789 3.5789 3.9660 3.9660 4.1101 4.1101 4.2478 4.2478 4.3729 4.3729 4.4615 4.4615 5.4957 5.4957 5.7293 5.7293 11.4497 11.4497 11.8530 11.8530 11.9950 11.9950 13.1739 13.1739 13.5330 13.5330 13.9019 13.9019 k = 0.3684-0.3361-0.2193 ( 6150 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3142 -19.3142 -16.2278 -16.2278 -16.1558 -16.1558 -13.0723 -13.0723 -12.9249 -12.9249 -12.9014 -12.9014 -12.8791 -12.8791 -5.9591 -5.9591 -4.0985 -4.0985 -3.9683 -3.9683 -2.1941 -2.1941 -1.8476 -1.8476 -0.7569 -0.7569 -0.4721 -0.4721 -0.2112 -0.2112 -0.0700 -0.0700 0.0701 0.0701 0.2852 0.2852 3.4609 3.4609 3.4876 3.4876 3.5527 3.5527 3.9562 3.9562 4.1151 4.1151 4.2430 4.2430 4.3744 4.3744 4.4548 4.4548 5.4820 5.4820 5.7049 5.7049 11.4603 11.4603 11.8716 11.8716 11.9935 11.9935 13.1855 13.1855 13.5416 13.5416 13.9260 13.9260 k = 0.3816-0.3481-0.2272 ( 6142 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3128 -19.3128 -16.2243 -16.2243 -16.1584 -16.1584 -13.0791 -13.0791 -12.9267 -12.9267 -12.9010 -12.9010 -12.8808 -12.8808 -5.9579 -5.9579 -4.0980 -4.0980 -3.9639 -3.9639 -2.1563 -2.1563 -1.8290 -1.8290 -0.7765 -0.7765 -0.4914 -0.4914 -0.1887 -0.1887 -0.0651 -0.0651 0.0811 0.0811 0.2685 0.2685 3.4503 3.4503 3.4819 3.4819 3.5321 3.5321 3.9476 3.9476 4.1199 4.1199 4.2381 4.2381 4.3760 4.3760 4.4482 4.4482 5.4699 5.4699 5.6820 5.6820 11.4698 11.4698 11.8872 11.8872 11.9930 11.9930 13.1933 13.1933 13.5473 13.5473 13.9481 13.9481 k = 0.3947-0.3601-0.2350 ( 6144 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3114 -19.3114 -16.2207 -16.2207 -16.1612 -16.1612 -13.0854 -13.0854 -12.9284 -12.9284 -12.9006 -12.9006 -12.8824 -12.8824 -5.9568 -5.9568 -4.0975 -4.0975 -3.9600 -3.9600 -2.1195 -2.1195 -1.8131 -1.8131 -0.7944 -0.7944 -0.5102 -0.5102 -0.1679 -0.1679 -0.0606 -0.0606 0.0911 0.0911 0.2529 0.2529 3.4360 3.4360 3.4764 3.4764 3.5177 3.5177 3.9404 3.9404 4.1245 4.1245 4.2334 4.2334 4.3778 4.3778 4.4419 4.4419 5.4592 5.4592 5.6605 5.6605 11.4782 11.4782 11.8990 11.8990 11.9944 11.9944 13.1983 13.1983 13.5508 13.5508 13.9634 13.9634 k = 0.4079-0.3721-0.2428 ( 6137 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3102 -19.3102 -16.2171 -16.2171 -16.1640 -16.1640 -13.0910 -13.0910 -12.9298 -12.9298 -12.9001 -12.9001 -12.8839 -12.8839 -5.9558 -5.9558 -4.0971 -4.0971 -3.9565 -3.9565 -2.0840 -2.0840 -1.8002 -1.8002 -0.8102 -0.8102 -0.5280 -0.5280 -0.1492 -0.1492 -0.0566 -0.0566 0.1002 0.1002 0.2386 0.2386 3.4193 3.4193 3.4714 3.4714 3.5085 3.5085 3.9343 3.9343 4.1288 4.1288 4.2288 4.2288 4.3797 4.3797 4.4359 4.4359 5.4501 5.4501 5.6408 5.6408 11.4855 11.4855 11.9065 11.9065 11.9983 11.9983 13.2014 13.2014 13.5525 13.5525 13.9737 13.9737 k = 0.4211-0.3841-0.2507 ( 6141 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3092 -19.3092 -16.2135 -16.2135 -16.1670 -16.1670 -13.0960 -13.0960 -12.9311 -12.9311 -12.8995 -12.8995 -12.8854 -12.8854 -5.9549 -5.9549 -4.0967 -4.0967 -3.9534 -3.9534 -2.0501 -2.0501 -1.7906 -1.7906 -0.8238 -0.8238 -0.5445 -0.5445 -0.1326 -0.1326 -0.0531 -0.0531 0.1082 0.1082 0.2258 0.2258 3.4020 3.4020 3.4670 3.4670 3.5027 3.5027 3.9293 3.9293 4.1326 4.1326 4.2245 4.2245 4.3818 4.3818 4.4302 4.4302 5.4425 5.4425 5.6230 5.6230 11.4917 11.4917 11.9101 11.9101 12.0043 12.0043 13.2030 13.2030 13.5532 13.5532 13.9812 13.9812 k = 0.4342-0.3961-0.2585 ( 6145 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3083 -19.3083 -16.2100 -16.2100 -16.1700 -16.1700 -13.1003 -13.1003 -12.9322 -12.9322 -12.8989 -12.8989 -12.8869 -12.8869 -5.9541 -5.9541 -4.0964 -4.0964 -3.9508 -3.9508 -2.0184 -2.0184 -1.7843 -1.7843 -0.8352 -0.8352 -0.5594 -0.5594 -0.1185 -0.1185 -0.0500 -0.0500 0.1151 0.1151 0.2147 0.2147 3.3858 3.3858 3.4631 3.4631 3.4990 3.4990 3.9253 3.9253 4.1360 4.1360 4.2206 4.2206 4.3841 4.3841 4.4248 4.4248 5.4363 5.4363 5.6074 5.6074 11.4969 11.4969 11.9111 11.9111 12.0115 12.0115 13.2038 13.2038 13.5533 13.5533 13.9868 13.9868 k = 0.4474-0.4081-0.2663 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3075 -19.3075 -16.2065 -16.2065 -16.1730 -16.1730 -13.1039 -13.1039 -12.9331 -12.9331 -12.8982 -12.8982 -12.8882 -12.8882 -5.9535 -5.9535 -4.0961 -4.0961 -3.9486 -3.9486 -1.9896 -1.9896 -1.7813 -1.7813 -0.8443 -0.8443 -0.5723 -0.5723 -0.1068 -0.1068 -0.0474 -0.0474 0.1208 0.1208 0.2055 0.2055 3.3718 3.3718 3.4598 3.4598 3.4965 3.4965 3.9223 3.9223 4.1389 4.1389 4.2172 4.2172 4.3866 4.3866 4.4198 4.4198 5.4314 5.4314 5.5943 5.5943 11.5010 11.5010 11.9105 11.9105 12.0187 12.0187 13.2041 13.2041 13.5531 13.5531 13.9912 13.9912 k = 0.4605-0.4201-0.2742 ( 6141 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3069 -19.3069 -16.2032 -16.2032 -16.1760 -16.1760 -13.1067 -13.1067 -12.9337 -12.9337 -12.8975 -12.8975 -12.8895 -12.8895 -5.9530 -5.9530 -4.0959 -4.0959 -3.9469 -3.9469 -1.9646 -1.9646 -1.7809 -1.7809 -0.8513 -0.8513 -0.5827 -0.5827 -0.0977 -0.0977 -0.0454 -0.0454 0.1252 0.1252 0.1981 0.1981 3.3604 3.3604 3.4573 3.4573 3.4949 3.4949 3.9200 3.9200 4.1412 4.1412 4.2144 4.2144 4.3893 4.3893 4.4152 4.4152 5.4278 5.4278 5.5837 5.5837 11.5042 11.5042 11.9093 11.9093 12.0250 12.0250 13.2041 13.2041 13.5528 13.5528 13.9945 13.9945 k = 0.4737-0.4321-0.2820 ( 6142 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3065 -19.3065 -16.2002 -16.2002 -16.1787 -16.1787 -13.1087 -13.1087 -12.9342 -12.9342 -12.8968 -12.8968 -12.8906 -12.8906 -5.9527 -5.9527 -4.0957 -4.0957 -3.9456 -3.9456 -1.9448 -1.9448 -1.7824 -1.7824 -0.8561 -0.8561 -0.5905 -0.5905 -0.0913 -0.0913 -0.0439 -0.0439 0.1285 0.1285 0.1929 0.1929 3.3521 3.3521 3.4554 3.4554 3.4938 3.4938 3.9184 3.9184 4.1429 4.1429 4.2124 4.2124 4.3920 4.3920 4.4111 4.4111 5.4253 5.4253 5.5760 5.5760 11.5064 11.5064 11.9081 11.9081 12.0298 12.0298 13.2039 13.2039 13.5525 13.5525 13.9967 13.9967 k = 0.4868-0.4441-0.2898 ( 6138 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3063 -19.3063 -16.1980 -16.1980 -16.1807 -16.1807 -13.1099 -13.1099 -12.9345 -12.9345 -12.8962 -12.8962 -12.8914 -12.8914 -5.9525 -5.9525 -4.0956 -4.0956 -3.9449 -3.9449 -1.9318 -1.9318 -1.7844 -1.7844 -0.8590 -0.8590 -0.5952 -0.5952 -0.0874 -0.0874 -0.0430 -0.0430 0.1304 0.1304 0.1897 0.1897 3.3470 3.3470 3.4543 3.4543 3.4932 3.4932 3.9175 3.9175 4.1439 4.1439 4.2111 4.2111 4.3943 4.3943 4.4079 4.4079 5.4239 5.4239 5.5714 5.5714 11.5078 11.5078 11.9072 11.9072 12.0329 12.0329 13.2038 13.2038 13.5523 13.5523 13.9981 13.9981 k = 0.5000-0.4561-0.2977 ( 6130 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3062 -19.3062 -16.1971 -16.1971 -16.1816 -16.1816 -13.1103 -13.1103 -12.9346 -12.9346 -12.8959 -12.8959 -12.8917 -12.8917 -5.9524 -5.9524 -4.0956 -4.0956 -3.9446 -3.9446 -1.9272 -1.9272 -1.7852 -1.7852 -0.8599 -0.8599 -0.5968 -0.5968 -0.0861 -0.0861 -0.0426 -0.0426 0.1310 0.1310 0.1887 0.1887 3.3453 3.3453 3.4539 3.4539 3.4930 3.4930 3.9173 3.9173 4.1442 4.1442 4.2107 4.2107 4.3954 4.3954 4.4066 4.4066 5.4234 5.4234 5.5698 5.5698 11.5082 11.5082 11.9069 11.9069 12.0339 12.0339 13.2038 13.2038 13.5522 13.5522 13.9985 13.9985 k = 0.5000-0.4561-0.2977 ( 6130 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3062 -19.3062 -16.1971 -16.1971 -16.1816 -16.1816 -13.1103 -13.1103 -12.9346 -12.9346 -12.8959 -12.8959 -12.8917 -12.8917 -5.9524 -5.9524 -4.0956 -4.0956 -3.9446 -3.9446 -1.9272 -1.9272 -1.7852 -1.7852 -0.8599 -0.8599 -0.5968 -0.5968 -0.0861 -0.0861 -0.0426 -0.0426 0.1310 0.1310 0.1887 0.1887 3.3453 3.3453 3.4539 3.4539 3.4930 3.4930 3.9173 3.9173 4.1442 4.1442 4.2107 4.2107 4.3954 4.3954 4.4066 4.4066 5.4234 5.4234 5.5698 5.5698 11.5082 11.5082 11.9069 11.9069 12.0339 12.0339 13.2038 13.2038 13.5522 13.5522 13.9985 13.9985 k = 0.5000-0.4455-0.3140 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3061 -19.3061 -16.1971 -16.1971 -16.1816 -16.1816 -13.1105 -13.1105 -12.9348 -12.9348 -12.8958 -12.8958 -12.8916 -12.8916 -5.9524 -5.9524 -4.0953 -4.0953 -3.9448 -3.9448 -1.9261 -1.9261 -1.7844 -1.7844 -0.8620 -0.8620 -0.5978 -0.5978 -0.0854 -0.0854 -0.0415 -0.0415 0.1314 0.1314 0.1886 0.1886 3.3452 3.3452 3.4509 3.4509 3.4963 3.4963 3.9167 3.9167 4.1371 4.1371 4.2174 4.2174 4.3959 4.3959 4.4062 4.4062 5.4230 5.4230 5.5686 5.5686 11.5095 11.5095 11.9078 11.9078 12.0338 12.0338 13.2044 13.2044 13.5531 13.5531 13.9891 13.9891 k = 0.5000-0.4348-0.3304 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3060 -19.3060 -16.1969 -16.1969 -16.1817 -16.1817 -13.1111 -13.1111 -12.9355 -12.9355 -12.8954 -12.8954 -12.8914 -12.8914 -5.9522 -5.9522 -4.0945 -4.0945 -3.9451 -3.9451 -1.9225 -1.9225 -1.7820 -1.7820 -0.8684 -0.8684 -0.6008 -0.6008 -0.0835 -0.0835 -0.0381 -0.0381 0.1323 0.1323 0.1883 0.1883 3.3451 3.3451 3.4436 3.4436 3.5042 3.5042 3.9153 3.9153 4.1207 4.1207 4.2326 4.2326 4.3966 4.3966 4.4057 4.4057 5.4216 5.4216 5.5651 5.5651 11.5132 11.5132 11.9104 11.9104 12.0334 12.0334 13.2062 13.2062 13.5556 13.5556 13.9637 13.9637 k = 0.5000-0.4241-0.3468 ( 6142 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3059 -19.3059 -16.1966 -16.1966 -16.1818 -16.1818 -13.1121 -13.1121 -12.9366 -12.9366 -12.8949 -12.8949 -12.8910 -12.8910 -5.9519 -5.9519 -4.0931 -4.0931 -3.9457 -3.9457 -1.9167 -1.9167 -1.7779 -1.7779 -0.8789 -0.8789 -0.6057 -0.6057 -0.0804 -0.0804 -0.0326 -0.0326 0.1338 0.1338 0.1878 0.1878 3.3447 3.3447 3.4344 3.4344 3.5144 3.5144 3.9130 3.9130 4.1005 4.1005 4.2508 4.2508 4.3956 4.3956 4.4071 4.4071 5.4194 5.4194 5.5593 5.5593 11.5193 11.5193 11.9148 11.9148 12.0327 12.0327 13.2093 13.2093 13.5598 13.5598 13.9284 13.9284 k = 0.5000-0.4134-0.3631 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3057 -19.3057 -16.1962 -16.1962 -16.1820 -16.1820 -13.1135 -13.1135 -12.9379 -12.9379 -12.8942 -12.8942 -12.8905 -12.8905 -5.9516 -5.9516 -4.0912 -4.0912 -3.9466 -3.9466 -1.9085 -1.9085 -1.7723 -1.7723 -0.8933 -0.8933 -0.6124 -0.6124 -0.0760 -0.0760 -0.0252 -0.0252 0.1359 0.1359 0.1872 0.1872 3.3443 3.3443 3.4242 3.4242 3.5258 3.5258 3.9102 3.9102 4.0787 4.0787 4.2697 4.2697 4.3918 4.3918 4.4111 4.4111 5.4165 5.4165 5.5515 5.5515 11.5278 11.5278 11.9209 11.9209 12.0317 12.0317 13.2137 13.2137 13.5656 13.5656 13.8877 13.8877 k = 0.5000-0.4027-0.3795 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3054 -19.3054 -16.1958 -16.1958 -16.1822 -16.1822 -13.1152 -13.1152 -12.9395 -12.9395 -12.8935 -12.8935 -12.8899 -12.8899 -5.9511 -5.9511 -4.0887 -4.0887 -3.9476 -3.9476 -1.8981 -1.8981 -1.7649 -1.7649 -0.9112 -0.9112 -0.6208 -0.6208 -0.0704 -0.0704 -0.0162 -0.0162 0.1385 0.1385 0.1864 0.1864 3.3437 3.3437 3.4135 3.4135 3.5380 3.5380 3.9071 3.9071 4.0563 4.0563 4.2886 4.2886 4.3859 4.3859 4.4168 4.4168 5.4129 5.4129 5.5417 5.5417 11.5385 11.5385 11.9284 11.9284 12.0303 12.0303 13.2193 13.2193 13.5728 13.5728 13.8446 13.8446 k = 0.5000-0.3921-0.3958 ( 6128 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3051 -19.3051 -16.1952 -16.1952 -16.1825 -16.1825 -13.1173 -13.1173 -12.9413 -12.9413 -12.8927 -12.8927 -12.8891 -12.8891 -5.9506 -5.9506 -4.0859 -4.0859 -3.9489 -3.9489 -1.8855 -1.8855 -1.7559 -1.7559 -0.9325 -0.9325 -0.6307 -0.6307 -0.0638 -0.0638 -0.0058 -0.0058 0.1413 0.1413 0.1853 0.1853 3.3430 3.3430 3.4022 3.4022 3.5508 3.5508 3.9041 3.9041 4.0335 4.0335 4.3071 4.3071 4.3785 4.3785 4.4234 4.4234 5.4088 5.4088 5.5302 5.5302 11.5512 11.5512 11.9374 11.9374 12.0284 12.0284 13.2263 13.2263 13.5811 13.5811 13.8007 13.8007 k = 0.5000-0.3814-0.4122 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3048 -19.3048 -16.1946 -16.1946 -16.1828 -16.1828 -13.1197 -13.1197 -12.9432 -12.9432 -12.8920 -12.8920 -12.8881 -12.8881 -5.9500 -5.9500 -4.0825 -4.0825 -3.9504 -3.9504 -1.8710 -1.8710 -1.7453 -1.7453 -0.9569 -0.9569 -0.6422 -0.6422 -0.0562 -0.0562 0.0056 0.0056 0.1444 0.1444 0.1841 0.1841 3.3419 3.3419 3.3904 3.3904 3.5641 3.5641 3.9014 3.9014 4.0106 4.0106 4.3251 4.3251 4.3696 4.3696 4.4306 4.4306 5.4044 5.4044 5.5173 5.5173 11.5659 11.5659 11.9476 11.9476 12.0261 12.0261 13.2346 13.2346 13.5901 13.5901 13.7575 13.7575 k = 0.5000-0.3707-0.4286 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3044 -19.3044 -16.1939 -16.1939 -16.1831 -16.1831 -13.1223 -13.1223 -12.9451 -12.9451 -12.8914 -12.8914 -12.8871 -12.8871 -5.9493 -5.9493 -4.0788 -4.0788 -3.9521 -3.9521 -1.8544 -1.8544 -1.7331 -1.7331 -0.9839 -0.9839 -0.6549 -0.6549 -0.0476 -0.0476 0.0178 0.0178 0.1476 0.1476 0.1826 0.1826 3.3407 3.3407 3.3781 3.3781 3.5777 3.5777 3.8995 3.8995 3.9878 3.9878 4.3422 4.3422 4.3597 4.3597 4.4380 4.4380 5.3999 5.3999 5.5033 5.5033 11.5822 11.5822 11.9590 11.9590 12.0230 12.0230 13.2444 13.2444 13.5984 13.5984 13.7169 13.7169 k = 0.5000-0.3600-0.4449 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3040 -19.3040 -16.1931 -16.1931 -16.1835 -16.1835 -13.1252 -13.1252 -12.9470 -12.9470 -12.8909 -12.8909 -12.8860 -12.8860 -5.9486 -5.9486 -4.0747 -4.0747 -3.9540 -3.9540 -1.8361 -1.8361 -1.7193 -1.7193 -1.0133 -1.0133 -0.6686 -0.6686 -0.0383 -0.0383 0.0304 0.0304 0.1509 0.1509 0.1809 0.1809 3.3392 3.3392 3.3652 3.3652 3.5916 3.5916 3.8984 3.8984 3.9653 3.9653 4.3473 4.3473 4.3597 4.3597 4.4453 4.4453 5.3954 5.3954 5.4884 5.4884 11.6000 11.6000 11.9713 11.9713 12.0193 12.0193 13.2556 13.2556 13.6016 13.6016 13.6834 13.6834 k = 0.5000-0.3494-0.4613 ( 6138 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3035 -19.3035 -16.1923 -16.1923 -16.1839 -16.1839 -13.1283 -13.1283 -12.9487 -12.9487 -12.8906 -12.8906 -12.8847 -12.8847 -5.9478 -5.9478 -4.0704 -4.0704 -3.9560 -3.9560 -1.8161 -1.8161 -1.7039 -1.7039 -1.0447 -1.0447 -0.6831 -0.6831 -0.0284 -0.0284 0.0432 0.0432 0.1540 0.1540 0.1790 0.1790 3.3372 3.3372 3.3520 3.3520 3.6057 3.6057 3.8982 3.8982 3.9435 3.9435 4.3351 4.3351 4.3752 4.3752 4.4523 4.4523 5.3912 5.3912 5.4730 5.4730 11.6189 11.6189 11.9843 11.9843 12.0148 12.0148 13.2682 13.2682 13.5896 13.5896 13.6676 13.6676 k = 0.5000-0.3387-0.4776 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3030 -19.3030 -16.1915 -16.1915 -16.1843 -16.1843 -13.1315 -13.1315 -12.9504 -12.9504 -12.8905 -12.8905 -12.8833 -12.8833 -5.9470 -5.9470 -4.0658 -4.0658 -3.9582 -3.9582 -1.7947 -1.7947 -1.6869 -1.6869 -1.0779 -1.0779 -0.6983 -0.6983 -0.0179 -0.0179 0.0559 0.0559 0.1569 0.1569 0.1769 0.1769 3.3333 3.3333 3.3399 3.3399 3.6198 3.6198 3.8977 3.8977 3.9238 3.9238 4.3216 4.3216 4.3902 4.3902 4.4588 4.4588 5.3874 5.3874 5.4575 5.4575 11.6385 11.6385 11.9972 11.9972 12.0101 12.0101 13.2823 13.2823 13.5606 13.5606 13.6712 13.6712 k = 0.5000-0.3280-0.4940 ( 6138 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3026 -19.3026 -16.1907 -16.1907 -16.1846 -16.1846 -13.1348 -13.1348 -12.9519 -12.9519 -12.8906 -12.8906 -12.8818 -12.8818 -5.9462 -5.9462 -4.0611 -4.0611 -3.9605 -3.9605 -1.7721 -1.7721 -1.6685 -1.6685 -1.1126 -1.1126 -0.7139 -0.7139 -0.0070 -0.0070 0.0683 0.0683 0.1594 0.1594 0.1748 0.1748 3.3215 3.3215 3.3348 3.3348 3.6340 3.6340 3.8901 3.8901 3.9132 3.9132 4.3071 4.3071 4.4045 4.4045 4.4648 4.4648 5.3841 5.3841 5.4421 5.4421 11.6586 11.6586 12.0003 12.0003 12.0148 12.0148 13.2977 13.2977 13.5257 13.5257 13.6835 13.6835 k = 0.5000-0.3173-0.5103 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3021 -19.3021 -16.1899 -16.1899 -16.1850 -16.1850 -13.1382 -13.1382 -12.9532 -12.9532 -12.8910 -12.8910 -12.8802 -12.8802 -5.9454 -5.9454 -4.0563 -4.0563 -3.9629 -3.9629 -1.7485 -1.7485 -1.6489 -1.6489 -1.1485 -1.1485 -0.7296 -0.7296 0.0039 0.0039 0.0800 0.0800 0.1615 0.1615 0.1727 0.1727 3.3068 3.3068 3.3319 3.3319 3.6480 3.6480 3.8723 3.8723 3.9149 3.9149 4.2918 4.2918 4.4180 4.4180 4.4701 4.4701 5.3816 5.3816 5.4272 5.4272 11.6786 11.6786 11.9931 11.9931 12.0291 12.0291 13.3139 13.3139 13.4905 13.4905 13.6992 13.6992 k = 0.5000-0.3067-0.5267 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3016 -19.3016 -16.1892 -16.1892 -16.1854 -16.1854 -13.1416 -13.1416 -12.9542 -12.9542 -12.8915 -12.8915 -12.8785 -12.8785 -5.9446 -5.9446 -4.0514 -4.0514 -3.9654 -3.9654 -1.7242 -1.7242 -1.6282 -1.6282 -1.1851 -1.1851 -0.7451 -0.7451 0.0148 0.0148 0.0909 0.0909 0.1628 0.1628 0.1710 0.1710 3.2914 3.2914 3.3290 3.3290 3.6619 3.6619 3.8523 3.8523 3.9211 3.9211 4.2759 4.2759 4.4308 4.4308 4.4749 4.4749 5.3799 5.3799 5.4131 5.4131 11.6980 11.6980 11.9839 11.9839 12.0448 12.0448 13.3299 13.3299 13.4577 13.4577 13.7166 13.7166 k = 0.5000-0.2960-0.5431 ( 6160 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3012 -19.3012 -16.1885 -16.1885 -16.1857 -16.1857 -13.1449 -13.1449 -12.9550 -12.9550 -12.8923 -12.8923 -12.8767 -12.8767 -5.9439 -5.9439 -4.0466 -4.0466 -3.9679 -3.9679 -1.6996 -1.6996 -1.6068 -1.6068 -1.2219 -1.2219 -0.7602 -0.7602 0.0254 0.0254 0.1006 0.1006 0.1629 0.1629 0.1703 0.1703 3.2757 3.2757 3.3260 3.3260 3.6755 3.6755 3.8321 3.8321 3.9295 3.9295 4.2595 4.2595 4.4427 4.4427 4.4791 4.4791 5.3791 5.3791 5.4001 5.4001 11.7163 11.7163 11.9731 11.9731 12.0613 12.0613 13.3423 13.3423 13.4312 13.4312 13.7350 13.7350 k = 0.5000-0.2853-0.5594 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3008 -19.3008 -16.1879 -16.1879 -16.1859 -16.1859 -13.1481 -13.1481 -12.9556 -12.9556 -12.8934 -12.8934 -12.8748 -12.8748 -5.9432 -5.9432 -4.0419 -4.0419 -3.9705 -3.9705 -1.6749 -1.6749 -1.5856 -1.5856 -1.2580 -1.2580 -0.7745 -0.7745 0.0355 0.0355 0.1087 0.1087 0.1621 0.1621 0.1708 0.1708 3.2600 3.2600 3.3227 3.3227 3.6889 3.6889 3.8125 3.8125 3.9396 3.9396 4.2429 4.2429 4.4538 4.4538 4.4831 4.4831 5.3784 5.3784 5.3892 5.3892 11.7329 11.7329 11.9607 11.9607 12.0787 12.0787 13.3420 13.3420 13.4203 13.4203 13.7539 13.7539 k = 0.5000-0.2746-0.5758 ( 6142 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3004 -19.3004 -16.1875 -16.1875 -16.1861 -16.1861 -13.1511 -13.1511 -12.9558 -12.9558 -12.8946 -12.8946 -12.8729 -12.8729 -5.9426 -5.9426 -4.0374 -4.0374 -3.9730 -3.9730 -1.6507 -1.6507 -1.5658 -1.5658 -1.2921 -1.2921 -0.7877 -0.7877 0.0447 0.0447 0.1148 0.1148 0.1610 0.1610 0.1720 0.1720 3.2443 3.2443 3.3193 3.3193 3.7020 3.7020 3.7935 3.7935 3.9512 3.9512 4.2262 4.2262 4.4637 4.4637 4.4873 4.4873 5.3738 5.3738 5.3846 5.3846 11.7473 11.7473 11.9467 11.9467 12.0972 12.0972 13.3244 13.3244 13.4296 13.4296 13.7726 13.7726 k = 0.5000-0.2640-0.5921 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3001 -19.3001 -16.1872 -16.1872 -16.1862 -16.1862 -13.1539 -13.1539 -12.9557 -12.9557 -12.8961 -12.8961 -12.8709 -12.8709 -5.9420 -5.9420 -4.0332 -4.0332 -3.9755 -3.9755 -1.6273 -1.6273 -1.5501 -1.5501 -1.3215 -1.3215 -0.7993 -0.7993 0.0526 0.0526 0.1185 0.1185 0.1603 0.1603 0.1738 0.1738 3.2289 3.2289 3.3157 3.3157 3.7147 3.7147 3.7753 3.7753 3.9638 3.9638 4.2096 4.2096 4.4721 4.4721 4.4923 4.4923 5.3656 5.3656 5.3862 5.3862 11.7588 11.7588 11.9309 11.9309 12.1171 12.1171 13.2989 13.2989 13.4494 13.4494 13.7891 13.7891 k = 0.5000-0.2533-0.6085 ( 6130 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2998 -19.2998 -16.1870 -16.1870 -16.1862 -16.1862 -13.1565 -13.1565 -12.9552 -12.9552 -12.8977 -12.8977 -12.8688 -12.8688 -5.9415 -5.9415 -4.0294 -4.0294 -3.9778 -3.9778 -1.6054 -1.6054 -1.5429 -1.5429 -1.3417 -1.3417 -0.8089 -0.8089 0.0591 0.0591 0.1198 0.1198 0.1599 0.1599 0.1763 0.1763 3.2139 3.2139 3.3120 3.3120 3.7269 3.7269 3.7582 3.7582 3.9772 3.9772 4.1934 4.1934 4.4785 4.4785 4.4988 4.4988 5.3581 5.3581 5.3899 5.3899 11.7670 11.7670 11.9133 11.9133 12.1383 12.1383 13.2716 13.2716 13.4732 13.4732 13.7943 13.7943 k = 0.5000-0.2426-0.6249 ( 6128 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2996 -19.2996 -16.1870 -16.1870 -16.1861 -16.1861 -13.1587 -13.1587 -12.9544 -12.9544 -12.8996 -12.8996 -12.8667 -12.8667 -5.9411 -5.9411 -4.0261 -4.0261 -3.9799 -3.9799 -1.5856 -1.5856 -1.5491 -1.5491 -1.3476 -1.3476 -0.8161 -0.8161 0.0637 0.0637 0.1191 0.1191 0.1597 0.1597 0.1795 0.1795 3.1996 3.1996 3.3083 3.3083 3.7358 3.7358 3.7451 3.7451 3.9910 3.9910 4.1777 4.1777 4.4833 4.4833 4.5066 4.5066 5.3520 5.3520 5.3950 5.3950 11.7716 11.7716 11.8939 11.8939 12.1611 12.1611 13.2446 13.2446 13.4986 13.4986 13.7736 13.7736 k = 0.5000-0.2319-0.6412 ( 6130 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2995 -19.2995 -16.1870 -16.1870 -16.1861 -16.1861 -13.1605 -13.1605 -12.9533 -12.9533 -12.9016 -12.9016 -12.8645 -12.8645 -5.9407 -5.9407 -4.0235 -4.0235 -3.9816 -3.9816 -1.5737 -1.5737 -1.5645 -1.5645 -1.3382 -1.3382 -0.8205 -0.8205 0.0662 0.0662 0.1169 0.1169 0.1593 0.1593 0.1830 0.1830 3.1860 3.1860 3.3045 3.3045 3.7253 3.7253 3.7525 3.7525 4.0049 4.0049 4.1627 4.1627 4.4875 4.4875 4.5151 4.5151 5.3475 5.3475 5.4012 5.4012 11.7723 11.7723 11.8726 11.8726 12.1853 12.1853 13.2184 13.2184 13.5241 13.5241 13.7424 13.7424 k = 0.5000-0.2213-0.6576 ( 6136 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2995 -19.2995 -16.1871 -16.1871 -16.1861 -16.1861 -13.1620 -13.1620 -12.9519 -12.9519 -12.9037 -12.9037 -12.8623 -12.8623 -5.9405 -5.9405 -4.0216 -4.0216 -3.9830 -3.9830 -1.6028 -1.6028 -1.5526 -1.5526 -1.3176 -1.3176 -0.8214 -0.8214 0.0665 0.0665 0.1136 0.1136 0.1587 0.1587 0.1867 0.1867 3.1735 3.1735 3.3008 3.3008 3.7120 3.7120 3.7638 3.7638 4.0186 4.0186 4.1486 4.1486 4.4918 4.4918 4.5238 4.5238 5.3446 5.3446 5.4085 5.4085 11.7691 11.7691 11.8496 11.8496 12.2109 12.2109 13.1934 13.1934 13.5477 13.5477 13.7120 13.7120 k = 0.5000-0.2106-0.6739 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2995 -19.2995 -16.1875 -16.1875 -16.1860 -16.1860 -13.1629 -13.1629 -12.9501 -12.9501 -12.9060 -12.9060 -12.8601 -12.8601 -5.9404 -5.9404 -4.0205 -4.0205 -3.9839 -3.9839 -1.6408 -1.6408 -1.5419 -1.5419 -1.2900 -1.2900 -0.8187 -0.8187 0.0648 0.0648 0.1093 0.1093 0.1579 0.1579 0.1900 0.1900 3.1620 3.1620 3.2971 3.2971 3.7001 3.7001 3.7750 3.7750 4.0317 4.0317 4.1355 4.1355 4.4968 4.4968 4.5326 4.5326 5.3436 5.3436 5.4168 5.4168 11.7621 11.7621 11.8247 11.8247 12.2377 12.2377 13.1697 13.1697 13.5659 13.5659 13.6877 13.6877 k = 0.5000-0.1999-0.6903 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2997 -19.2997 -16.1881 -16.1881 -16.1856 -16.1856 -13.1634 -13.1634 -12.9479 -12.9479 -12.9083 -12.9083 -12.8579 -12.8579 -5.9404 -5.9404 -4.0203 -4.0203 -3.9843 -3.9843 -1.6826 -1.6826 -1.5349 -1.5349 -1.2582 -1.2582 -0.8121 -0.8121 0.0613 0.0613 0.1040 0.1040 0.1567 0.1567 0.1929 0.1929 3.1518 3.1518 3.2937 3.2937 3.6900 3.6900 3.7860 3.7860 4.0438 4.0438 4.1236 4.1236 4.5027 4.5027 4.5411 4.5411 5.3443 5.3443 5.4262 5.4262 11.7513 11.7513 11.7981 11.7981 12.2655 12.2655 13.1474 13.1474 13.5722 13.5722 13.6761 13.6761 k = 0.5000-0.1892-0.7067 ( 6138 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2999 -19.2999 -16.1890 -16.1890 -16.1852 -16.1852 -13.1633 -13.1633 -12.9455 -12.9455 -12.9107 -12.9107 -12.8557 -12.8557 -5.9405 -5.9405 -4.0209 -4.0209 -3.9843 -3.9843 -1.7267 -1.7267 -1.5321 -1.5321 -1.2236 -1.2236 -0.8014 -0.8014 0.0564 0.0564 0.0977 0.0977 0.1550 0.1550 0.1952 0.1952 3.1431 3.1431 3.2906 3.2906 3.6818 3.6818 3.7967 3.7967 4.0547 4.0547 4.1130 4.1130 4.5100 4.5100 4.5494 4.5494 5.3468 5.3468 5.4365 5.4365 11.7369 11.7369 11.7697 11.7697 12.2939 12.2939 13.1265 13.1265 13.5625 13.5625 13.6812 13.6812 k = 0.5000-0.1786-0.7230 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3003 -19.3003 -16.1901 -16.1901 -16.1845 -16.1845 -13.1626 -13.1626 -12.9427 -12.9427 -12.9132 -12.9132 -12.8535 -12.8535 -5.9408 -5.9408 -4.0223 -4.0223 -3.9840 -3.9840 -1.7722 -1.7722 -1.5334 -1.5334 -1.1873 -1.1873 -0.7868 -0.7868 0.0506 0.0506 0.0902 0.0902 0.1527 0.1527 0.1968 0.1968 3.1358 3.1358 3.2879 3.2879 3.6758 3.6758 3.8072 3.8072 4.0639 4.0639 4.1038 4.1038 4.5187 4.5187 4.5574 4.5574 5.3512 5.3512 5.4477 5.4477 11.7190 11.7190 11.7398 11.7398 12.3229 12.3229 13.1071 13.1071 13.5430 13.5430 13.6962 13.6962 k = 0.5000-0.1679-0.7394 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3008 -19.3008 -16.1915 -16.1915 -16.1838 -16.1838 -13.1614 -13.1614 -12.9396 -12.9396 -12.9156 -12.9156 -12.8513 -12.8513 -5.9411 -5.9411 -4.0242 -4.0242 -3.9835 -3.9835 -1.8187 -1.8187 -1.5388 -1.5388 -1.1498 -1.1498 -0.7685 -0.7685 0.0440 0.0440 0.0816 0.0816 0.1495 0.1495 0.1976 0.1976 3.1302 3.1302 3.2857 3.2857 3.6720 3.6720 3.8173 3.8173 4.0709 4.0709 4.0967 4.0967 4.5288 4.5288 4.5649 4.5649 5.3574 5.3574 5.4597 5.4597 11.6974 11.6974 11.7089 11.7089 12.3520 12.3520 13.0893 13.0893 13.5203 13.5203 13.7143 13.7143 k = 0.7870-0.0412-0.4513 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3008 -19.3008 -16.1915 -16.1915 -16.1838 -16.1838 -13.1614 -13.1614 -12.9396 -12.9396 -12.9156 -12.9156 -12.8513 -12.8513 -5.9411 -5.9411 -4.0242 -4.0242 -3.9835 -3.9835 -1.8187 -1.8187 -1.5388 -1.5388 -1.1498 -1.1498 -0.7685 -0.7685 0.0440 0.0440 0.0816 0.0816 0.1495 0.1495 0.1976 0.1976 3.1302 3.1302 3.2857 3.2857 3.6720 3.6720 3.8173 3.8173 4.0709 4.0709 4.0967 4.0967 4.5288 4.5288 4.5649 4.5649 5.3574 5.3574 5.4597 5.4597 11.6974 11.6974 11.7089 11.7089 12.3520 12.3520 13.0893 13.0893 13.5203 13.5203 13.7143 13.7143 k = 0.7793-0.0341-0.4353 ( 6136 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3014 -19.3014 -16.1932 -16.1932 -16.1829 -16.1829 -13.1596 -13.1596 -12.9364 -12.9364 -12.9180 -12.9180 -12.8492 -12.8492 -5.9416 -5.9416 -4.0264 -4.0264 -3.9831 -3.9831 -1.8651 -1.8651 -1.5479 -1.5479 -1.1121 -1.1121 -0.7472 -0.7472 0.0371 0.0371 0.0721 0.0721 0.1454 0.1454 0.1976 0.1976 3.1264 3.1264 3.2841 3.2841 3.6706 3.6706 3.8270 3.8270 4.0741 4.0741 4.0930 4.0930 4.5404 4.5404 4.5720 4.5720 5.3654 5.3654 5.4724 5.4724 11.6706 11.6706 11.6797 11.6797 12.3807 12.3807 13.0736 13.0736 13.4978 13.4978 13.7318 13.7318 k = 0.7715-0.0270-0.4192 ( 6144 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3021 -19.3021 -16.1950 -16.1950 -16.1819 -16.1819 -13.1571 -13.1571 -12.9330 -12.9330 -12.9202 -12.9202 -12.8471 -12.8471 -5.9421 -5.9421 -4.0289 -4.0289 -3.9827 -3.9827 -1.9118 -1.9118 -1.5605 -1.5605 -1.0739 -1.0739 -0.7232 -0.7232 0.0300 0.0300 0.0615 0.0615 0.1404 0.1404 0.1968 0.1968 3.1242 3.1242 3.2832 3.2832 3.6714 3.6714 3.8364 3.8364 4.0731 4.0731 4.0932 4.0932 4.5533 4.5533 4.5786 4.5786 5.3752 5.3752 5.4859 5.4859 11.6378 11.6378 11.6524 11.6524 12.4093 12.4093 13.0596 13.0596 13.4761 13.4761 13.7477 13.7477 k = 0.7638-0.0200-0.4031 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3029 -19.3029 -16.1972 -16.1972 -16.1808 -16.1808 -13.1541 -13.1541 -12.9299 -12.9299 -12.9219 -12.9219 -12.8450 -12.8450 -5.9428 -5.9428 -4.0317 -4.0317 -3.9826 -3.9826 -1.9587 -1.9587 -1.5763 -1.5763 -1.0357 -1.0357 -0.6967 -0.6967 0.0228 0.0228 0.0499 0.0499 0.1344 0.1344 0.1952 0.1952 3.1238 3.1238 3.2832 3.2832 3.6745 3.6745 3.8456 3.8456 4.0700 4.0700 4.0952 4.0952 4.5673 4.5673 4.5849 4.5849 5.3870 5.3870 5.5001 5.5001 11.6023 11.6023 11.6241 11.6241 12.4375 12.4375 13.0476 13.0476 13.4557 13.4557 13.7614 13.7614 k = 0.7560-0.0129-0.3870 ( 6138 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3038 -19.3038 -16.1995 -16.1995 -16.1795 -16.1795 -13.1504 -13.1504 -12.9282 -12.9282 -12.9218 -12.9218 -12.8430 -12.8430 -5.9436 -5.9436 -4.0346 -4.0346 -3.9826 -3.9826 -2.0056 -2.0056 -1.5948 -1.5948 -0.9975 -0.9975 -0.6684 -0.6684 0.0157 0.0157 0.0373 0.0373 0.1276 0.1276 0.1929 0.1929 3.1251 3.1251 3.2840 3.2840 3.6797 3.6797 3.8545 3.8545 4.0669 4.0669 4.0970 4.0970 4.5820 4.5820 4.5913 4.5913 5.4007 5.4007 5.5151 5.5151 11.5650 11.5650 11.5940 11.5940 12.4653 12.4653 13.0377 13.0377 13.4368 13.4368 13.7726 13.7726 k = 0.7483-0.0058-0.3709 ( 6142 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3048 -19.3048 -16.2021 -16.2021 -16.1781 -16.1781 -13.1462 -13.1462 -12.9290 -12.9290 -12.9189 -12.9189 -12.8411 -12.8411 -5.9445 -5.9445 -4.0376 -4.0376 -3.9830 -3.9830 -2.0523 -2.0523 -1.6159 -1.6159 -0.9597 -0.9597 -0.6386 -0.6386 0.0088 0.0088 0.0237 0.0237 0.1200 0.1200 0.1899 0.1899 3.1282 3.1282 3.2858 3.2858 3.6870 3.6870 3.8632 3.8632 4.0643 4.0643 4.0981 4.0981 4.5930 4.5930 4.6017 4.6017 5.4162 5.4162 5.5308 5.5308 11.5263 11.5263 11.5622 11.5622 12.4925 12.4925 13.0299 13.0299 13.4195 13.4195 13.7810 13.7810 k = 0.7405 0.0013-0.3548 ( 6144 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3060 -19.3060 -16.2049 -16.2049 -16.1765 -16.1765 -13.1413 -13.1413 -12.9307 -12.9307 -12.9149 -12.9149 -12.8392 -12.8392 -5.9455 -5.9455 -4.0406 -4.0406 -3.9837 -3.9837 -2.0989 -2.0989 -1.6392 -1.6392 -0.9224 -0.9224 -0.6077 -0.6077 0.0022 0.0022 0.0091 0.0091 0.1117 0.1117 0.1863 0.1863 3.1329 3.1329 3.2886 3.2886 3.6963 3.6963 3.8717 3.8717 4.0625 4.0625 4.0983 4.0983 4.5987 4.5987 4.6178 4.6178 5.4336 5.4336 5.5472 5.5472 11.4862 11.4862 11.5288 11.5288 12.5190 12.5190 13.0244 13.0244 13.4038 13.4038 13.7868 13.7868 k = 0.7327 0.0083-0.3387 ( 6146 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3072 -19.3072 -16.2080 -16.2080 -16.1749 -16.1749 -13.1359 -13.1359 -12.9325 -12.9325 -12.9105 -12.9105 -12.8373 -12.8373 -5.9467 -5.9467 -4.0437 -4.0437 -3.9847 -3.9847 -2.1450 -2.1450 -1.6645 -1.6645 -0.8859 -0.8859 -0.5761 -0.5761 -0.0070 -0.0070 -0.0034 -0.0034 0.1030 0.1030 0.1820 0.1820 3.1393 3.1393 3.2924 3.2924 3.7072 3.7072 3.8801 3.8801 4.0616 4.0616 4.0977 4.0977 4.6032 4.6032 4.6352 4.6352 5.4529 5.4529 5.5643 5.5643 11.4449 11.4449 11.4941 11.4941 12.5448 12.5448 13.0213 13.0213 13.3897 13.3897 13.7899 13.7899 k = 0.7250 0.0154-0.3226 ( 6150 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3086 -19.3086 -16.2113 -16.2113 -16.1731 -16.1731 -13.1298 -13.1298 -12.9343 -12.9343 -12.9058 -12.9058 -12.8356 -12.8356 -5.9479 -5.9479 -4.0469 -4.0469 -3.9860 -3.9860 -2.1906 -2.1906 -1.6914 -1.6914 -0.8505 -0.8505 -0.5440 -0.5440 -0.0233 -0.0233 -0.0093 -0.0093 0.0940 0.0940 0.1772 0.1772 3.1472 3.1472 3.2973 3.2973 3.7197 3.7197 3.8884 3.8884 4.0616 4.0616 4.0964 4.0964 4.6073 4.6073 4.6532 4.6532 5.4740 5.4740 5.5821 5.5821 11.4024 11.4024 11.4581 11.4581 12.5698 12.5698 13.0207 13.0207 13.3772 13.3772 13.7903 13.7903 k = 0.7172 0.0225-0.3065 ( 6156 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3100 -19.3100 -16.2147 -16.2147 -16.1712 -16.1712 -13.1233 -13.1233 -12.9359 -12.9359 -12.9011 -12.9011 -12.8339 -12.8339 -5.9491 -5.9491 -4.0499 -4.0499 -3.9876 -3.9876 -2.2355 -2.2355 -1.7200 -1.7200 -0.8162 -0.8162 -0.5118 -0.5118 -0.0406 -0.0406 -0.0143 -0.0143 0.0848 0.0848 0.1719 0.1719 3.1566 3.1566 3.3031 3.3031 3.7334 3.7334 3.8966 3.8966 4.0625 4.0625 4.0945 4.0945 4.6112 4.6112 4.6714 4.6714 5.4968 5.4968 5.6005 5.6005 11.3589 11.3589 11.4211 11.4211 12.5938 12.5938 13.0227 13.0227 13.3663 13.3663 13.7883 13.7883 k = 0.7095 0.0296-0.2904 ( 6164 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3116 -19.3116 -16.2184 -16.2184 -16.1692 -16.1692 -13.1162 -13.1162 -12.9373 -12.9373 -12.8963 -12.8963 -12.8322 -12.8322 -5.9505 -5.9505 -4.0530 -4.0530 -3.9896 -3.9896 -2.2796 -2.2796 -1.7498 -1.7498 -0.7833 -0.7833 -0.4797 -0.4797 -0.0588 -0.0588 -0.0187 -0.0187 0.0756 0.0756 0.1662 0.1662 3.1674 3.1674 3.3099 3.3099 3.7480 3.7480 3.9049 3.9049 4.0643 4.0643 4.0921 4.0921 4.6152 4.6152 4.6896 4.6896 5.5212 5.5212 5.6194 5.6194 11.3144 11.3144 11.3833 11.3833 12.6170 12.6170 13.0272 13.0272 13.3569 13.3569 13.7839 13.7839 k = 0.7017 0.0367-0.2743 ( 6162 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3132 -19.3132 -16.2221 -16.2221 -16.1671 -16.1671 -13.1086 -13.1086 -12.9385 -12.9385 -12.8914 -12.8914 -12.8307 -12.8307 -5.9520 -5.9520 -4.0560 -4.0560 -3.9920 -3.9920 -2.3228 -2.3228 -1.7808 -1.7808 -0.7518 -0.7518 -0.4480 -0.4480 -0.0776 -0.0776 -0.0223 -0.0223 0.0665 0.0665 0.1603 0.1603 3.1794 3.1794 3.3176 3.3176 3.7632 3.7632 3.9133 3.9133 4.0671 4.0671 4.0893 4.0893 4.6193 4.6193 4.7076 4.7076 5.5471 5.5471 5.6389 5.6389 11.2692 11.2692 11.3449 11.3449 12.6392 12.6392 13.0343 13.0343 13.3491 13.3491 13.7772 13.7772 k = 0.6939 0.0437-0.2583 ( 6158 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3149 -19.3149 -16.2261 -16.2261 -16.1650 -16.1650 -13.1006 -13.1006 -12.9396 -12.9396 -12.8865 -12.8865 -12.8292 -12.8292 -5.9535 -5.9535 -4.0590 -4.0590 -3.9947 -3.9947 -2.3650 -2.3650 -1.8128 -1.8128 -0.7220 -0.7220 -0.4167 -0.4167 -0.0970 -0.0970 -0.0251 -0.0251 0.0576 0.0576 0.1540 0.1540 3.1926 3.1926 3.3261 3.3261 3.7786 3.7786 3.9218 3.9218 4.0707 4.0707 4.0862 4.0862 4.6238 4.6238 4.7254 4.7254 5.5745 5.5745 5.6589 5.6589 11.2232 11.2232 11.3061 11.3061 12.6603 12.6603 13.0439 13.0439 13.3428 13.3428 13.7684 13.7684 k = 0.6862 0.0508-0.2422 ( 6162 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3166 -19.3166 -16.2301 -16.2301 -16.1627 -16.1627 -13.0922 -13.0922 -12.9404 -12.9404 -12.8816 -12.8816 -12.8279 -12.8279 -5.9550 -5.9550 -4.0619 -4.0619 -3.9977 -3.9977 -2.4060 -2.4060 -1.8457 -1.8457 -0.6939 -0.6939 -0.3861 -0.3861 -0.1169 -0.1169 -0.0272 -0.0272 0.0489 0.0489 0.1476 0.1476 3.2066 3.2066 3.3352 3.3352 3.7940 3.7940 3.9305 3.9305 4.0753 4.0753 4.0829 4.0829 4.6290 4.6290 4.7427 4.7427 5.6031 5.6031 5.6793 5.6793 11.1768 11.1768 11.2670 11.2670 12.6804 12.6804 13.0561 13.0561 13.3380 13.3380 13.7575 13.7575 k = 0.6784 0.0579-0.2261 ( 6154 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3184 -19.3184 -16.2343 -16.2343 -16.1604 -16.1604 -13.0835 -13.0835 -12.9410 -12.9410 -12.8768 -12.8768 -12.8266 -12.8266 -5.9567 -5.9567 -4.0647 -4.0647 -4.0011 -4.0011 -2.4457 -2.4457 -1.8792 -1.8792 -0.6676 -0.6676 -0.3563 -0.3563 -0.1369 -0.1369 -0.0286 -0.0286 0.0407 0.0407 0.1410 0.1410 3.2215 3.2215 3.3450 3.3450 3.8090 3.8090 3.9393 3.9393 4.0790 4.0790 4.0811 4.0811 4.6350 4.6350 4.7596 4.7596 5.6328 5.6328 5.7002 5.7002 11.1299 11.1299 11.2278 11.2278 12.6995 12.6995 13.0705 13.0705 13.3348 13.3348 13.7448 13.7448 k = 0.6707 0.0650-0.2100 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3203 -19.3203 -16.2385 -16.2385 -16.1581 -16.1581 -13.0745 -13.0745 -12.9414 -12.9414 -12.8721 -12.8721 -12.8254 -12.8254 -5.9583 -5.9583 -4.0674 -4.0674 -4.0048 -4.0048 -2.4840 -2.4840 -1.9132 -1.9132 -0.6432 -0.6432 -0.3276 -0.3276 -0.1568 -0.1568 -0.0292 -0.0292 0.0328 0.0328 0.1344 0.1344 3.2370 3.2370 3.3551 3.3551 3.8233 3.8233 3.9482 3.9482 4.0757 4.0757 4.0873 4.0873 4.6420 4.6420 4.7760 4.7760 5.6635 5.6635 5.7212 5.7212 11.0829 11.0829 11.1887 11.1887 12.7176 12.7176 13.0872 13.0872 13.3332 13.3332 13.7304 13.7304 k = 0.6629 0.0720-0.1939 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3222 -19.3222 -16.2427 -16.2427 -16.1557 -16.1557 -13.0652 -13.0652 -12.9416 -12.9416 -12.8675 -12.8675 -12.8243 -12.8243 -5.9600 -5.9600 -4.0699 -4.0699 -4.0088 -4.0088 -2.5208 -2.5208 -1.9476 -1.9476 -0.6206 -0.6206 -0.3004 -0.3004 -0.1763 -0.1763 -0.0292 -0.0292 0.0255 0.0255 0.1277 0.1277 3.2530 3.2530 3.3656 3.3656 3.8367 3.8367 3.9571 3.9571 4.0722 4.0722 4.0944 4.0944 4.6504 4.6504 4.7917 4.7917 5.6950 5.6950 5.7426 5.7426 11.0359 11.0359 11.1499 11.1499 12.7345 12.7345 13.1058 13.1058 13.3332 13.3332 13.7144 13.7144 k = 0.6552 0.0791-0.1778 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3241 -19.3241 -16.2470 -16.2470 -16.1533 -16.1533 -13.0558 -13.0558 -12.9416 -12.9416 -12.8630 -12.8630 -12.8233 -12.8233 -5.9617 -5.9617 -4.0724 -4.0724 -4.0131 -4.0131 -2.5559 -2.5559 -1.9821 -1.9821 -0.5999 -0.5999 -0.2753 -0.2753 -0.1946 -0.1946 -0.0287 -0.0287 0.0186 0.0186 0.1211 0.1211 3.2693 3.2693 3.3762 3.3762 3.8491 3.8491 3.9660 3.9660 4.0689 4.0689 4.1021 4.1021 4.6601 4.6601 4.8067 4.8067 5.7270 5.7270 5.7640 5.7640 10.9891 10.9891 11.1115 11.1115 12.7503 12.7503 13.1261 13.1261 13.3349 13.3349 13.6971 13.6971 k = 0.6474 0.0862-0.1617 ( 6154 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3260 -19.3260 -16.2513 -16.2513 -16.1509 -16.1509 -13.0462 -13.0462 -12.9413 -12.9413 -12.8587 -12.8587 -12.8224 -12.8224 -5.9635 -5.9635 -4.0747 -4.0747 -4.0178 -4.0178 -2.5894 -2.5894 -2.0167 -2.0167 -0.5810 -0.5810 -0.2558 -0.2558 -0.2082 -0.2082 -0.0276 -0.0276 0.0124 0.0124 0.1146 0.1146 3.2858 3.2858 3.3868 3.3868 3.8602 3.8602 3.9745 3.9745 4.0661 4.0661 4.1103 4.1103 4.6715 4.6715 4.8210 4.8210 5.7594 5.7594 5.7854 5.7854 10.9427 10.9427 11.0737 11.0737 12.7651 12.7651 13.1477 13.1477 13.3386 13.3386 13.6786 13.6786 k = 0.6396 0.0933-0.1456 ( 6154 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3279 -19.3279 -16.2555 -16.2555 -16.1485 -16.1485 -13.0366 -13.0366 -12.9409 -12.9409 -12.8546 -12.8546 -12.8216 -12.8216 -5.9652 -5.9652 -4.0769 -4.0769 -4.0226 -4.0226 -2.6211 -2.6211 -2.0511 -2.0511 -0.5637 -0.5637 -0.2531 -0.2531 -0.2059 -0.2059 -0.0263 -0.0263 0.0068 0.0068 0.1082 0.1082 3.3023 3.3023 3.3974 3.3974 3.8702 3.8702 3.9825 3.9825 4.0640 4.0640 4.1187 4.1187 4.6844 4.6844 4.8345 4.8345 5.7919 5.7919 5.8068 5.8068 10.8969 10.8969 11.0367 11.0367 12.7787 12.7787 13.1700 13.1700 13.3443 13.3443 13.6592 13.6592 k = 0.6319 0.1004-0.1295 ( 6160 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3298 -19.3298 -16.2597 -16.2597 -16.1462 -16.1462 -13.0269 -13.0269 -12.9402 -12.9402 -12.8507 -12.8507 -12.8209 -12.8209 -5.9669 -5.9669 -4.0789 -4.0789 -4.0277 -4.0277 -2.6509 -2.6509 -2.0852 -2.0852 -0.5481 -0.5481 -0.2660 -0.2660 -0.1888 -0.1888 -0.0250 -0.0250 0.0021 0.0021 0.1020 0.1020 3.3187 3.3187 3.4077 3.4077 3.8789 3.8789 3.9894 3.9894 4.0631 4.0631 4.1271 4.1271 4.6989 4.6989 4.8473 4.8473 5.8241 5.8241 5.8284 5.8284 10.8519 10.8519 11.0007 11.0007 12.7913 12.7913 13.1925 13.1925 13.3526 13.3526 13.6390 13.6390 k = 0.6241 0.1074-0.1134 ( 6164 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3317 -19.3317 -16.2638 -16.2638 -16.1438 -16.1438 -13.0174 -13.0174 -12.9394 -12.9394 -12.8470 -12.8470 -12.8203 -12.8203 -5.9686 -5.9686 -4.0808 -4.0808 -4.0329 -4.0329 -2.6789 -2.6789 -2.1187 -2.1187 -0.5340 -0.5340 -0.2825 -0.2825 -0.1690 -0.1690 -0.0239 -0.0239 -0.0015 -0.0015 0.0960 0.0960 3.3349 3.3349 3.4177 3.4177 3.8865 3.8865 3.9948 3.9948 4.0642 4.0642 4.1352 4.1352 4.7149 4.7149 4.8593 4.8593 5.8485 5.8485 5.8572 5.8572 10.8079 10.8079 10.9657 10.9657 12.8027 12.8027 13.2142 13.2142 13.3638 13.3638 13.6184 13.6184 k = 0.6164 0.1145-0.0973 ( 6172 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3335 -19.3335 -16.2678 -16.2678 -16.1416 -16.1416 -13.0080 -13.0080 -12.9384 -12.9384 -12.8435 -12.8435 -12.8198 -12.8198 -5.9703 -5.9703 -4.0826 -4.0826 -4.0382 -4.0382 -2.7049 -2.7049 -2.1515 -2.1515 -0.5213 -0.5213 -0.2995 -0.2995 -0.1495 -0.1495 -0.0233 -0.0233 -0.0038 -0.0038 0.0904 0.0904 3.3508 3.3508 3.4273 3.4273 3.8929 3.8929 3.9981 3.9981 4.0676 4.0676 4.1428 4.1428 4.7323 4.7323 4.8704 4.8704 5.8691 5.8691 5.8890 5.8890 10.7653 10.7653 10.9319 10.9319 12.8131 12.8131 13.2344 13.2344 13.3784 13.3784 13.5976 13.5976 k = 0.6086 0.1216-0.0813 ( 6168 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3353 -19.3353 -16.2717 -16.2717 -16.1394 -16.1394 -12.9987 -12.9987 -12.9373 -12.9373 -12.8403 -12.8403 -12.8194 -12.8194 -5.9719 -5.9719 -4.0843 -4.0843 -4.0435 -4.0435 -2.7290 -2.7290 -2.1834 -2.1834 -0.5099 -0.5099 -0.3161 -0.3161 -0.1314 -0.1314 -0.0235 -0.0235 -0.0045 -0.0045 0.0851 0.0851 3.3663 3.3663 3.4363 3.4363 3.8984 3.8984 3.9992 3.9992 4.0736 4.0736 4.1498 4.1498 4.7508 4.7508 4.8808 4.8808 5.8891 5.8891 5.9202 5.9202 10.7241 10.7241 10.8996 10.8996 12.8225 12.8225 13.2524 13.2524 13.3967 13.3967 13.5768 13.5768 k = 0.6009 0.1287-0.0652 ( 6170 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3370 -19.3370 -16.2754 -16.2754 -16.1373 -16.1373 -12.9897 -12.9897 -12.9361 -12.9361 -12.8373 -12.8373 -12.8191 -12.8191 -5.9735 -5.9735 -4.0860 -4.0860 -4.0487 -4.0487 -2.7512 -2.7512 -2.2141 -2.2141 -0.4995 -0.4995 -0.3320 -0.3320 -0.1151 -0.1151 -0.0243 -0.0243 -0.0038 -0.0038 0.0803 0.0803 3.3812 3.3812 3.4448 3.4448 3.9029 3.9029 3.9984 3.9984 4.0818 4.0818 4.1562 4.1562 4.7701 4.7701 4.8904 4.8904 5.9085 5.9085 5.9505 5.9505 10.6846 10.6846 10.8688 10.8688 12.8308 12.8308 13.2676 13.2676 13.4186 13.4186 13.5566 13.5566 k = 0.5931 0.1357-0.0491 ( 6168 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3386 -19.3386 -16.2789 -16.2789 -16.1353 -16.1353 -12.9811 -12.9811 -12.9348 -12.9348 -12.8345 -12.8345 -12.8189 -12.8189 -5.9750 -5.9750 -4.0877 -4.0877 -4.0537 -4.0537 -2.7714 -2.7714 -2.2436 -2.2436 -0.4903 -0.4903 -0.3471 -0.3471 -0.1009 -0.1009 -0.0251 -0.0251 -0.0021 -0.0021 0.0760 0.0760 3.3956 3.3956 3.4525 3.4525 3.9066 3.9066 3.9962 3.9962 4.0914 4.0914 4.1618 4.1618 4.7898 4.7898 4.8993 4.8993 5.9270 5.9270 5.9798 5.9798 10.6470 10.6470 10.8396 10.8396 12.8381 12.8381 13.2803 13.2803 13.4433 13.4433 13.5372 13.5372 k = 0.5853 0.1428-0.0330 ( 6160 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3402 -19.3402 -16.2822 -16.2822 -16.1334 -16.1334 -12.9728 -12.9728 -12.9335 -12.9335 -12.8321 -12.8321 -12.8187 -12.8187 -5.9764 -5.9764 -4.0895 -4.0895 -4.0584 -4.0584 -2.7897 -2.7897 -2.2716 -2.2716 -0.4819 -0.4819 -0.3612 -0.3612 -0.0892 -0.0892 -0.0255 -0.0255 0.0003 0.0003 0.0723 0.0723 3.4094 3.4094 3.4596 3.4596 3.9096 3.9096 3.9932 3.9932 4.1020 4.1020 4.1666 4.1666 4.8095 4.8095 4.9074 4.9074 5.9447 5.9447 6.0077 6.0077 10.6116 10.6116 10.8123 10.8123 12.8445 12.8445 13.2906 13.2906 13.4695 13.4695 13.5196 13.5196 k = 0.5776 0.1499-0.0169 ( 6154 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3416 -19.3416 -16.2854 -16.2854 -16.1316 -16.1316 -12.9649 -12.9649 -12.9321 -12.9321 -12.8298 -12.8298 -12.8187 -12.8187 -5.9778 -5.9778 -4.0915 -4.0915 -4.0626 -4.0626 -2.8061 -2.8061 -2.2980 -2.2980 -0.4745 -0.4745 -0.3743 -0.3743 -0.0803 -0.0803 -0.0252 -0.0252 0.0032 0.0032 0.0694 0.0694 3.4224 3.4224 3.4659 3.4659 3.9120 3.9120 3.9898 3.9898 4.1129 4.1129 4.1709 4.1709 4.8290 4.8290 4.9148 4.9148 5.9613 5.9613 6.0341 6.0341 10.5785 10.5785 10.7868 10.7868 12.8500 12.8500 13.2988 13.2988 13.4891 13.4891 13.5112 13.5112 k = 0.5698 0.1570-0.0008 ( 6142 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3430 -19.3430 -16.2882 -16.2882 -16.1299 -16.1299 -12.9576 -12.9576 -12.9307 -12.9307 -12.8278 -12.8278 -12.8187 -12.8187 -5.9790 -5.9790 -4.0937 -4.0937 -4.0661 -4.0661 -2.8207 -2.8207 -2.3224 -2.3224 -0.4678 -0.4678 -0.3862 -0.3862 -0.0740 -0.0740 -0.0244 -0.0244 0.0065 0.0065 0.0672 0.0672 3.4346 3.4346 3.4715 3.4715 3.9138 3.9138 3.9864 3.9864 4.1238 4.1238 4.1745 4.1745 4.8477 4.8477 4.9216 4.9216 5.9768 5.9768 6.0587 6.0587 10.5479 10.5479 10.7635 10.7635 12.8546 12.8546 13.3053 13.3053 13.4812 13.4812 13.5325 13.5325 k = 0.5621 0.1640 0.0153 ( 6142 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3442 -19.3442 -16.2908 -16.2908 -16.1284 -16.1284 -12.9508 -12.9508 -12.9293 -12.9293 -12.8261 -12.8261 -12.8188 -12.8188 -5.9802 -5.9802 -4.0962 -4.0962 -4.0690 -4.0690 -2.8335 -2.8335 -2.3449 -2.3449 -0.4619 -0.4619 -0.3970 -0.3970 -0.0700 -0.0700 -0.0234 -0.0234 0.0101 0.0101 0.0659 0.0659 3.4459 3.4459 3.4763 3.4763 3.9150 3.9150 3.9831 3.9831 4.1342 4.1342 4.1776 4.1776 4.8652 4.8652 4.9278 4.9278 5.9910 5.9910 6.0813 6.0813 10.5200 10.5200 10.7422 10.7422 12.8585 12.8585 13.3100 13.3100 13.4685 13.4685 13.5602 13.5602 k = 0.5543 0.1711 0.0314 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3453 -19.3453 -16.2932 -16.2932 -16.1271 -16.1271 -12.9447 -12.9447 -12.9281 -12.9281 -12.8246 -12.8246 -12.8189 -12.8189 -5.9812 -5.9812 -4.0988 -4.0988 -4.0713 -4.0713 -2.8447 -2.8447 -2.3652 -2.3652 -0.4568 -0.4568 -0.4066 -0.4066 -0.0678 -0.0678 -0.0224 -0.0224 0.0136 0.0136 0.0655 0.0655 3.4563 3.4563 3.4804 3.4804 3.9157 3.9157 3.9801 3.9801 4.1438 4.1438 4.1804 4.1804 4.8812 4.8812 4.9335 4.9335 6.0039 6.0039 6.1018 6.1018 10.4950 10.4950 10.7232 10.7232 12.8616 12.8616 13.3131 13.3131 13.4572 13.4572 13.5875 13.5875 k = 0.5465 0.1782 0.0475 ( 6130 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3463 -19.3463 -16.2953 -16.2953 -16.1259 -16.1259 -12.9392 -12.9392 -12.9269 -12.9269 -12.8234 -12.8234 -12.8191 -12.8191 -5.9821 -5.9821 -4.1015 -4.1015 -4.0729 -4.0729 -2.8542 -2.8542 -2.3831 -2.3831 -0.4524 -0.4524 -0.4149 -0.4149 -0.0667 -0.0667 -0.0218 -0.0218 0.0168 0.0168 0.0659 0.0659 3.4655 3.4655 3.4839 3.4839 3.9159 3.9159 3.9775 3.9775 4.1523 4.1523 4.1829 4.1829 4.8952 4.8952 4.9389 4.9389 6.0153 6.0153 6.1199 6.1199 10.4730 10.4730 10.7066 10.7066 12.8641 12.8641 13.3147 13.3147 13.4481 13.4481 13.6132 13.6132 k = 0.5388 0.1853 0.0636 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3471 -19.3471 -16.2970 -16.2970 -16.1249 -16.1249 -12.9345 -12.9345 -12.9258 -12.9258 -12.8223 -12.8223 -12.8192 -12.8192 -5.9829 -5.9829 -4.1041 -4.1041 -4.0741 -4.0741 -2.8620 -2.8620 -2.3985 -2.3985 -0.4487 -0.4487 -0.4219 -0.4219 -0.0662 -0.0662 -0.0215 -0.0215 0.0195 0.0195 0.0669 0.0669 3.4735 3.4735 3.4867 3.4867 3.9158 3.9158 3.9755 3.9755 4.1594 4.1594 4.1854 4.1854 4.9069 4.9069 4.9440 4.9440 6.0251 6.0251 6.1356 6.1356 10.4541 10.4541 10.6923 10.6923 12.8661 12.8661 13.3150 13.3150 13.4411 13.4411 13.6365 13.6365 k = 0.5310 0.1924 0.0796 ( 6136 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3478 -19.3478 -16.2985 -16.2985 -16.1240 -16.1240 -12.9305 -12.9305 -12.9249 -12.9249 -12.8215 -12.8215 -12.8194 -12.8194 -5.9836 -5.9836 -4.1064 -4.1064 -4.0749 -4.0749 -2.8684 -2.8684 -2.4113 -2.4113 -0.4460 -0.4460 -0.4274 -0.4274 -0.0661 -0.0661 -0.0215 -0.0215 0.0216 0.0216 0.0684 0.0684 3.4802 3.4802 3.4889 3.4889 3.9154 3.9154 3.9739 3.9739 4.1649 4.1649 4.1879 4.1879 4.9161 4.9161 4.9489 4.9489 6.0332 6.0332 6.1486 6.1486 10.4385 10.4385 10.6806 10.6806 12.8676 12.8676 13.3143 13.3143 13.4361 13.4361 13.6567 13.6567 k = 0.5233 0.1994 0.0957 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3483 -19.3483 -16.2997 -16.2997 -16.1234 -16.1234 -12.9274 -12.9274 -12.9242 -12.9242 -12.8209 -12.8209 -12.8195 -12.8195 -5.9841 -5.9841 -4.1083 -4.1083 -4.0754 -4.0754 -2.8733 -2.8733 -2.4214 -2.4214 -0.4442 -0.4442 -0.4313 -0.4313 -0.0662 -0.0662 -0.0217 -0.0217 0.0230 0.0230 0.0699 0.0699 3.4856 3.4856 3.4906 3.4906 3.9149 3.9149 3.9728 3.9728 4.1689 4.1689 4.1903 4.1903 4.9227 4.9227 4.9534 4.9534 6.0396 6.0396 6.1588 6.1588 10.4263 10.4263 10.6714 10.6714 12.8686 12.8686 13.3132 13.3132 13.4327 13.4327 13.6732 13.6732 k = 0.5155 0.2065 0.1118 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3487 -19.3487 -16.3005 -16.3005 -16.1229 -16.1229 -12.9252 -12.9252 -12.9236 -12.9236 -12.8206 -12.8206 -12.8195 -12.8195 -5.9845 -5.9845 -4.1098 -4.1098 -4.0757 -4.0757 -2.8768 -2.8768 -2.4286 -2.4286 -0.4434 -0.4434 -0.4336 -0.4336 -0.0663 -0.0663 -0.0219 -0.0219 0.0240 0.0240 0.0712 0.0712 3.4895 3.4895 3.4917 3.4917 3.9144 3.9144 3.9721 3.9721 4.1714 4.1714 4.1923 4.1923 4.9271 4.9271 4.9572 4.9572 6.0442 6.0442 6.1662 6.1662 10.4175 10.4175 10.6648 10.6648 12.8693 12.8693 13.3121 13.3121 13.4307 13.4307 13.6854 13.6854 k = 0.5078 0.2136 0.1279 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3490 -19.3490 -16.3010 -16.3010 -16.1226 -16.1226 -12.9240 -12.9240 -12.9231 -12.9231 -12.8205 -12.8205 -12.8195 -12.8195 -5.9847 -5.9847 -4.1106 -4.1106 -4.0759 -4.0759 -2.8788 -2.8788 -2.4330 -2.4330 -0.4435 -0.4435 -0.4345 -0.4345 -0.0663 -0.0663 -0.0220 -0.0220 0.0245 0.0245 0.0721 0.0721 3.4919 3.4919 3.4925 3.4925 3.9141 3.9141 3.9717 3.9717 4.1728 4.1728 4.1937 4.1937 4.9295 4.9295 4.9596 4.9596 6.0470 6.0470 6.1707 6.1707 10.4122 10.4122 10.6608 10.6608 12.8698 12.8698 13.3112 13.3112 13.4296 13.4296 13.6929 13.6929 k = 0.5000 0.2207 0.1440 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3491 -19.3491 -16.3011 -16.3011 -16.1225 -16.1225 -12.9237 -12.9237 -12.9229 -12.9229 -12.8204 -12.8204 -12.8195 -12.8195 -5.9848 -5.9848 -4.1109 -4.1109 -4.0760 -4.0760 -2.8795 -2.8795 -2.4345 -2.4345 -0.4436 -0.4436 -0.4347 -0.4347 -0.0664 -0.0664 -0.0221 -0.0221 0.0246 0.0246 0.0724 0.0724 3.4926 3.4926 3.4927 3.4927 3.9139 3.9139 3.9716 3.9716 4.1732 4.1732 4.1942 4.1942 4.9302 4.9302 4.9604 4.9604 6.0479 6.0479 6.1722 6.1722 10.4104 10.4104 10.6595 10.6595 12.8699 12.8699 13.3109 13.3109 13.4292 13.4292 13.6954 13.6954 k = 0.5000 0.2207 0.1440 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3491 -19.3491 -16.3011 -16.3011 -16.1225 -16.1225 -12.9237 -12.9237 -12.9229 -12.9229 -12.8204 -12.8204 -12.8195 -12.8195 -5.9848 -5.9848 -4.1109 -4.1109 -4.0760 -4.0760 -2.8795 -2.8795 -2.4345 -2.4345 -0.4436 -0.4436 -0.4347 -0.4347 -0.0664 -0.0664 -0.0221 -0.0221 0.0246 0.0246 0.0724 0.0724 3.4926 3.4926 3.4927 3.4927 3.9139 3.9139 3.9716 3.9716 4.1732 4.1732 4.1942 4.1942 4.9302 4.9302 4.9604 4.9604 6.0479 6.0479 6.1722 6.1722 10.4104 10.4104 10.6595 10.6595 12.8699 12.8699 13.3109 13.3109 13.4292 13.4292 13.6954 13.6954 k = 0.4828 0.2131 0.1390 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3491 -19.3491 -16.3011 -16.3011 -16.1225 -16.1225 -12.9236 -12.9236 -12.9228 -12.9228 -12.8205 -12.8205 -12.8195 -12.8195 -5.9848 -5.9848 -4.1109 -4.1109 -4.0760 -4.0760 -2.8799 -2.8799 -2.4339 -2.4339 -0.4433 -0.4433 -0.4344 -0.4344 -0.0878 -0.0878 -0.0062 -0.0062 0.0296 0.0296 0.0720 0.0720 3.4934 3.4934 3.4935 3.4935 3.9118 3.9118 3.9687 3.9687 4.1757 4.1757 4.1974 4.1974 4.9292 4.9292 4.9594 4.9594 6.0474 6.0474 6.1727 6.1727 10.4117 10.4117 10.6618 10.6618 12.8664 12.8664 13.3116 13.3116 13.4299 13.4299 13.6635 13.6635 k = 0.4655 0.2054 0.1341 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3491 -19.3491 -16.3008 -16.3008 -16.1227 -16.1227 -12.9234 -12.9234 -12.9226 -12.9226 -12.8207 -12.8207 -12.8197 -12.8197 -5.9849 -5.9849 -4.1109 -4.1109 -4.0761 -4.0761 -2.8812 -2.8812 -2.4320 -2.4320 -0.4422 -0.4422 -0.4335 -0.4335 -0.1236 -0.1236 0.0057 0.0057 0.0517 0.0517 0.0708 0.0708 3.4957 3.4957 3.4959 3.4959 3.9055 3.9055 3.9604 3.9604 4.1828 4.1828 4.2065 4.2065 4.9259 4.9259 4.9561 4.9561 6.0460 6.0460 6.1742 6.1742 10.4156 10.4156 10.6687 10.6687 12.8557 12.8557 13.3137 13.3137 13.4320 13.4320 13.5878 13.5878 k = 0.4483 0.1978 0.1291 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3492 -19.3492 -16.3004 -16.3004 -16.1228 -16.1228 -12.9231 -12.9231 -12.9224 -12.9224 -12.8210 -12.8210 -12.8200 -12.8200 -5.9851 -5.9851 -4.1109 -4.1109 -4.0762 -4.0762 -2.8833 -2.8833 -2.4290 -2.4290 -0.4405 -0.4405 -0.4320 -0.4320 -0.1616 -0.1616 0.0073 0.0073 0.0687 0.0687 0.0852 0.0852 3.4996 3.4996 3.4998 3.4998 3.8959 3.8959 3.9481 3.9481 4.1939 4.1939 4.2203 4.2203 4.9206 4.9206 4.9507 4.9507 6.0438 6.0438 6.1765 6.1765 10.4220 10.4220 10.6801 10.6801 12.8374 12.8374 13.3170 13.3170 13.4355 13.4355 13.4954 13.4954 k = 0.4310 0.1902 0.1241 ( 6128 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3494 -19.3494 -16.2999 -16.2999 -16.1231 -16.1231 -12.9227 -12.9227 -12.9219 -12.9219 -12.8214 -12.8214 -12.8204 -12.8204 -5.9853 -5.9853 -4.1108 -4.1108 -4.0764 -4.0764 -2.8860 -2.8860 -2.4248 -2.4248 -0.4382 -0.4382 -0.4300 -0.4300 -0.2003 -0.2003 0.0058 0.0058 0.0658 0.0658 0.1214 0.1214 3.5051 3.5051 3.5054 3.5054 3.8838 3.8838 3.9329 3.9329 4.2081 4.2081 4.2376 4.2376 4.9132 4.9132 4.9432 4.9432 6.0408 6.0408 6.1796 6.1796 10.4311 10.4311 10.6960 10.6960 12.8109 12.8109 13.3217 13.3217 13.3999 13.3999 13.4404 13.4404 k = 0.4138 0.1826 0.1192 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3495 -19.3495 -16.2992 -16.2992 -16.1234 -16.1234 -12.9222 -12.9222 -12.9214 -12.9214 -12.8219 -12.8219 -12.8209 -12.8209 -5.9856 -5.9856 -4.1108 -4.1108 -4.0767 -4.0767 -2.8895 -2.8895 -2.4197 -2.4197 -0.4351 -0.4351 -0.4274 -0.4274 -0.2392 -0.2392 0.0029 0.0029 0.0621 0.0621 0.1580 0.1580 3.5119 3.5119 3.5123 3.5123 3.8700 3.8700 3.9160 3.9160 4.2246 4.2246 4.2571 4.2571 4.9037 4.9037 4.9336 4.9336 6.0372 6.0372 6.1833 6.1833 10.4426 10.4426 10.7162 10.7162 12.7752 12.7752 13.3076 13.3076 13.3277 13.3277 13.4465 13.4465 k = 0.3966 0.1750 0.1142 ( 6152 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3497 -19.3497 -16.2984 -16.2984 -16.1238 -16.1238 -12.9216 -12.9216 -12.9208 -12.9208 -12.8225 -12.8225 -12.8215 -12.8215 -5.9860 -5.9860 -4.1107 -4.1107 -4.0770 -4.0770 -2.8935 -2.8935 -2.4136 -2.4136 -0.4315 -0.4315 -0.4242 -0.4242 -0.2780 -0.2780 -0.0009 -0.0009 0.0577 0.0577 0.1943 0.1943 3.5201 3.5201 3.5206 3.5206 3.8552 3.8552 3.8984 3.8984 4.2427 4.2427 4.2782 4.2782 4.8921 4.8921 4.9220 4.9220 6.0330 6.0330 6.1876 6.1876 10.4565 10.4565 10.7405 10.7405 12.7294 12.7294 13.2222 13.2222 13.3349 13.3349 13.4539 13.4539 k = 0.3793 0.1674 0.1093 ( 6152 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3499 -19.3499 -16.2974 -16.2974 -16.1243 -16.1243 -12.9209 -12.9209 -12.9201 -12.9201 -12.8232 -12.8232 -12.8223 -12.8223 -5.9864 -5.9864 -4.1106 -4.1106 -4.0773 -4.0773 -2.8980 -2.8980 -2.4067 -2.4067 -0.4271 -0.4271 -0.4205 -0.4205 -0.3164 -0.3164 -0.0056 -0.0056 0.0525 0.0525 0.2301 0.2301 3.5295 3.5295 3.5302 3.5302 3.8402 3.8402 3.8806 3.8806 4.2620 4.2620 4.3001 4.3001 4.8786 4.8786 4.9084 4.9084 6.0286 6.0286 6.1922 6.1922 10.4729 10.4729 10.7686 10.7686 12.6732 12.6732 13.1455 13.1455 13.3432 13.3432 13.4625 13.4625 k = 0.3621 0.1598 0.1043 ( 6158 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3502 -19.3502 -16.2963 -16.2963 -16.1248 -16.1248 -12.9200 -12.9200 -12.9193 -12.9193 -12.8241 -12.8241 -12.8231 -12.8231 -5.9869 -5.9869 -4.1105 -4.1105 -4.0777 -4.0777 -2.9028 -2.9028 -2.3991 -2.3991 -0.4222 -0.4222 -0.4162 -0.4162 -0.3543 -0.3543 -0.0110 -0.0110 0.0465 0.0465 0.2651 0.2651 3.5399 3.5399 3.5408 3.5408 3.8254 3.8254 3.8632 3.8632 4.2819 4.2819 4.3225 4.3225 4.8632 4.8632 4.8928 4.8928 6.0238 6.0238 6.1972 6.1972 10.4917 10.4917 10.8004 10.8004 12.6074 12.6074 13.0781 13.0781 13.3525 13.3525 13.4722 13.4722 k = 0.3448 0.1522 0.0993 ( 6143 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3505 -19.3505 -16.2951 -16.2951 -16.1254 -16.1254 -12.9191 -12.9191 -12.9183 -12.9183 -12.8250 -12.8250 -12.8240 -12.8240 -5.9874 -5.9874 -4.1104 -4.1104 -4.0781 -4.0781 -2.9079 -2.9079 -2.3910 -2.3910 -0.4166 -0.4166 -0.4117 -0.4117 -0.3912 -0.3912 -0.0170 -0.0170 0.0398 0.0398 0.2994 0.2994 3.5510 3.5510 3.5523 3.5523 3.8115 3.8115 3.8467 3.8467 4.3022 4.3022 4.3450 4.3450 4.8459 4.8459 4.8755 4.8755 6.0190 6.0190 6.2023 6.2023 10.5126 10.5126 10.8355 10.8355 12.5339 12.5339 13.0189 13.0189 13.3629 13.3629 13.4829 13.4829 k = 0.3276 0.1446 0.0944 ( 6154 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3508 -19.3508 -16.2938 -16.2938 -16.1260 -16.1260 -12.9181 -12.9181 -12.9173 -12.9173 -12.8260 -12.8260 -12.8250 -12.8250 -5.9879 -5.9879 -4.1103 -4.1103 -4.0786 -4.0786 -2.9131 -2.9131 -2.3824 -2.3824 -0.4289 -0.4289 -0.4104 -0.4104 -0.4053 -0.4053 -0.0238 -0.0238 0.0325 0.0325 0.3327 0.3327 3.5625 3.5625 3.5643 3.5643 3.7988 3.7988 3.8316 3.8316 4.3225 4.3225 4.3673 4.3673 4.8269 4.8269 4.8564 4.8564 6.0140 6.0140 6.2075 6.2075 10.5357 10.5357 10.8735 10.8735 12.4550 12.4550 12.9664 12.9664 13.3740 13.3740 13.4944 13.4944 k = 0.3103 0.1370 0.0894 ( 6157 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3511 -19.3511 -16.2924 -16.2924 -16.1267 -16.1267 -12.9170 -12.9170 -12.9162 -12.9162 -12.8271 -12.8271 -12.8261 -12.8261 -5.9885 -5.9885 -4.1102 -4.1102 -4.0790 -4.0790 -2.9185 -2.9185 -2.3736 -2.3736 -0.4644 -0.4644 -0.4037 -0.4037 -0.3997 -0.3997 -0.0311 -0.0311 0.0244 0.0244 0.3650 0.3650 3.5739 3.5739 3.5764 3.5764 3.7882 3.7882 3.8184 3.8184 4.3427 4.3427 4.3893 4.3893 4.8061 4.8061 4.8357 4.8357 6.0090 6.0090 6.2127 6.2127 10.5609 10.5609 10.9140 10.9140 12.3732 12.3732 12.9187 12.9187 13.3860 13.3860 13.5068 13.5068 k = 0.2931 0.1294 0.0844 ( 6160 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3514 -19.3514 -16.2910 -16.2910 -16.1274 -16.1274 -12.9158 -12.9158 -12.9150 -12.9150 -12.8283 -12.8283 -12.8273 -12.8273 -5.9891 -5.9891 -4.1101 -4.1101 -4.0795 -4.0795 -2.9238 -2.9238 -2.3645 -2.3645 -0.4992 -0.4992 -0.3964 -0.3964 -0.3934 -0.3934 -0.0390 -0.0390 0.0158 0.0158 0.3961 0.3961 3.5844 3.5844 3.5878 3.5878 3.7803 3.7803 3.8079 3.8079 4.3626 4.3626 4.4107 4.4107 4.7838 4.7838 4.8134 4.8134 6.0040 6.0040 6.2179 6.2179 10.5878 10.5878 10.9565 10.9565 12.2905 12.2905 12.8746 12.8746 13.3985 13.3985 13.5198 13.5198 k = 0.2759 0.1217 0.0795 ( 6169 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3518 -19.3518 -16.2895 -16.2895 -16.1282 -16.1282 -12.9145 -12.9145 -12.9138 -12.9138 -12.8296 -12.8296 -12.8286 -12.8286 -5.9898 -5.9898 -4.1100 -4.1100 -4.0801 -4.0801 -2.9291 -2.9291 -2.3554 -2.3554 -0.5329 -0.5329 -0.3885 -0.3885 -0.3865 -0.3865 -0.0474 -0.0474 0.0066 0.0066 0.4260 0.4260 3.5931 3.5931 3.5980 3.5980 3.7762 3.7762 3.8009 3.8009 4.3820 4.3820 4.4313 4.4313 4.7599 4.7599 4.7899 4.7899 5.9992 5.9992 6.2231 6.2231 10.6165 10.6165 11.0004 11.0004 12.2087 12.2087 12.8332 12.8332 13.4115 13.4115 13.5333 13.5333 k = 0.2586 0.1141 0.0745 ( 6163 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3521 -19.3521 -16.2879 -16.2879 -16.1290 -16.1290 -12.9132 -12.9132 -12.9125 -12.9125 -12.8309 -12.8309 -12.8299 -12.8299 -5.9904 -5.9904 -4.1099 -4.1099 -4.0806 -4.0806 -2.9342 -2.9342 -2.3462 -2.3462 -0.5654 -0.5654 -0.3802 -0.3802 -0.3792 -0.3792 -0.0564 -0.0564 -0.0031 -0.0031 0.4546 0.4546 3.5993 3.5993 3.6058 3.6058 3.7767 3.7767 3.7982 3.7982 4.4008 4.4008 4.4510 4.4510 4.7347 4.7347 4.7651 4.7651 5.9945 5.9945 6.2281 6.2281 10.6467 10.6467 11.0453 11.0453 12.1290 12.1290 12.7939 12.7939 13.4248 13.4248 13.5471 13.5471 k = 0.2414 0.1065 0.0695 ( 6160 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3525 -19.3525 -16.2863 -16.2863 -16.1298 -16.1298 -12.9118 -12.9118 -12.9111 -12.9111 -12.8323 -12.8323 -12.8313 -12.8313 -5.9911 -5.9911 -4.1098 -4.1098 -4.0811 -4.0811 -2.9392 -2.9392 -2.3372 -2.3372 -0.5965 -0.5965 -0.3714 -0.3714 -0.3713 -0.3713 -0.0658 -0.0658 -0.0133 -0.0133 0.4820 0.4820 3.6023 3.6023 3.6107 3.6107 3.7823 3.7823 3.8007 3.8007 4.4188 4.4188 4.4694 4.4694 4.7082 4.7082 4.7394 4.7394 5.9899 5.9899 6.2329 6.2329 10.6782 10.6782 11.0903 11.0903 12.0522 12.0522 12.7566 12.7566 13.4383 13.4383 13.5611 13.5611 k = 0.2241 0.0989 0.0646 ( 6160 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3528 -19.3528 -16.2847 -16.2847 -16.1306 -16.1306 -12.9104 -12.9104 -12.9097 -12.9097 -12.8337 -12.8337 -12.8327 -12.8327 -5.9917 -5.9917 -4.1098 -4.1098 -4.0816 -4.0816 -2.9439 -2.9439 -2.3284 -2.3284 -0.6262 -0.6262 -0.3631 -0.3631 -0.3621 -0.3621 -0.0756 -0.0756 -0.0240 -0.0240 0.5078 0.5078 3.6022 3.6022 3.6123 3.6123 3.7930 3.7930 3.8086 3.8086 4.4360 4.4360 4.4864 4.4864 4.6807 4.6807 4.7131 4.7131 5.9855 5.9855 6.2376 6.2376 10.7107 10.7107 11.1348 11.1348 11.9792 11.9792 12.7212 12.7212 13.4519 13.4519 13.5752 13.5752 k = 0.2069 0.0913 0.0596 ( 6160 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3532 -19.3532 -16.2831 -16.2831 -16.1314 -16.1314 -12.9089 -12.9089 -12.9083 -12.9083 -12.8352 -12.8352 -12.8341 -12.8341 -5.9923 -5.9923 -4.1097 -4.1097 -4.0821 -4.0821 -2.9483 -2.9483 -2.3198 -2.3198 -0.6543 -0.6543 -0.3544 -0.3544 -0.3524 -0.3524 -0.0859 -0.0859 -0.0350 -0.0350 0.5321 0.5321 3.5996 3.5996 3.6110 3.6110 3.8082 3.8082 3.8214 3.8214 4.4521 4.4521 4.5014 4.5014 4.6522 4.6522 4.6868 4.6868 5.9814 5.9814 6.2420 6.2420 10.7439 10.7439 11.1779 11.1779 11.9105 11.9105 12.6880 12.6880 13.4653 13.4653 13.5892 13.5892 k = 0.1897 0.0837 0.0546 ( 6178 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3535 -19.3535 -16.2816 -16.2816 -16.1323 -16.1323 -12.9075 -12.9075 -12.9068 -12.9068 -12.8366 -12.8366 -12.8356 -12.8356 -5.9929 -5.9929 -4.1096 -4.1096 -4.0826 -4.0826 -2.9524 -2.9524 -2.3117 -2.3117 -0.6807 -0.6807 -0.3454 -0.3454 -0.3423 -0.3423 -0.0965 -0.0965 -0.0464 -0.0464 0.5547 0.5547 3.5951 3.5951 3.6074 3.6074 3.8269 3.8269 3.8383 3.8383 4.4672 4.4672 4.5136 4.5136 4.6230 4.6230 4.6614 4.6614 5.9775 5.9775 6.2461 6.2461 10.7776 10.7776 11.2188 11.2188 11.8466 11.8466 12.6571 12.6571 13.4784 13.4784 13.6028 13.6028 k = 0.1724 0.0761 0.0497 ( 6184 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3538 -19.3538 -16.2801 -16.2801 -16.1331 -16.1331 -12.9060 -12.9060 -12.9054 -12.9054 -12.8381 -12.8381 -12.8370 -12.8370 -5.9935 -5.9935 -4.1096 -4.1096 -4.0831 -4.0831 -2.9563 -2.9563 -2.3040 -2.3040 -0.7052 -0.7052 -0.3359 -0.3359 -0.3319 -0.3319 -0.1074 -0.1074 -0.0581 -0.0581 0.5757 0.5757 3.5895 3.5895 3.6024 3.6024 3.8485 3.8485 3.8586 3.8586 4.4809 4.4809 4.5212 4.5212 4.5935 4.5935 4.6387 4.6387 5.9738 5.9738 6.2499 6.2499 10.8113 10.8113 11.2567 11.2567 11.7878 11.7878 12.6291 12.6291 13.4910 13.4910 13.6160 13.6160 k = 0.1552 0.0685 0.0447 ( 6184 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3541 -19.3541 -16.2786 -16.2786 -16.1338 -16.1338 -12.9046 -12.9046 -12.9040 -12.9040 -12.8395 -12.8395 -12.8384 -12.8384 -5.9941 -5.9941 -4.1095 -4.1095 -4.0835 -4.0835 -2.9597 -2.9597 -2.2967 -2.2967 -0.7279 -0.7279 -0.3261 -0.3261 -0.3212 -0.3212 -0.1186 -0.1186 -0.0699 -0.0699 0.5949 0.5949 3.5835 3.5835 3.5966 3.5966 3.8721 3.8721 3.8813 3.8813 4.4927 4.4927 4.5215 4.5215 4.5642 4.5642 4.6217 4.6217 5.9705 5.9705 6.2535 6.2535 10.8446 10.8446 11.2910 11.2910 11.7345 11.7345 12.6042 12.6042 13.5030 13.5030 13.6285 13.6285 k = 0.1379 0.0609 0.0397 ( 6196 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6467 -33.6467 -33.6385 -33.6385 -19.3544 -19.3544 -16.2773 -16.2773 -16.1346 -16.1346 -12.9032 -12.9032 -12.9026 -12.9026 -12.8409 -12.8409 -12.8398 -12.8398 -5.9946 -5.9946 -4.1095 -4.1095 -4.0839 -4.0839 -2.9629 -2.9629 -2.2901 -2.2901 -0.7485 -0.7485 -0.3160 -0.3160 -0.3104 -0.3104 -0.1300 -0.1300 -0.0819 -0.0819 0.6122 0.6122 3.5775 3.5775 3.5905 3.5905 3.8971 3.8971 3.9056 3.9056 4.5001 4.5001 4.5115 4.5115 4.5380 4.5380 4.6133 4.6133 5.9675 5.9675 6.2567 6.2567 10.8770 10.8770 11.3210 11.3210 11.6868 11.6868 12.5827 12.5827 13.5142 13.5142 13.6403 13.6403 k = 0.1207 0.0533 0.0348 ( 6196 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6467 -33.6467 -33.6385 -33.6385 -19.3547 -19.3547 -16.2760 -16.2760 -16.1353 -16.1353 -12.9018 -12.9018 -12.9013 -12.9013 -12.8423 -12.8423 -12.8411 -12.8411 -5.9950 -5.9950 -4.1094 -4.1094 -4.0843 -4.0843 -2.9657 -2.9657 -2.2841 -2.2841 -0.7669 -0.7669 -0.3056 -0.3056 -0.2994 -0.2994 -0.1416 -0.1416 -0.0939 -0.0939 0.6277 0.6277 3.5717 3.5717 3.5846 3.5846 3.9230 3.9230 3.9311 3.9311 4.4907 4.4907 4.4928 4.4928 4.5274 4.5274 4.6127 4.6127 5.9648 5.9648 6.2596 6.2596 10.9079 10.9079 11.3466 11.3466 11.6447 11.6447 12.5648 12.5648 13.5246 13.5246 13.6511 13.6511 k = 0.1034 0.0457 0.0298 ( 6196 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3549 -19.3549 -16.2749 -16.2749 -16.1359 -16.1359 -12.9006 -12.9006 -12.9001 -12.9001 -12.8435 -12.8435 -12.8424 -12.8424 -5.9955 -5.9955 -4.1094 -4.1094 -4.0846 -4.0846 -2.9681 -2.9681 -2.2788 -2.2788 -0.7829 -0.7829 -0.2949 -0.2949 -0.2884 -0.2884 -0.1534 -0.1534 -0.1059 -0.1059 0.6413 0.6413 3.5664 3.5664 3.5792 3.5792 3.9492 3.9492 3.9569 3.9569 4.4655 4.4655 4.4692 4.4692 4.5320 4.5320 4.6161 4.6161 5.9625 5.9625 6.2621 6.2621 10.9365 10.9365 11.3680 11.3680 11.6078 11.6078 12.5506 12.5506 13.5338 13.5338 13.6607 13.6607 k = 0.0862 0.0380 0.0248 ( 6184 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3551 -19.3551 -16.2739 -16.2739 -16.1364 -16.1364 -12.8995 -12.8995 -12.8990 -12.8990 -12.8446 -12.8446 -12.8434 -12.8434 -5.9958 -5.9958 -4.1094 -4.1094 -4.0849 -4.0849 -2.9701 -2.9701 -2.2742 -2.2742 -0.7968 -0.7968 -0.2839 -0.2839 -0.2776 -0.2776 -0.1653 -0.1653 -0.1174 -0.1174 0.6529 0.6529 3.5617 3.5617 3.5743 3.5743 3.9748 3.9748 3.9823 3.9823 4.4380 4.4380 4.4439 4.4439 4.5386 4.5386 4.6209 4.6209 5.9605 5.9605 6.2643 6.2643 10.9622 10.9622 11.3858 11.3858 11.5758 11.5758 12.5398 12.5398 13.5419 13.5419 13.6692 13.6692 k = 0.0690 0.0304 0.0199 ( 6196 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6467 -33.6467 -33.6386 -33.6386 -19.3553 -19.3553 -16.2731 -16.2731 -16.1369 -16.1369 -12.8985 -12.8985 -12.8980 -12.8980 -12.8456 -12.8456 -12.8444 -12.8444 -5.9961 -5.9961 -4.1093 -4.1093 -4.0852 -4.0852 -2.9718 -2.9718 -2.2704 -2.2704 -0.8083 -0.8083 -0.2727 -0.2727 -0.2672 -0.2672 -0.1772 -0.1772 -0.1285 -0.1285 0.6624 0.6624 3.5577 3.5577 3.5702 3.5702 3.9992 3.9992 4.0065 4.0065 4.4117 4.4117 4.4192 4.4192 4.5446 4.5446 4.6257 4.6257 5.9588 5.9588 6.2661 6.2661 10.9842 10.9842 11.4011 11.4011 11.5479 11.5479 12.5320 12.5320 13.5486 13.5486 13.6762 13.6762 k = 0.0517 0.0228 0.0149 ( 6193 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3554 -19.3554 -16.2724 -16.2724 -16.1373 -16.1373 -12.8977 -12.8977 -12.8972 -12.8972 -12.8464 -12.8464 -12.8452 -12.8452 -5.9964 -5.9964 -4.1093 -4.1093 -4.0854 -4.0854 -2.9731 -2.9731 -2.2673 -2.2673 -0.8172 -0.8172 -0.2614 -0.2614 -0.2577 -0.2577 -0.1891 -0.1891 -0.1385 -0.1385 0.6699 0.6699 3.5546 3.5546 3.5670 3.5670 4.0211 4.0211 4.0282 4.0282 4.3882 4.3882 4.3967 4.3967 4.5494 4.5494 4.6298 4.6298 5.9575 5.9575 6.2675 6.2675 11.0020 11.0020 11.4153 11.4153 11.5232 11.5232 12.5268 12.5268 13.5540 13.5540 13.6819 13.6819 k = 0.0345 0.0152 0.0099 ( 6181 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3555 -19.3555 -16.2720 -16.2720 -16.1375 -16.1375 -12.8971 -12.8971 -12.8966 -12.8966 -12.8470 -12.8470 -12.8457 -12.8457 -5.9965 -5.9965 -4.1093 -4.1093 -4.0855 -4.0855 -2.9740 -2.9740 -2.2652 -2.2652 -0.8236 -0.8236 -0.2500 -0.2500 -0.2496 -0.2496 -0.2009 -0.2009 -0.1469 -0.1469 0.6752 0.6752 3.5523 3.5523 3.5646 3.5646 4.0390 4.0390 4.0459 4.0459 4.3692 4.3692 4.3784 4.3784 4.5529 4.5529 4.6329 4.6329 5.9566 5.9566 6.2685 6.2685 11.0150 11.0150 11.4297 11.4297 11.5010 11.5010 12.5236 12.5236 13.5579 13.5579 13.6859 13.6859 k = 0.0172 0.0076 0.0050 ( 6169 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3555 -19.3555 -16.2717 -16.2717 -16.1377 -16.1377 -12.8967 -12.8967 -12.8963 -12.8963 -12.8473 -12.8473 -12.8461 -12.8461 -5.9966 -5.9966 -4.1093 -4.1093 -4.0856 -4.0856 -2.9746 -2.9746 -2.2638 -2.2638 -0.8275 -0.8275 -0.2441 -0.2441 -0.2388 -0.2388 -0.2123 -0.2123 -0.1527 -0.1527 0.6785 0.6785 3.5510 3.5510 3.5632 3.5632 4.0509 4.0509 4.0577 4.0577 4.3566 4.3566 4.3662 4.3662 4.5551 4.5551 4.6348 4.6348 5.9561 5.9561 6.2692 6.2692 11.0229 11.0229 11.4451 11.4451 11.4807 11.4807 12.5220 12.5220 13.5602 13.5602 13.6884 13.6884 k = 0.0000 0.0000 0.0000 ( 6169 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3556 -19.3556 -16.2716 -16.2716 -16.1377 -16.1377 -12.8966 -12.8966 -12.8962 -12.8962 -12.8474 -12.8474 -12.8462 -12.8462 -5.9967 -5.9967 -4.1093 -4.1093 -4.0856 -4.0856 -2.9747 -2.9747 -2.2634 -2.2634 -0.8288 -0.8288 -0.2420 -0.2420 -0.2313 -0.2313 -0.2199 -0.2199 -0.1548 -0.1548 0.6795 0.6795 3.5505 3.5505 3.5627 3.5627 4.0551 4.0551 4.0619 4.0619 4.3521 4.3521 4.3619 4.3619 4.5558 4.5558 4.6354 4.6354 5.9559 5.9559 6.2694 6.2694 11.0256 11.0256 11.4606 11.4606 11.4636 11.4636 12.5214 12.5214 13.5610 13.5610 13.6892 13.6892 k = 0.0000 0.0000 0.0000 ( 6169 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3556 -19.3556 -16.2716 -16.2716 -16.1377 -16.1377 -12.8966 -12.8966 -12.8962 -12.8962 -12.8474 -12.8474 -12.8462 -12.8462 -5.9967 -5.9967 -4.1093 -4.1093 -4.0856 -4.0856 -2.9747 -2.9747 -2.2634 -2.2634 -0.8288 -0.8288 -0.2420 -0.2420 -0.2313 -0.2313 -0.2199 -0.2199 -0.1548 -0.1548 0.6795 0.6795 3.5505 3.5505 3.5627 3.5627 4.0551 4.0551 4.0619 4.0619 4.3521 4.3521 4.3619 4.3619 4.5558 4.5558 4.6354 4.6354 5.9559 5.9559 6.2694 6.2694 11.0256 11.0256 11.4606 11.4606 11.4636 11.4636 12.5214 12.5214 13.5610 13.5610 13.6892 13.6892 k = 0.0079-0.0072-0.0164 ( 6173 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3555 -19.3555 -16.2715 -16.2715 -16.1377 -16.1377 -12.8968 -12.8968 -12.8963 -12.8963 -12.8476 -12.8476 -12.8464 -12.8464 -5.9966 -5.9966 -4.1091 -4.1091 -4.0856 -4.0856 -2.9731 -2.9731 -2.2629 -2.2629 -0.8276 -0.8276 -0.2419 -0.2419 -0.2311 -0.2311 -0.2201 -0.2201 -0.1553 -0.1553 0.6788 0.6788 3.5504 3.5504 3.5625 3.5625 4.0552 4.0552 4.0620 4.0620 4.3515 4.3515 4.3614 4.3614 4.5547 4.5547 4.6342 4.6342 5.9546 5.9546 6.2682 6.2682 11.0270 11.0270 11.4630 11.4630 11.4643 11.4643 12.5223 12.5223 13.5611 13.5611 13.6893 13.6893 k = 0.0158-0.0145-0.0329 ( 6177 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3552 -19.3552 -16.2714 -16.2714 -16.1377 -16.1377 -12.8974 -12.8974 -12.8967 -12.8967 -12.8484 -12.8484 -12.8466 -12.8466 -5.9963 -5.9963 -4.1086 -4.1086 -4.0854 -4.0854 -2.9683 -2.9683 -2.2615 -2.2615 -0.8241 -0.8241 -0.2417 -0.2417 -0.2305 -0.2305 -0.2205 -0.2205 -0.1568 -0.1568 0.6765 0.6765 3.5500 3.5500 3.5621 3.5621 4.0557 4.0557 4.0623 4.0623 4.3491 4.3491 4.3603 4.3603 4.5512 4.5512 4.6308 4.6308 5.9508 5.9508 6.2649 6.2649 11.0315 11.0315 11.4659 11.4659 11.4702 11.4702 12.5250 12.5250 13.5613 13.5613 13.6896 13.6896 k = 0.0238-0.0217-0.0493 ( 6181 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3548 -19.3548 -16.2712 -16.2712 -16.1375 -16.1375 -12.8985 -12.8985 -12.8972 -12.8972 -12.8500 -12.8500 -12.8467 -12.8467 -5.9959 -5.9959 -4.1079 -4.1079 -4.0851 -4.0851 -2.9602 -2.9602 -2.2591 -2.2591 -0.8182 -0.8182 -0.2420 -0.2420 -0.2291 -0.2291 -0.2212 -0.2212 -0.1590 -0.1590 0.6726 0.6726 3.5492 3.5492 3.5615 3.5615 4.0565 4.0565 4.0629 4.0629 4.3441 4.3441 4.3596 4.3596 4.5451 4.5451 4.6256 4.6256 5.9446 5.9446 6.2594 6.2594 11.0389 11.0389 11.4689 11.4689 11.4820 11.4820 12.5295 12.5295 13.5614 13.5614 13.6903 13.6903 k = 0.0317-0.0289-0.0657 ( 6173 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3541 -19.3541 -16.2710 -16.2710 -16.1374 -16.1374 -12.9001 -12.9001 -12.8979 -12.8979 -12.8522 -12.8522 -12.8467 -12.8467 -5.9954 -5.9954 -4.1069 -4.1069 -4.0845 -4.0845 -2.9490 -2.9490 -2.2557 -2.2557 -0.8099 -0.8099 -0.2434 -0.2434 -0.2277 -0.2277 -0.2212 -0.2212 -0.1613 -0.1613 0.6674 0.6674 3.5482 3.5482 3.5606 3.5606 4.0574 4.0574 4.0639 4.0639 4.3362 4.3362 4.3594 4.3594 4.5357 4.5357 4.6194 4.6194 5.9359 5.9359 6.2517 6.2517 11.0491 11.0491 11.4729 11.4729 11.4983 11.4983 12.5359 12.5359 13.5613 13.5613 13.6915 13.6915 k = 0.0396-0.0361-0.0822 ( 6173 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3534 -19.3534 -16.2706 -16.2706 -16.1372 -16.1372 -12.9021 -12.9021 -12.8988 -12.8988 -12.8550 -12.8550 -12.8467 -12.8467 -5.9946 -5.9946 -4.1060 -4.1060 -4.0836 -4.0836 -2.9347 -2.9347 -2.2513 -2.2513 -0.7994 -0.7994 -0.2467 -0.2467 -0.2288 -0.2288 -0.2180 -0.2180 -0.1634 -0.1634 0.6606 0.6606 3.5468 3.5468 3.5595 3.5595 4.0584 4.0584 4.0654 4.0654 4.3256 4.3256 4.3597 4.3597 4.5225 4.5225 4.6129 4.6129 5.9249 5.9249 6.2419 6.2419 11.0621 11.0621 11.4781 11.4781 11.5188 11.5188 12.5442 12.5442 13.5606 13.5606 13.6936 13.6936 k = 0.0475-0.0434-0.0986 ( 6179 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3524 -19.3524 -16.2702 -16.2702 -16.1370 -16.1370 -12.9045 -12.9045 -12.9001 -12.9001 -12.8584 -12.8584 -12.8467 -12.8467 -5.9937 -5.9937 -4.1050 -4.1050 -4.0821 -4.0821 -2.9175 -2.9175 -2.2458 -2.2458 -0.7867 -0.7867 -0.2526 -0.2526 -0.2316 -0.2316 -0.2121 -0.2121 -0.1647 -0.1647 0.6526 0.6526 3.5449 3.5449 3.5582 3.5582 4.0593 4.0593 4.0676 4.0676 4.3125 4.3125 4.3602 4.3602 4.5054 4.5054 4.6066 4.6066 5.9117 5.9117 6.2301 6.2301 11.0779 11.0779 11.4843 11.4843 11.5432 11.5432 12.5545 12.5545 13.5591 13.5591 13.6969 13.6969 k = 0.0555-0.0506-0.1150 ( 6177 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3513 -19.3513 -16.2696 -16.2696 -16.1368 -16.1368 -12.9072 -12.9072 -12.9016 -12.9016 -12.8621 -12.8621 -12.8468 -12.8468 -5.9927 -5.9927 -4.1043 -4.1043 -4.0799 -4.0799 -2.8974 -2.8974 -2.2393 -2.2393 -0.7719 -0.7719 -0.2618 -0.2618 -0.2347 -0.2347 -0.2047 -0.2047 -0.1649 -0.1649 0.6432 0.6432 3.5426 3.5426 3.5566 3.5566 4.0597 4.0597 4.0706 4.0706 4.2969 4.2969 4.3609 4.3609 4.4844 4.4844 4.6007 4.6007 5.8964 5.8964 6.2164 6.2164 11.0962 11.0962 11.4916 11.4916 11.5712 11.5712 12.5670 12.5670 13.5567 13.5567 13.7016 13.7016 k = 0.0634-0.0578-0.1314 ( 6177 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3500 -19.3500 -16.2690 -16.2690 -16.1365 -16.1365 -12.9102 -12.9102 -12.9036 -12.9036 -12.8661 -12.8661 -12.8469 -12.8469 -5.9915 -5.9915 -4.1037 -4.1037 -4.0772 -4.0772 -2.8746 -2.8746 -2.2316 -2.2316 -0.7549 -0.7549 -0.2746 -0.2746 -0.2376 -0.2376 -0.1959 -0.1959 -0.1641 -0.1641 0.6326 0.6326 3.5398 3.5398 3.5549 3.5549 4.0596 4.0596 4.0744 4.0744 4.2789 4.2789 4.3617 4.3617 4.4602 4.4602 4.5953 4.5953 5.8792 5.8792 6.2008 6.2008 11.1170 11.1170 11.4998 11.4998 11.6022 11.6022 12.5819 12.5819 13.5530 13.5530 13.7078 13.7078 k = 0.0713-0.0650-0.1479 ( 6169 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3487 -19.3487 -16.2683 -16.2683 -16.1363 -16.1363 -12.9134 -12.9134 -12.9063 -12.9063 -12.8702 -12.8702 -12.8471 -12.8471 -5.9902 -5.9902 -4.1033 -4.1033 -4.0738 -4.0738 -2.8492 -2.8492 -2.2228 -2.2228 -0.7360 -0.7360 -0.2905 -0.2905 -0.2406 -0.2406 -0.1860 -0.1860 -0.1622 -0.1622 0.6209 0.6209 3.5365 3.5365 3.5529 3.5529 4.0586 4.0586 4.0791 4.0791 4.2588 4.2588 4.3623 4.3623 4.4337 4.4337 4.5902 4.5902 5.8602 5.8602 6.1834 6.1834 11.1400 11.1400 11.5089 11.5089 11.6358 11.6358 12.5992 12.5992 13.5481 13.5481 13.7158 13.7158 k = 0.0792-0.0723-0.1643 ( 6169 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3471 -19.3471 -16.2676 -16.2676 -16.1361 -16.1361 -12.9169 -12.9169 -12.9097 -12.9097 -12.8742 -12.8742 -12.8473 -12.8473 -5.9888 -5.9888 -4.1030 -4.1030 -4.0698 -4.0698 -2.8214 -2.8214 -2.2128 -2.2128 -0.7152 -0.7152 -0.3090 -0.3090 -0.2440 -0.2440 -0.1750 -0.1750 -0.1594 -0.1594 0.6082 0.6082 3.5326 3.5326 3.5508 3.5508 4.0563 4.0563 4.0847 4.0847 4.2366 4.2366 4.3619 4.3619 4.4063 4.4063 4.5851 4.5851 5.8395 5.8395 6.1644 6.1644 11.1652 11.1652 11.5189 11.5189 11.6714 11.6714 12.6193 12.6193 13.5420 13.5420 13.7255 13.7255 k = 0.0871-0.0795-0.1807 ( 6169 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3455 -19.3455 -16.2667 -16.2667 -16.1358 -16.1358 -12.9206 -12.9206 -12.9140 -12.9140 -12.8778 -12.8778 -12.8476 -12.8476 -5.9873 -5.9873 -4.1028 -4.1028 -4.0653 -4.0653 -2.7912 -2.7912 -2.2015 -2.2015 -0.6927 -0.6927 -0.3299 -0.3299 -0.2480 -0.2480 -0.1632 -0.1632 -0.1559 -0.1559 0.5946 0.5946 3.5283 3.5283 3.5486 3.5486 4.0520 4.0520 4.0910 4.0910 4.2130 4.2130 4.3565 4.3565 4.3830 4.3830 4.5800 4.5800 5.8173 5.8173 6.1439 6.1439 11.1923 11.1923 11.5296 11.5296 11.7084 11.7084 12.6424 12.6424 13.5348 13.5348 13.7367 13.7367 k = 0.0951-0.0867-0.1972 ( 6163 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3437 -19.3437 -16.2657 -16.2657 -16.1356 -16.1356 -12.9244 -12.9244 -12.9193 -12.9193 -12.8810 -12.8810 -12.8480 -12.8480 -5.9857 -5.9857 -4.1025 -4.1025 -4.0605 -4.0605 -2.7589 -2.7589 -2.1889 -2.1889 -0.6687 -0.6687 -0.3529 -0.3529 -0.2528 -0.2528 -0.1526 -0.1526 -0.1493 -0.1493 0.5801 0.5801 3.5235 3.5235 3.5462 3.5462 4.0445 4.0445 4.0982 4.0982 4.1891 4.1891 4.3357 4.3357 4.3748 4.3748 4.5747 4.5747 5.7939 5.7939 6.1220 6.1220 11.2212 11.2212 11.5410 11.5410 11.7461 11.7461 12.6687 12.6687 13.5267 13.5267 13.7494 13.7494 k = 0.1030-0.0939-0.2136 ( 6163 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3419 -19.3419 -16.2646 -16.2646 -16.1355 -16.1355 -12.9282 -12.9282 -12.9256 -12.9256 -12.8837 -12.8837 -12.8484 -12.8484 -5.9839 -5.9839 -4.1021 -4.1021 -4.0554 -4.0554 -2.7245 -2.7245 -2.1751 -2.1751 -0.6433 -0.6433 -0.3776 -0.3776 -0.2586 -0.2586 -0.1474 -0.1474 -0.1361 -0.1361 0.5650 0.5650 3.5181 3.5181 3.5439 3.5439 4.0320 4.0320 4.1059 4.1059 4.1665 4.1665 4.3076 4.3076 4.3744 4.3744 4.5693 4.5693 5.7694 5.7694 6.0988 6.0988 11.2516 11.2516 11.5530 11.5530 11.7837 11.7837 12.6985 12.6985 13.5178 13.5178 13.7636 13.7636 k = 0.1109-0.1012-0.2300 ( 6167 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3399 -19.3399 -16.2634 -16.2634 -16.1354 -16.1354 -12.9330 -12.9330 -12.9321 -12.9321 -12.8858 -12.8858 -12.8490 -12.8490 -5.9821 -5.9821 -4.1016 -4.1016 -4.0501 -4.0501 -2.6883 -2.6883 -2.1599 -2.1599 -0.6170 -0.6170 -0.4037 -0.4037 -0.2656 -0.2656 -0.1419 -0.1419 -0.1216 -0.1216 0.5492 0.5492 3.5121 3.5121 3.5416 3.5416 4.0128 4.0128 4.1139 4.1139 4.1476 4.1476 4.2787 4.2787 4.3756 4.3756 4.5636 4.5636 5.7439 5.7439 6.0744 6.0744 11.2833 11.2833 11.5656 11.5656 11.8207 11.8207 12.7320 12.7320 13.5083 13.5083 13.7790 13.7790 k = 0.1188-0.1084-0.2465 ( 6165 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3379 -19.3379 -16.2621 -16.2621 -16.1353 -16.1353 -12.9411 -12.9411 -12.9361 -12.9361 -12.8876 -12.8876 -12.8496 -12.8496 -5.9802 -5.9802 -4.1009 -4.1009 -4.0446 -4.0446 -2.6504 -2.6504 -2.1434 -2.1434 -0.5903 -0.5903 -0.4306 -0.4306 -0.2739 -0.2739 -0.1358 -0.1358 -0.1065 -0.1065 0.5329 0.5329 3.5056 3.5056 3.5396 3.5396 3.9860 3.9860 4.1192 4.1192 4.1357 4.1357 4.2507 4.2507 4.3775 4.3775 4.5576 4.5576 5.7177 5.7177 6.0489 6.0489 11.3161 11.3161 11.5786 11.5786 11.8564 11.8564 12.7694 12.7694 13.4982 13.4982 13.7957 13.7957 k = 0.1267-0.1156-0.2629 ( 6167 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3359 -19.3359 -16.2607 -16.2607 -16.1354 -16.1354 -12.9499 -12.9499 -12.9400 -12.9400 -12.8890 -12.8890 -12.8503 -12.8503 -5.9783 -5.9783 -4.0999 -4.0999 -4.0391 -4.0391 -2.6110 -2.6110 -2.1257 -2.1257 -0.5650 -0.5650 -0.4564 -0.4564 -0.2836 -0.2836 -0.1291 -0.1291 -0.0907 -0.0907 0.5161 0.5161 3.4986 3.4986 3.5378 3.5378 3.9525 3.9525 4.1136 4.1136 4.1382 4.1382 4.2245 4.2245 4.3795 4.3795 4.5514 4.5514 5.6909 5.6909 6.0225 6.0225 11.3498 11.3498 11.5920 11.5920 11.8901 11.8901 12.8105 12.8105 13.4876 13.4876 13.8136 13.8136 k = 0.1347-0.1229-0.2793 ( 6179 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3338 -19.3338 -16.2592 -16.2592 -16.1355 -16.1355 -12.9592 -12.9592 -12.9438 -12.9438 -12.8901 -12.8901 -12.8510 -12.8510 -5.9763 -5.9763 -4.0987 -4.0987 -4.0335 -4.0335 -2.5701 -2.5701 -2.1067 -2.1067 -0.5474 -0.5474 -0.4751 -0.4751 -0.2949 -0.2949 -0.1218 -0.1218 -0.0745 -0.0745 0.4990 0.4990 3.4909 3.4909 3.5365 3.5365 3.9140 3.9140 4.1033 4.1033 4.1464 4.1464 4.2014 4.2014 4.3818 4.3818 4.5449 4.5449 5.6638 5.6638 5.9953 5.9953 11.3841 11.3841 11.6056 11.6056 11.9215 11.9215 12.8554 12.8554 13.4767 13.4767 13.8324 13.8324 k = 0.1426-0.1301-0.2957 ( 6163 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3316 -19.3316 -16.2575 -16.2575 -16.1358 -16.1358 -12.9690 -12.9690 -12.9474 -12.9474 -12.8910 -12.8910 -12.8519 -12.8519 -5.9743 -5.9743 -4.0973 -4.0973 -4.0280 -4.0280 -2.5280 -2.5280 -2.0864 -2.0864 -0.5528 -0.5528 -0.4713 -0.4713 -0.3078 -0.3078 -0.1138 -0.1138 -0.0579 -0.0579 0.4817 0.4817 3.4827 3.4827 3.5358 3.5358 3.8723 3.8723 4.0912 4.0912 4.1534 4.1534 4.1843 4.1843 4.3842 4.3842 4.5382 4.5382 5.6365 5.6365 5.9675 5.9675 11.4189 11.4189 11.6195 11.6195 11.9502 11.9502 12.9036 12.9036 13.4652 13.4652 13.8515 13.8515 k = 0.1505-0.1373-0.3122 ( 6157 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3295 -19.3295 -16.2558 -16.2558 -16.1361 -16.1361 -12.9791 -12.9791 -12.9509 -12.9509 -12.8917 -12.8917 -12.8528 -12.8528 -5.9723 -5.9723 -4.0957 -4.0957 -4.0226 -4.0226 -2.4847 -2.4847 -2.0650 -2.0650 -0.5779 -0.5779 -0.4486 -0.4486 -0.3221 -0.3221 -0.1051 -0.1051 -0.0411 -0.0411 0.4642 0.4642 3.4738 3.4738 3.5357 3.5357 3.8288 3.8288 4.0762 4.0762 4.1517 4.1517 4.1805 4.1805 4.3866 4.3866 4.5315 4.5315 5.6092 5.6092 5.9390 5.9390 11.4538 11.4538 11.6335 11.6335 11.9760 11.9760 12.9547 12.9547 13.4534 13.4534 13.8680 13.8681 k = 0.1584-0.1445-0.3286 ( 6157 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3273 -19.3273 -16.2539 -16.2539 -16.1366 -16.1366 -12.9895 -12.9895 -12.9543 -12.9543 -12.8923 -12.8923 -12.8537 -12.8537 -5.9702 -5.9702 -4.0938 -4.0938 -4.0173 -4.0173 -2.4405 -2.4405 -2.0424 -2.0424 -0.6097 -0.6097 -0.4203 -0.4203 -0.3377 -0.3377 -0.0958 -0.0958 -0.0242 -0.0242 0.4466 0.4466 3.4643 3.4643 3.5364 3.5364 3.7844 3.7844 4.0579 4.0579 4.1429 4.1429 4.1881 4.1881 4.3889 4.3889 4.5247 4.5247 5.5820 5.5820 5.9100 5.9100 11.4886 11.4886 11.6475 11.6475 11.9989 11.9989 13.0079 13.0079 13.4410 13.4410 13.8716 13.8716 k = 0.1664-0.1518-0.3450 ( 6163 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3252 -19.3252 -16.2519 -16.2519 -16.1372 -16.1372 -13.0001 -13.0001 -12.9573 -12.9573 -12.8927 -12.8927 -12.8548 -12.8548 -5.9682 -5.9682 -4.0916 -4.0916 -4.0122 -4.0122 -2.3954 -2.3954 -2.0188 -2.0188 -0.6442 -0.6442 -0.3925 -0.3925 -0.3525 -0.3525 -0.0859 -0.0859 -0.0072 -0.0072 0.4289 0.4289 3.4542 3.4542 3.5380 3.5380 3.7402 3.7402 4.0372 4.0372 4.1345 4.1345 4.1986 4.1986 4.3912 4.3912 4.5179 4.5179 5.5552 5.5552 5.8808 5.8808 11.5231 11.5231 11.6616 11.6616 12.0188 12.0188 13.0623 13.0623 13.4281 13.4281 13.8529 13.8529 k = 0.1743-0.1590-0.3615 ( 6157 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3231 -19.3231 -16.2497 -16.2497 -16.1379 -16.1379 -13.0108 -13.0108 -12.9601 -12.9601 -12.8930 -12.8930 -12.8559 -12.8559 -5.9661 -5.9661 -4.0893 -4.0893 -4.0073 -4.0073 -2.3495 -2.3495 -1.9942 -1.9942 -0.6802 -0.6802 -0.3848 -0.3848 -0.3482 -0.3482 -0.0754 -0.0754 0.0096 0.0096 0.4113 0.4113 3.4435 3.4435 3.5405 3.5405 3.6967 3.6967 4.0150 4.0150 4.1273 4.1273 4.2097 4.2097 4.3932 4.3932 4.5115 4.5115 5.5289 5.5289 5.8513 5.8513 11.5571 11.5571 11.6756 11.6756 12.0359 12.0359 13.1167 13.1167 13.4145 13.4145 13.8258 13.8258 k = 0.1822-0.1662-0.3779 ( 6155 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3210 -19.3210 -16.2474 -16.2474 -16.1389 -16.1389 -13.0215 -13.0215 -12.9626 -12.9626 -12.8932 -12.8932 -12.8570 -12.8570 -5.9641 -5.9641 -4.0867 -4.0867 -4.0026 -4.0026 -2.3031 -2.3031 -1.9689 -1.9689 -0.7173 -0.7173 -0.4021 -0.4021 -0.3204 -0.3204 -0.0643 -0.0643 0.0260 0.0260 0.3938 0.3938 3.4322 3.4322 3.5440 3.5440 3.6546 3.6546 3.9923 3.9923 4.1209 4.1209 4.2209 4.2209 4.3949 4.3949 4.5054 4.5054 5.5033 5.5033 5.8217 5.8217 11.5902 11.5902 11.6894 11.6894 12.0503 12.0503 13.1699 13.1699 13.4005 13.4005 13.7992 13.7992 k = 0.1901-0.1734-0.3943 ( 6149 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3190 -19.3190 -16.2450 -16.2450 -16.1399 -16.1399 -13.0322 -13.0322 -12.9648 -12.9648 -12.8933 -12.8933 -12.8582 -12.8582 -5.9621 -5.9621 -4.0839 -4.0839 -3.9983 -3.9983 -2.2562 -2.2562 -1.9428 -1.9428 -0.7552 -0.7552 -0.4240 -0.4240 -0.2896 -0.2896 -0.0527 -0.0527 0.0421 0.0421 0.3764 0.3764 3.4204 3.4204 3.5482 3.5482 3.6144 3.6144 3.9696 3.9696 4.1147 4.1147 4.2317 4.2317 4.3962 4.3962 4.4999 4.4999 5.4785 5.4785 5.7921 5.7921 11.6223 11.6223 11.7031 11.7031 12.0624 12.0624 13.2201 13.2201 13.3864 13.3864 13.7753 13.7753 k = 0.1980-0.1807-0.4108 ( 6147 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3170 -19.3170 -16.2425 -16.2425 -16.1412 -16.1412 -13.0428 -13.0428 -12.9666 -12.9666 -12.8933 -12.8933 -12.8594 -12.8594 -5.9602 -5.9602 -4.0810 -4.0810 -3.9942 -3.9942 -2.2089 -2.2089 -1.9161 -1.9161 -0.7938 -0.7938 -0.4478 -0.4478 -0.2587 -0.2587 -0.0406 -0.0406 0.0576 0.0576 0.3592 0.3592 3.4081 3.4081 3.5521 3.5521 3.5777 3.5777 3.9473 3.9473 4.1084 4.1084 4.2419 4.2419 4.3970 4.3970 4.4953 4.4953 5.4548 5.4548 5.7627 5.7627 11.6531 11.6531 11.7165 11.7165 12.0724 12.0724 13.2652 13.2652 13.3735 13.3735 13.7552 13.7552 k = 0.2060-0.1879-0.4272 ( 6139 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3151 -19.3151 -16.2399 -16.2399 -16.1426 -16.1426 -13.0533 -13.0533 -12.9681 -12.9681 -12.8933 -12.8933 -12.8606 -12.8606 -5.9583 -5.9583 -4.0778 -4.0778 -3.9905 -3.9905 -2.1614 -2.1614 -1.8889 -1.8889 -0.8329 -0.8329 -0.4730 -0.4730 -0.2283 -0.2283 -0.0280 -0.0280 0.0724 0.0724 0.3422 0.3422 3.3954 3.3954 3.5359 3.5359 3.5645 3.5645 3.9258 3.9258 4.1018 4.1018 4.2513 4.2513 4.3972 4.3972 4.4917 4.4917 5.4323 5.4323 5.7335 5.7335 11.6823 11.6823 11.7297 11.7297 12.0805 12.0805 13.2996 13.2996 13.3666 13.3666 13.7389 13.7389 k = 0.2139-0.1951-0.4436 ( 6137 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3133 -19.3133 -16.2371 -16.2371 -16.1442 -16.1442 -13.0636 -13.0636 -12.9692 -12.9692 -12.8932 -12.8932 -12.8619 -12.8619 -5.9565 -5.9565 -4.0746 -4.0746 -3.9872 -3.9872 -2.1138 -2.1138 -1.8615 -1.8615 -0.8724 -0.8724 -0.4993 -0.4993 -0.1987 -0.1987 -0.0151 -0.0151 0.0864 0.0864 0.3256 0.3256 3.3827 3.3827 3.5036 3.5036 3.5709 3.5709 3.9053 3.9053 4.0948 4.0948 4.2595 4.2595 4.3971 4.3971 4.4892 4.4892 5.4112 5.4112 5.7047 5.7047 11.7097 11.7097 11.7425 11.7425 12.0870 12.0870 13.3105 13.3105 13.3781 13.3781 13.7266 13.7266 k = 0.2218-0.2023-0.4601 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3116 -19.3116 -16.2342 -16.2342 -16.1460 -16.1460 -13.0736 -13.0736 -12.9699 -12.9699 -12.8931 -12.8931 -12.8631 -12.8631 -5.9548 -5.9548 -4.0711 -4.0711 -3.9842 -3.9842 -2.0662 -2.0662 -1.8340 -1.8340 -0.9124 -0.9124 -0.5265 -0.5265 -0.1702 -0.1702 -0.0018 -0.0018 0.0993 0.0993 0.3094 0.3094 3.3700 3.3700 3.4726 3.4726 3.5794 3.5794 3.8859 3.8859 4.0873 4.0873 4.2663 4.2663 4.3966 4.3966 4.4879 4.4879 5.3916 5.3916 5.6765 5.6765 11.7350 11.7350 11.7550 11.7550 12.0924 12.0924 13.3022 13.3022 13.4037 13.4037 13.7180 13.7180 k = 0.2297-0.2096-0.4765 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3100 -19.3100 -16.2312 -16.2312 -16.1479 -16.1479 -13.0832 -13.0832 -12.9702 -12.9702 -12.8930 -12.8930 -12.8643 -12.8643 -5.9531 -5.9531 -4.0676 -4.0676 -3.9816 -3.9816 -2.0186 -2.0186 -1.8065 -1.8065 -0.9525 -0.9525 -0.5543 -0.5543 -0.1428 -0.1428 0.0116 0.0116 0.1113 0.1113 0.2936 0.2936 3.3576 3.3576 3.4438 3.4438 3.5892 3.5892 3.8677 3.8677 4.0792 4.0792 4.2712 4.2712 4.3963 4.3963 4.4877 4.4877 5.3737 5.3737 5.6490 5.6490 11.7580 11.7580 11.7670 11.7670 12.0968 12.0968 13.2886 13.2886 13.4298 13.4298 13.7130 13.7130 k = 0.2377-0.2168-0.4929 ( 6136 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3084 -19.3084 -16.2281 -16.2281 -16.1501 -16.1501 -13.0926 -13.0926 -12.9701 -12.9701 -12.8929 -12.8929 -12.8655 -12.8655 -5.9515 -5.9515 -4.0640 -4.0640 -3.9794 -3.9794 -1.9714 -1.9714 -1.7792 -1.7792 -0.9927 -0.9927 -0.5825 -0.5825 -0.1169 -0.1169 0.0252 0.0252 0.1220 0.1220 0.2783 0.2783 3.3458 3.3458 3.4172 3.4172 3.5998 3.5998 3.8508 3.8508 4.0707 4.0707 4.2740 4.2740 4.3966 4.3966 4.4886 4.4886 5.3576 5.3576 5.6223 5.6223 11.7779 11.7779 11.7791 11.7791 12.1007 12.1007 13.2741 13.2741 13.4528 13.4528 13.7113 13.7113 k = 0.2456-0.2240-0.5093 ( 6128 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3070 -19.3070 -16.2250 -16.2250 -16.1523 -16.1523 -13.1014 -13.1014 -12.9697 -12.9697 -12.8929 -12.8929 -12.8666 -12.8666 -5.9500 -5.9500 -4.0603 -4.0603 -3.9777 -3.9777 -1.9244 -1.9244 -1.7525 -1.7525 -1.0330 -1.0330 -0.6107 -0.6107 -0.0924 -0.0924 0.0388 0.0388 0.1316 0.1316 0.2635 0.2635 3.3347 3.3347 3.3930 3.3930 3.6113 3.6113 3.8354 3.8354 4.0617 4.0617 4.2744 4.2744 4.3977 4.3977 4.4902 4.4902 5.3435 5.3435 5.5966 5.5966 11.7896 11.7896 11.7960 11.7960 12.1045 12.1045 13.2602 13.2602 13.4717 13.4717 13.7126 13.7126 k = 0.2535-0.2313-0.5258 ( 6128 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3058 -19.3058 -16.2217 -16.2217 -16.1548 -16.1548 -13.1099 -13.1099 -12.9690 -12.9690 -12.8929 -12.8929 -12.8676 -12.8676 -5.9486 -5.9486 -4.0566 -4.0566 -3.9763 -3.9763 -1.8780 -1.8780 -1.7264 -1.7264 -1.0731 -1.0731 -0.6386 -0.6386 -0.0696 -0.0696 0.0524 0.0524 0.1398 0.1398 0.2494 0.2494 3.3240 3.3240 3.3712 3.3712 3.6233 3.6233 3.8214 3.8214 4.0523 4.0523 4.2724 4.2724 4.4000 4.4000 4.4925 4.4925 5.3314 5.3314 5.5720 5.5720 11.8002 11.8002 11.8102 11.8102 12.1083 12.1083 13.2475 13.2475 13.4869 13.4869 13.7165 13.7165 k = 0.2614-0.2385-0.5422 ( 6128 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3046 -19.3046 -16.2183 -16.2183 -16.1574 -16.1574 -13.1178 -13.1178 -12.9680 -12.9680 -12.8930 -12.8930 -12.8684 -12.8684 -5.9474 -5.9474 -4.0528 -4.0528 -3.9754 -3.9754 -1.8322 -1.8322 -1.7012 -1.7012 -1.1131 -1.1131 -0.6660 -0.6660 -0.0486 -0.0486 0.0658 0.0658 0.1468 0.1468 0.2359 0.2359 3.3130 3.3130 3.3527 3.3527 3.6360 3.6360 3.8087 3.8087 4.0428 4.0428 4.2679 4.2679 4.4035 4.4035 4.4954 4.4954 5.3215 5.3215 5.5486 5.5486 11.8102 11.8102 11.8211 11.8211 12.1127 12.1127 13.2365 13.2365 13.4985 13.4985 13.7229 13.7229 k = 0.2693-0.2457-0.5586 ( 6126 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3036 -19.3036 -16.2149 -16.2149 -16.1602 -16.1602 -13.1252 -13.1252 -12.9666 -12.9666 -12.8932 -12.8932 -12.8692 -12.8692 -5.9462 -5.9462 -4.0490 -4.0490 -3.9749 -3.9749 -1.7873 -1.7873 -1.6773 -1.6773 -1.1525 -1.1525 -0.6924 -0.6924 -0.0293 -0.0293 0.0788 0.0788 0.1525 0.1525 0.2232 0.2232 3.3003 3.3003 3.3388 3.3388 3.6490 3.6490 3.7974 3.7974 4.0332 4.0332 4.2614 4.2614 4.4081 4.4081 4.4986 4.4986 5.3139 5.3139 5.5266 5.5266 11.8195 11.8195 11.8286 11.8286 12.1177 12.1177 13.2274 13.2274 13.5069 13.5069 13.7314 13.7314 k = 0.2773-0.2529-0.5751 ( 6128 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3026 -19.3026 -16.2115 -16.2115 -16.1631 -16.1631 -13.1319 -13.1319 -12.9651 -12.9651 -12.8936 -12.8936 -12.8697 -12.8697 -5.9451 -5.9451 -4.0453 -4.0453 -3.9748 -3.9748 -1.7437 -1.7437 -1.6548 -1.6548 -1.1913 -1.1913 -0.7174 -0.7174 -0.0120 -0.0120 0.0913 0.0913 0.1569 0.1569 0.2115 0.2115 3.2851 3.2851 3.3299 3.3299 3.6622 3.6622 3.7873 3.7873 4.0239 4.0239 4.2530 4.2530 4.4136 4.4136 4.5021 4.5021 5.3086 5.3086 5.5061 5.5061 11.8277 11.8277 11.8329 11.8329 12.1236 12.1236 13.2204 13.2204 13.5126 13.5126 13.7419 13.7419 k = 0.2852-0.2602-0.5915 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3019 -19.3019 -16.2080 -16.2080 -16.1662 -16.1662 -13.1381 -13.1381 -12.9634 -12.9634 -12.8941 -12.8941 -12.8700 -12.8700 -5.9442 -5.9442 -4.0416 -4.0416 -3.9751 -3.9751 -1.7016 -1.7016 -1.6341 -1.6341 -1.2289 -1.2289 -0.7406 -0.7406 0.0034 0.0034 0.1030 0.1030 0.1600 0.1600 0.2008 0.2008 3.2682 3.2682 3.3251 3.3251 3.6754 3.6754 3.7783 3.7783 4.0153 4.0153 4.2431 4.2431 4.4200 4.4200 4.5059 4.5059 5.3058 5.3058 5.4871 5.4871 11.8311 11.8311 11.8378 11.8378 12.1304 12.1304 13.2157 13.2157 13.5157 13.5157 13.7540 13.7540 k = 0.2931-0.2674-0.6079 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3012 -19.3012 -16.2044 -16.2044 -16.1694 -16.1694 -13.1436 -13.1436 -12.9616 -12.9616 -12.8947 -12.8947 -12.8700 -12.8700 -5.9433 -5.9433 -4.0380 -4.0380 -3.9757 -3.9757 -1.6620 -1.6620 -1.6154 -1.6154 -1.2647 -1.2647 -0.7616 -0.7616 0.0169 0.0169 0.1137 0.1137 0.1618 0.1618 0.1916 0.1916 3.2508 3.2508 3.3229 3.3229 3.6885 3.6885 3.7700 3.7700 4.0078 4.0078 4.2318 4.2318 4.4270 4.4270 4.5100 4.5100 5.3053 5.3053 5.4698 5.4698 11.8285 11.8285 11.8448 11.8448 12.1379 12.1379 13.2134 13.2134 13.5167 13.5167 13.7673 13.7673 k = 0.3010-0.2746-0.6244 ( 6128 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3006 -19.3006 -16.2009 -16.2009 -16.1726 -16.1726 -13.1484 -13.1484 -12.9597 -12.9597 -12.8956 -12.8956 -12.8697 -12.8697 -5.9426 -5.9426 -4.0345 -4.0345 -3.9766 -3.9766 -1.6260 -1.6260 -1.5989 -1.5989 -1.2974 -1.2974 -0.7800 -0.7800 0.0285 0.0285 0.1228 0.1228 0.1620 0.1620 0.1846 0.1846 3.2333 3.2333 3.3223 3.3223 3.7014 3.7014 3.7622 3.7622 4.0020 4.0020 4.2194 4.2194 4.4347 4.4347 4.5142 4.5142 5.3073 5.3073 5.4542 5.4542 11.8224 11.8224 11.8515 11.8515 12.1462 12.1462 13.2137 13.2137 13.5157 13.5157 13.7812 13.7812 k = 0.3089-0.2818-0.6408 ( 6128 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3002 -19.3002 -16.1973 -16.1973 -16.1760 -16.1760 -13.1525 -13.1525 -12.9579 -12.9579 -12.8968 -12.8968 -12.8690 -12.8690 -5.9420 -5.9420 -4.0312 -4.0312 -3.9778 -3.9778 -1.5969 -1.5969 -1.5841 -1.5841 -1.3247 -1.3247 -0.7954 -0.7954 0.0382 0.0382 0.1294 0.1294 0.1609 0.1609 0.1804 0.1804 3.2162 3.2162 3.3227 3.3227 3.7139 3.7139 3.7542 3.7542 3.9985 3.9985 4.2059 4.2059 4.4430 4.4430 4.5186 4.5186 5.3117 5.3117 5.4403 5.4403 11.8134 11.8134 11.8575 11.8575 12.1550 12.1550 13.2164 13.2164 13.5130 13.5130 13.7930 13.7930 k = 0.3169-0.2891-0.6572 ( 6124 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2999 -19.2999 -16.1938 -16.1938 -16.1794 -16.1794 -13.1560 -13.1560 -12.9562 -12.9562 -12.8981 -12.8981 -12.8679 -12.8679 -5.9415 -5.9415 -4.0282 -4.0282 -3.9791 -3.9791 -1.5798 -1.5798 -1.5695 -1.5695 -1.3431 -1.3431 -0.8074 -0.8074 0.0463 0.0463 0.1322 0.1322 0.1594 0.1594 0.1793 0.1793 3.1997 3.1997 3.3235 3.3235 3.7258 3.7258 3.7458 3.7458 3.9980 3.9980 4.1915 4.1915 4.4520 4.4520 4.5231 4.5231 5.3185 5.3185 5.4282 5.4282 11.8021 11.8021 11.8628 11.8628 12.1641 12.1641 13.2217 13.2217 13.5088 13.5088 13.7937 13.7937 k = 0.3248-0.2963-0.6736 ( 6128 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2996 -19.2996 -16.1903 -16.1903 -16.1828 -16.1828 -13.1587 -13.1587 -12.9546 -12.9546 -12.8998 -12.8998 -12.8664 -12.8664 -5.9410 -5.9410 -4.0255 -4.0255 -3.9805 -3.9805 -1.5723 -1.5723 -1.5625 -1.5625 -1.3478 -1.3478 -0.8158 -0.8158 0.0527 0.0527 0.1309 0.1309 0.1585 0.1585 0.1805 0.1805 3.1839 3.1839 3.3244 3.3244 3.7348 3.7348 3.7384 3.7384 4.0009 4.0009 4.1763 4.1763 4.4616 4.4616 4.5279 4.5279 5.3275 5.3275 5.4177 5.4177 11.7886 11.7886 11.8674 11.8674 12.1733 12.1733 13.2295 13.2295 13.5033 13.5033 13.7736 13.7736 k = 0.3327-0.3035-0.6901 ( 6130 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2995 -19.2995 -16.1871 -16.1871 -16.1861 -16.1861 -13.1606 -13.1606 -12.9532 -12.9532 -12.9017 -12.9017 -12.8644 -12.8644 -5.9407 -5.9407 -4.0233 -4.0233 -3.9818 -3.9818 -1.5758 -1.5758 -1.5630 -1.5630 -1.3374 -1.3374 -0.8204 -0.8204 0.0576 0.0576 0.1269 0.1269 0.1575 0.1575 0.1834 0.1834 3.1688 3.1688 3.3250 3.3250 3.7247 3.7247 3.7480 3.7480 4.0075 4.0075 4.1603 4.1603 4.4717 4.4717 4.5329 4.5329 5.3387 5.3387 5.4090 5.4090 11.7734 11.7734 11.8713 11.8713 12.1825 12.1825 13.2398 13.2398 13.4966 13.4966 13.7430 13.7430 k = 0.3406-0.3107-0.7065 ( 6130 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2995 -19.2995 -16.1899 -16.1899 -16.1834 -16.1834 -13.1619 -13.1619 -12.9521 -12.9521 -12.9040 -12.9040 -12.8619 -12.8619 -5.9405 -5.9405 -4.0218 -4.0218 -3.9828 -3.9828 -1.5945 -1.5945 -1.5631 -1.5631 -1.3156 -1.3156 -0.8212 -0.8212 0.0613 0.0613 0.1217 0.1217 0.1559 0.1559 0.1868 0.1868 3.1546 3.1546 3.3251 3.3251 3.7120 3.7120 3.7578 3.7578 4.0181 4.0181 4.1437 4.1437 4.4825 4.4825 4.5383 4.5383 5.3518 5.3518 5.4019 5.4019 11.7568 11.7568 11.8744 11.8744 12.1915 12.1915 13.2524 13.2524 13.4891 13.4891 13.7098 13.7098 k = 0.3486-0.3180-0.7229 ( 6126 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2995 -19.2995 -16.1934 -16.1934 -16.1800 -16.1800 -13.1624 -13.1624 -12.9512 -12.9512 -12.9065 -12.9065 -12.8590 -12.8590 -5.9404 -5.9404 -4.0210 -4.0210 -3.9833 -3.9833 -1.6210 -1.6210 -1.5651 -1.5651 -1.2871 -1.2871 -0.8184 -0.8184 0.0638 0.0638 0.1161 0.1161 0.1535 0.1535 0.1900 0.1900 3.1412 3.1412 3.3247 3.3247 3.6976 3.6976 3.7669 3.7669 4.0322 4.0322 4.1267 4.1267 4.4935 4.4935 4.5441 4.5441 5.3666 5.3666 5.3966 5.3966 11.7389 11.7389 11.8768 11.8768 12.2003 12.2003 13.2673 13.2673 13.4808 13.4808 13.6759 13.6759 k = 0.3565-0.3252-0.7394 ( 6126 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2997 -19.2997 -16.1968 -16.1968 -16.1768 -16.1768 -13.1622 -13.1622 -12.9506 -12.9506 -12.9094 -12.9094 -12.8558 -12.8558 -5.9404 -5.9404 -4.0212 -4.0212 -3.9832 -3.9832 -1.6512 -1.6512 -1.5696 -1.5696 -1.2553 -1.2553 -0.8122 -0.8122 0.0654 0.0654 0.1103 0.1103 0.1507 0.1507 0.1925 0.1925 3.1287 3.1287 3.3237 3.3237 3.6816 3.6816 3.7751 3.7751 4.0493 4.0493 4.1095 4.1095 4.5047 4.5047 4.5505 4.5505 5.3813 5.3813 5.3945 5.3945 11.7202 11.7202 11.8786 11.8786 12.2087 12.2087 13.2841 13.2841 13.4722 13.4722 13.6423 13.6423 k = 0.6435-0.1045-0.5954 ( 6126 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2997 -19.2997 -16.1968 -16.1968 -16.1768 -16.1768 -13.1622 -13.1622 -12.9506 -12.9506 -12.9094 -12.9094 -12.8557 -12.8557 -5.9404 -5.9404 -4.0212 -4.0212 -3.9832 -3.9832 -1.6512 -1.6512 -1.5696 -1.5696 -1.2553 -1.2553 -0.8122 -0.8122 0.0654 0.0654 0.1103 0.1103 0.1507 0.1507 0.1925 0.1925 3.1288 3.1288 3.3237 3.3237 3.6816 3.6816 3.7751 3.7751 4.0493 4.0493 4.1095 4.1095 4.5047 4.5047 4.5505 4.5505 5.3813 5.3813 5.3945 5.3945 11.7202 11.7202 11.8786 11.8786 12.2087 12.2087 13.2841 13.2841 13.4722 13.4722 13.6423 13.6423 k = 0.6360-0.0874-0.5954 ( 6126 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.2998 -19.2998 -16.2001 -16.2001 -16.1738 -16.1738 -13.1614 -13.1614 -12.9503 -12.9503 -12.9125 -12.9125 -12.8523 -12.8523 -5.9404 -5.9404 -4.0222 -4.0222 -3.9825 -3.9825 -1.6814 -1.6814 -1.5759 -1.5759 -1.2236 -1.2236 -0.8035 -0.8035 0.0662 0.0662 0.1047 0.1047 0.1477 0.1477 0.1939 0.1939 3.1178 3.1178 3.3222 3.3222 3.6651 3.6651 3.7822 3.7822 4.0672 4.0672 4.0940 4.0940 4.5151 4.5151 4.5575 4.5575 5.3861 5.3861 5.4044 5.4044 11.7018 11.7018 11.8796 11.8796 12.2162 12.2162 13.3015 13.3015 13.4639 13.4639 13.6109 13.6109 k = 0.6284-0.0703-0.5954 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3001 -19.3001 -16.2033 -16.2033 -16.1709 -16.1709 -13.1599 -13.1599 -12.9501 -12.9501 -12.9159 -12.9159 -12.8486 -12.8486 -5.9405 -5.9405 -4.0240 -4.0240 -3.9813 -3.9813 -1.7121 -1.7121 -1.5838 -1.5838 -1.1915 -1.1915 -0.7923 -0.7923 0.0664 0.0664 0.0989 0.0989 0.1446 0.1446 0.1943 0.1943 3.1076 3.1076 3.3203 3.3203 3.6476 3.6476 3.7886 3.7886 4.0711 4.0711 4.0942 4.0942 4.5247 4.5247 4.5656 4.5656 5.3853 5.3853 5.4220 5.4220 11.6830 11.6830 11.8801 11.8801 12.2233 12.2233 13.3196 13.3196 13.4564 13.4564 13.5805 13.5805 k = 0.6209-0.0532-0.5954 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3004 -19.3004 -16.2064 -16.2064 -16.1681 -16.1681 -13.1579 -13.1579 -12.9501 -12.9501 -12.9196 -12.9196 -12.8446 -12.8446 -5.9406 -5.9406 -4.0263 -4.0263 -3.9797 -3.9797 -1.7427 -1.7427 -1.5930 -1.5930 -1.1594 -1.1594 -0.7791 -0.7791 0.0662 0.0662 0.0929 0.0929 0.1415 0.1415 0.1935 0.1935 3.0984 3.0984 3.3180 3.3180 3.6294 3.6294 3.7943 3.7943 4.0559 4.0559 4.1150 4.1150 4.5333 4.5333 4.5751 4.5751 5.3847 5.3847 5.4414 5.4414 11.6640 11.6640 11.8800 11.8800 12.2299 12.2299 13.3370 13.3370 13.4509 13.4509 13.5516 13.5516 k = 0.6133-0.0361-0.5954 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3007 -19.3007 -16.2094 -16.2094 -16.1654 -16.1654 -13.1553 -13.1553 -12.9503 -12.9503 -12.9236 -12.9236 -12.8406 -12.8406 -5.9408 -5.9408 -4.0291 -4.0291 -3.9777 -3.9777 -1.7727 -1.7727 -1.6032 -1.6032 -1.1279 -1.1279 -0.7642 -0.7642 0.0656 0.0656 0.0865 0.0865 0.1387 0.1387 0.1916 0.1916 3.0900 3.0900 3.3155 3.3155 3.6106 3.6106 3.7994 3.7994 4.0393 4.0393 4.1384 4.1384 4.5408 4.5408 4.5859 4.5859 5.3847 5.3847 5.4616 5.4616 11.6451 11.6451 11.8795 11.8795 12.2360 12.2360 13.3509 13.3509 13.4500 13.4500 13.5244 13.5244 k = 0.6058-0.0190-0.5954 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3010 -19.3010 -16.2124 -16.2124 -16.1628 -16.1628 -13.1522 -13.1522 -12.9506 -12.9506 -12.9278 -12.9278 -12.8364 -12.8364 -5.9411 -5.9411 -4.0323 -4.0323 -3.9756 -3.9756 -1.8019 -1.8019 -1.6139 -1.6139 -1.0971 -1.0971 -0.7480 -0.7480 0.0646 0.0646 0.0799 0.0799 0.1361 0.1361 0.1887 0.1887 3.0825 3.0825 3.3129 3.3129 3.5915 3.5915 3.8038 3.8038 4.0227 4.0227 4.1626 4.1626 4.5471 4.5471 4.5978 4.5978 5.3855 5.3855 5.4824 5.4824 11.6264 11.6264 11.8786 11.8786 12.2414 12.2414 13.3574 13.3574 13.4571 13.4571 13.4996 13.4996 k = 0.5982-0.0018-0.5954 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3014 -19.3014 -16.2152 -16.2152 -16.1604 -16.1604 -13.1486 -13.1486 -12.9510 -12.9510 -12.9324 -12.9324 -12.8323 -12.8323 -5.9414 -5.9414 -4.0355 -4.0355 -3.9734 -3.9734 -1.8299 -1.8299 -1.6249 -1.6249 -1.0673 -1.0673 -0.7308 -0.7308 0.0631 0.0631 0.0734 0.0734 0.1339 0.1339 0.1847 0.1847 3.0758 3.0758 3.3103 3.3103 3.5723 3.5723 3.8078 3.8078 4.0064 4.0064 4.1870 4.1870 4.5525 4.5525 4.6103 4.6103 5.3868 5.3868 5.5035 5.5035 11.6082 11.6082 11.8774 11.8774 12.2463 12.2463 13.3552 13.3552 13.4710 13.4710 13.4802 13.4802 k = 0.5906 0.0153-0.5954 ( 6146 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3017 -19.3017 -16.2178 -16.2178 -16.1582 -16.1582 -13.1446 -13.1446 -12.9515 -12.9515 -12.9371 -12.9371 -12.8282 -12.8282 -5.9416 -5.9416 -4.0389 -4.0389 -3.9711 -3.9711 -1.8566 -1.8566 -1.6359 -1.6359 -1.0385 -1.0385 -0.7131 -0.7131 0.0597 0.0597 0.0683 0.0683 0.1321 0.1321 0.1798 0.1798 3.0700 3.0700 3.3079 3.3079 3.5531 3.5531 3.8113 3.8113 3.9906 3.9906 4.2111 4.2111 4.5573 4.5573 4.6231 4.6231 5.3886 5.3886 5.5245 5.5245 11.5905 11.5905 11.8759 11.8759 12.2506 12.2506 13.3462 13.3462 13.4565 13.4565 13.4993 13.4993 k = 0.5831 0.0324-0.5954 ( 6150 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3021 -19.3021 -16.2203 -16.2203 -16.1561 -16.1561 -13.1402 -13.1402 -12.9521 -12.9521 -12.9421 -12.9421 -12.8242 -12.8242 -5.9420 -5.9420 -4.0423 -4.0423 -3.9689 -3.9689 -1.8819 -1.8819 -1.6467 -1.6467 -1.0111 -1.0111 -0.6952 -0.6952 0.0534 0.0534 0.0658 0.0658 0.1307 0.1307 0.1741 0.1741 3.0649 3.0649 3.3059 3.3059 3.5341 3.5341 3.8144 3.8144 3.9755 3.9755 4.2344 4.2344 4.5615 4.5615 4.6358 4.6358 5.3908 5.3908 5.5451 5.5451 11.5736 11.5736 11.8741 11.8741 12.2543 12.2543 13.3332 13.3332 13.4399 13.4399 13.5282 13.5282 k = 0.5755 0.0495-0.5954 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3025 -19.3025 -16.2226 -16.2226 -16.1541 -16.1541 -13.1355 -13.1355 -12.9527 -12.9527 -12.9472 -12.9472 -12.8203 -12.8203 -5.9423 -5.9423 -4.0456 -4.0456 -3.9667 -3.9667 -1.9055 -1.9055 -1.6571 -1.6571 -0.9852 -0.9852 -0.6773 -0.6773 0.0456 0.0456 0.0646 0.0646 0.1296 0.1296 0.1677 0.1677 3.0605 3.0605 3.3042 3.3042 3.5155 3.5155 3.8171 3.8171 3.9611 3.9611 4.2568 4.2568 4.5653 4.5653 4.6482 4.6482 5.3933 5.3933 5.5652 5.5652 11.5576 11.5576 11.8723 11.8723 12.2574 12.2574 13.3182 13.3182 13.4257 13.4257 13.5605 13.5605 k = 0.5680 0.0666-0.5954 ( 6146 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3028 -19.3028 -16.2248 -16.2248 -16.1524 -16.1524 -13.1306 -13.1306 -12.9540 -12.9540 -12.9517 -12.9517 -12.8167 -12.8167 -5.9426 -5.9426 -4.0487 -4.0487 -3.9646 -3.9646 -1.9272 -1.9272 -1.6669 -1.6669 -0.9609 -0.9609 -0.6599 -0.6599 0.0374 0.0374 0.0640 0.0640 0.1289 0.1289 0.1608 0.1608 3.0569 3.0569 3.3031 3.3031 3.4974 3.4974 3.8196 3.8196 3.9476 3.9476 4.2779 4.2779 4.5686 4.5686 4.6600 4.6600 5.3959 5.3959 5.5843 5.5843 11.5427 11.5427 11.8703 11.8703 12.2600 12.2600 13.3024 13.3024 13.4138 13.4138 13.5951 13.5951 k = 0.5604 0.0837-0.5954 ( 6152 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3032 -19.3032 -16.2267 -16.2267 -16.1508 -16.1508 -13.1256 -13.1256 -12.9582 -12.9582 -12.9532 -12.9532 -12.8134 -12.8134 -5.9429 -5.9429 -4.0517 -4.0517 -3.9627 -3.9627 -1.9471 -1.9471 -1.6760 -1.6760 -0.9385 -0.9385 -0.6431 -0.6431 0.0291 0.0291 0.0636 0.0636 0.1283 0.1283 0.1536 0.1536 3.0538 3.0538 3.3025 3.3025 3.4801 3.4801 3.8217 3.8217 3.9350 3.9350 4.2973 4.2973 4.5716 4.5716 4.6710 4.6710 5.3986 5.3986 5.6023 5.6023 11.5289 11.5289 11.8683 11.8683 12.2621 12.2621 13.2867 13.2867 13.4037 13.4037 13.6316 13.6316 k = 0.5529 0.1009-0.5954 ( 6152 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3035 -19.3035 -16.2285 -16.2285 -16.1493 -16.1493 -13.1205 -13.1205 -12.9633 -12.9633 -12.9538 -12.9538 -12.8103 -12.8103 -5.9432 -5.9432 -4.0544 -4.0544 -3.9609 -3.9609 -1.9649 -1.9649 -1.6842 -1.6842 -0.9180 -0.9180 -0.6274 -0.6274 0.0211 0.0211 0.0634 0.0634 0.1279 0.1279 0.1465 0.1465 3.0513 3.0513 3.3027 3.3027 3.4636 3.4636 3.8237 3.8237 3.9236 3.9236 4.3150 4.3150 4.5743 4.5743 4.6811 4.6811 5.4012 5.4012 5.6189 5.6189 11.5165 11.5165 11.8664 11.8664 12.2638 12.2638 13.2718 13.2718 13.3952 13.3952 13.6695 13.6695 k = 0.5453 0.1180-0.5954 ( 6158 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3038 -19.3038 -16.2300 -16.2300 -16.1481 -16.1481 -13.1156 -13.1156 -12.9684 -12.9684 -12.9543 -12.9543 -12.8076 -12.8076 -5.9434 -5.9434 -4.0568 -4.0568 -3.9594 -3.9594 -1.9806 -1.9806 -1.6915 -1.6915 -0.8998 -0.8998 -0.6130 -0.6130 0.0136 0.0136 0.0635 0.0635 0.1275 0.1275 0.1396 0.1396 3.0493 3.0493 3.3035 3.3035 3.4481 3.4481 3.8256 3.8256 3.9134 3.9134 4.3307 4.3307 4.5767 4.5767 4.6900 4.6900 5.4037 5.4037 5.6338 5.6338 11.5055 11.5055 11.8647 11.8647 12.2651 12.2651 13.2583 13.2583 13.3881 13.3881 13.7085 13.7085 k = 0.5378 0.1351-0.5954 ( 6166 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3040 -19.3040 -16.2313 -16.2313 -16.1470 -16.1470 -13.1109 -13.1109 -12.9731 -12.9731 -12.9548 -12.9548 -12.8052 -12.8052 -5.9437 -5.9437 -4.0589 -4.0589 -3.9580 -3.9580 -1.9941 -1.9941 -1.6978 -1.6978 -0.8839 -0.8839 -0.6002 -0.6002 0.0068 0.0068 0.0638 0.0638 0.1266 0.1266 0.1336 0.1336 3.0477 3.0477 3.3049 3.3049 3.4340 3.4340 3.8272 3.8272 3.9044 3.9044 4.3442 4.3442 4.5787 4.5787 4.6978 4.6978 5.4059 5.4059 5.6468 5.6468 11.4960 11.4960 11.8631 11.8631 12.2661 12.2661 13.2463 13.2463 13.3822 13.3822 13.7480 13.7480 k = 0.5302 0.1522-0.5954 ( 6164 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3042 -19.3042 -16.2324 -16.2324 -16.1462 -16.1462 -13.1066 -13.1066 -12.9774 -12.9774 -12.9551 -12.9551 -12.8032 -12.8032 -5.9439 -5.9439 -4.0607 -4.0607 -3.9568 -3.9568 -2.0052 -2.0052 -1.7030 -1.7030 -0.8707 -0.8707 -0.5893 -0.5893 0.0009 0.0009 0.0642 0.0642 0.1239 0.1239 0.1302 0.1302 3.0465 3.0465 3.3068 3.3068 3.4214 3.4214 3.8288 3.8288 3.8967 3.8967 4.3554 4.3554 4.5803 4.5803 4.7044 4.7044 5.4079 5.4079 5.6577 5.6577 11.4882 11.4882 11.8617 11.8617 12.2668 12.2668 13.2363 13.2363 13.3775 13.3775 13.7875 13.7875 k = 0.5227 0.1693-0.5954 ( 6164 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3044 -19.3044 -16.2333 -16.2333 -16.1455 -16.1455 -13.1029 -13.1029 -12.9811 -12.9811 -12.9554 -12.9554 -12.8017 -12.8017 -5.9440 -5.9440 -4.0621 -4.0621 -3.9559 -3.9559 -2.0139 -2.0139 -1.7071 -1.7071 -0.8601 -0.8601 -0.5805 -0.5805 -0.0039 -0.0039 0.0646 0.0646 0.1196 0.1196 0.1293 0.1293 3.0457 3.0457 3.3090 3.3090 3.4108 3.4108 3.8301 3.8301 3.8906 3.8906 4.3642 4.3642 4.5816 4.5816 4.7095 4.7095 5.4095 5.4095 5.6664 5.6664 11.4820 11.4820 11.8606 11.8606 12.2673 12.2673 13.2283 13.2283 13.3740 13.3740 13.8260 13.8260 k = 0.5151 0.1864-0.5954 ( 6160 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3045 -19.3045 -16.2339 -16.2339 -16.1450 -16.1450 -13.1001 -13.1001 -12.9839 -12.9839 -12.9556 -12.9556 -12.8006 -12.8006 -5.9441 -5.9441 -4.0631 -4.0631 -3.9553 -3.9553 -2.0201 -2.0201 -1.7101 -1.7101 -0.8525 -0.8525 -0.5741 -0.5741 -0.0075 -0.0075 0.0651 0.0651 0.1159 0.1159 0.1290 0.1290 3.0451 3.0451 3.3112 3.3112 3.4026 3.4026 3.8312 3.8312 3.8860 3.8860 4.3706 4.3706 4.5825 4.5825 4.7132 4.7132 5.4107 5.4107 5.6727 5.6727 11.4775 11.4775 11.8598 11.8598 12.2676 12.2676 13.2225 13.2225 13.3714 13.3714 13.8614 13.8614 k = 0.5076 0.2036-0.5954 ( 6154 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3046 -19.3046 -16.2343 -16.2343 -16.1447 -16.1447 -13.0983 -13.0983 -12.9857 -12.9857 -12.9557 -12.9557 -12.7999 -12.7999 -5.9442 -5.9442 -4.0638 -4.0638 -3.9549 -3.9549 -2.0239 -2.0239 -1.7119 -1.7119 -0.8478 -0.8478 -0.5702 -0.5702 -0.0097 -0.0097 0.0655 0.0655 0.1135 0.1135 0.1290 0.1290 3.0447 3.0447 3.3128 3.3128 3.3973 3.3973 3.8319 3.8319 3.8832 3.8832 4.3744 4.3744 4.5831 4.5831 4.7154 4.7154 5.4114 5.4114 5.6765 5.6765 11.4748 11.4748 11.8593 11.8593 12.2677 12.2677 13.2190 13.2190 13.3699 13.3699 13.8893 13.8893 k = 0.5000 0.2207-0.5954 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3046 -19.3046 -16.2344 -16.2344 -16.1446 -16.1446 -13.0977 -13.0977 -12.9863 -12.9863 -12.9557 -12.9557 -12.7997 -12.7997 -5.9442 -5.9442 -4.0640 -4.0640 -3.9547 -3.9547 -2.0252 -2.0252 -1.7124 -1.7124 -0.8463 -0.8463 -0.5688 -0.5688 -0.0104 -0.0104 0.0656 0.0656 0.1127 0.1127 0.1290 0.1290 3.0446 3.0446 3.3134 3.3134 3.3955 3.3955 3.8321 3.8321 3.8823 3.8823 4.3757 4.3757 4.5833 4.5833 4.7162 4.7162 5.4117 5.4117 5.6778 5.6778 11.4739 11.4739 11.8591 11.8591 12.2678 12.2678 13.2178 13.2178 13.3694 13.3694 13.9007 13.9007 k = 0.5000 0.2207-0.5954 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3046 -19.3046 -16.2344 -16.2344 -16.1446 -16.1446 -13.0977 -13.0977 -12.9863 -12.9863 -12.9557 -12.9557 -12.7997 -12.7997 -5.9442 -5.9442 -4.0640 -4.0640 -3.9547 -3.9547 -2.0252 -2.0252 -1.7124 -1.7124 -0.8463 -0.8463 -0.5688 -0.5688 -0.0104 -0.0104 0.0656 0.0656 0.1127 0.1127 0.1290 0.1290 3.0446 3.0446 3.3134 3.3134 3.3955 3.3955 3.8321 3.8321 3.8823 3.8823 4.3757 4.3757 4.5833 4.5833 4.7162 4.7162 5.4117 5.4117 5.6778 5.6778 11.4739 11.4739 11.8591 11.8591 12.2678 12.2678 13.2178 13.2178 13.3694 13.3694 13.9007 13.9007 k = 0.5130 0.2264-0.5823 ( 6155 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3046 -19.3046 -16.2343 -16.2343 -16.1448 -16.1448 -13.0978 -13.0978 -12.9862 -12.9862 -12.9555 -12.9555 -12.7998 -12.7998 -5.9443 -5.9443 -4.0640 -4.0640 -3.9548 -3.9548 -2.0264 -2.0264 -1.7120 -1.7120 -0.8459 -0.8459 -0.5684 -0.5684 -0.0106 -0.0106 0.0649 0.0649 0.1126 0.1126 0.1290 0.1290 3.0453 3.0453 3.3137 3.3137 3.3957 3.3957 3.8326 3.8326 3.8832 3.8832 4.3748 4.3748 4.5827 4.5827 4.7166 4.7166 5.4117 5.4117 5.6777 5.6777 11.4734 11.4734 11.8555 11.8555 12.2713 12.2713 13.2174 13.2174 13.3609 13.3609 13.9131 13.9131 k = 0.5261 0.2322-0.5692 ( 6154 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3047 -19.3047 -16.2339 -16.2339 -16.1452 -16.1452 -13.0982 -13.0982 -12.9858 -12.9858 -12.9547 -12.9547 -12.8001 -12.8001 -5.9443 -5.9443 -4.0641 -4.0641 -3.9549 -3.9549 -2.0300 -2.0300 -1.7107 -1.7107 -0.8448 -0.8448 -0.5672 -0.5672 -0.0113 -0.0113 0.0628 0.0628 0.1126 0.1126 0.1292 0.1292 3.0475 3.0475 3.3146 3.3146 3.3965 3.3965 3.8341 3.8341 3.8860 3.8860 4.3722 4.3722 4.5811 4.5811 4.7176 4.7176 5.4116 5.4116 5.6774 5.6774 11.4717 11.4717 11.8450 11.8450 12.2815 12.2815 13.2159 13.2159 13.3382 13.3382 13.9476 13.9476 k = 0.5391 0.2379-0.5561 ( 6154 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3047 -19.3047 -16.2334 -16.2334 -16.1459 -16.1459 -13.0987 -13.0987 -12.9852 -12.9852 -12.9535 -12.9535 -12.8006 -12.8006 -5.9445 -5.9445 -4.0643 -4.0643 -3.9550 -3.9550 -2.0358 -2.0358 -1.7087 -1.7087 -0.8429 -0.8429 -0.5653 -0.5653 -0.0124 -0.0124 0.0594 0.0594 0.1125 0.1125 0.1293 0.1293 3.0510 3.0510 3.3161 3.3161 3.3979 3.3979 3.8366 3.8366 3.8905 3.8905 4.3678 4.3678 4.5785 4.5785 4.7193 4.7193 5.4116 5.4116 5.6768 5.6768 11.4689 11.4689 11.8288 11.8288 12.2971 12.2971 13.2118 13.2118 13.3078 13.3078 13.9961 13.9961 k = 0.5522 0.2437-0.5430 ( 6159 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3049 -19.3049 -16.2326 -16.2326 -16.1469 -16.1469 -13.0993 -13.0993 -12.9844 -12.9844 -12.9518 -12.9518 -12.8014 -12.8014 -5.9446 -5.9446 -4.0646 -4.0646 -3.9553 -3.9553 -2.0438 -2.0438 -1.7061 -1.7061 -0.8403 -0.8403 -0.5625 -0.5625 -0.0140 -0.0140 0.0550 0.0550 0.1123 0.1123 0.1294 0.1294 3.0558 3.0558 3.3183 3.3183 3.3999 3.3999 3.8399 3.8399 3.8968 3.8968 4.3619 4.3619 4.5748 4.5748 4.7214 4.7214 5.4118 5.4118 5.6760 5.6760 11.4650 11.4650 11.8082 11.8082 12.3166 12.3166 13.2009 13.2009 13.2790 13.2790 14.0298 14.0298 k = 0.5652 0.2495-0.5299 ( 6159 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3050 -19.3050 -16.2316 -16.2316 -16.1481 -16.1481 -13.1001 -13.1001 -12.9833 -12.9833 -12.9498 -12.9498 -12.8023 -12.8023 -5.9448 -5.9448 -4.0650 -4.0650 -3.9556 -3.9556 -2.0535 -2.0535 -1.7032 -1.7032 -0.8370 -0.8370 -0.5591 -0.5591 -0.0160 -0.0160 0.0496 0.0496 0.1120 0.1120 0.1293 0.1293 3.0620 3.0620 3.3211 3.3211 3.4026 3.4026 3.8439 3.8439 3.9047 3.9047 4.3544 4.3544 4.5703 4.5703 4.7238 4.7238 5.4121 5.4121 5.6750 5.6750 11.4601 11.4601 11.7847 11.7847 12.3385 12.3385 13.1773 13.1773 13.2611 13.2611 14.0329 14.0329 k = 0.5783 0.2552-0.5168 ( 6153 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3052 -19.3052 -16.2304 -16.2304 -16.1496 -16.1496 -13.1010 -13.1010 -12.9820 -12.9820 -12.9474 -12.9474 -12.8035 -12.8035 -5.9451 -5.9451 -4.0655 -4.0655 -3.9559 -3.9559 -2.0648 -2.0648 -1.7003 -1.7003 -0.8330 -0.8330 -0.5550 -0.5550 -0.0183 -0.0183 0.0434 0.0434 0.1116 0.1116 0.1290 0.1290 3.0694 3.0694 3.3245 3.3245 3.4060 3.4060 3.8485 3.8485 3.9143 3.9143 4.3455 4.3455 4.5650 4.5650 4.7263 4.7263 5.4128 5.4128 5.6737 5.6737 11.4543 11.4543 11.7594 11.7594 12.3615 12.3615 13.1431 13.1431 13.2546 13.2546 14.0300 14.0300 k = 0.5913 0.2610-0.5037 ( 6155 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3055 -19.3055 -16.2290 -16.2290 -16.1513 -16.1513 -13.1019 -13.1019 -12.9805 -12.9805 -12.9446 -12.9446 -12.8048 -12.8048 -5.9454 -5.9454 -4.0661 -4.0661 -3.9563 -3.9563 -2.0774 -2.0774 -1.6976 -1.6976 -0.8283 -0.8283 -0.5504 -0.5504 -0.0210 -0.0210 0.0367 0.0367 0.1110 0.1110 0.1284 0.1284 3.0780 3.0780 3.3286 3.3286 3.4104 3.4104 3.8535 3.8535 3.9254 3.9254 4.3354 4.3354 4.5590 4.5590 4.7287 4.7287 5.4139 5.4139 5.6722 5.6722 11.4475 11.4475 11.7333 11.7333 12.3842 12.3842 13.1056 13.1056 13.2539 13.2539 14.0254 14.0254 k = 0.6044 0.2667-0.4906 ( 6152 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3057 -19.3057 -16.2275 -16.2275 -16.1533 -16.1533 -13.1027 -13.1027 -12.9787 -12.9787 -12.9417 -12.9417 -12.8063 -12.8063 -5.9458 -5.9458 -4.0667 -4.0667 -3.9568 -3.9568 -2.0911 -2.0911 -1.6952 -1.6952 -0.8229 -0.8229 -0.5452 -0.5452 -0.0240 -0.0240 0.0295 0.0295 0.1103 0.1103 0.1277 0.1277 3.0876 3.0876 3.3334 3.3334 3.4156 3.4156 3.8587 3.8587 3.9378 3.9378 4.3241 4.3241 4.5524 4.5524 4.7308 4.7308 5.4157 5.4157 5.6704 5.6704 11.4399 11.4399 11.7071 11.7071 12.4058 12.4058 13.0689 13.0689 13.2561 13.2561 14.0199 14.0199 k = 0.6174 0.2725-0.4775 ( 6151 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3060 -19.3060 -16.2257 -16.2257 -16.1554 -16.1554 -13.1035 -13.1035 -12.9768 -12.9768 -12.9386 -12.9386 -12.8081 -12.8081 -5.9462 -5.9462 -4.0675 -4.0675 -3.9573 -3.9573 -2.1057 -2.1057 -1.6935 -1.6935 -0.8169 -0.8169 -0.5396 -0.5396 -0.0274 -0.0274 0.0219 0.0219 0.1094 0.1094 0.1268 0.1268 3.0982 3.0982 3.3389 3.3389 3.4219 3.4219 3.8639 3.8639 3.9515 3.9515 4.3119 4.3119 4.5455 4.5455 4.7323 4.7323 5.4182 5.4182 5.6684 5.6684 11.4316 11.4316 11.6814 11.6814 12.4250 12.4250 13.0352 13.0352 13.2600 13.2600 14.0137 14.0137 k = 0.6305 0.2783-0.4644 ( 6143 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3064 -19.3064 -16.2238 -16.2238 -16.1577 -16.1577 -13.1042 -13.1042 -12.9746 -12.9746 -12.9353 -12.9353 -12.8100 -12.8100 -5.9467 -5.9467 -4.0683 -4.0683 -3.9578 -3.9578 -2.1209 -2.1209 -1.6925 -1.6925 -0.8103 -0.8103 -0.5336 -0.5336 -0.0310 -0.0310 0.0140 0.0140 0.1082 0.1082 0.1258 0.1258 3.1098 3.1098 3.3451 3.3451 3.4293 3.4293 3.8689 3.8689 3.9665 3.9665 4.2987 4.2987 4.5384 4.5384 4.7331 4.7331 5.4217 5.4217 5.6662 5.6662 11.4225 11.4225 11.6568 11.6568 12.4410 12.4410 13.0056 13.0056 13.2652 13.2652 14.0071 14.0071 k = 0.6435 0.2840-0.4513 ( 6147 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3067 -19.3067 -16.2218 -16.2218 -16.1602 -16.1602 -13.1047 -13.1047 -12.9722 -12.9722 -12.9320 -12.9320 -12.8121 -12.8121 -5.9472 -5.9472 -4.0693 -4.0693 -3.9584 -3.9584 -2.1366 -2.1366 -1.6925 -1.6925 -0.8032 -0.8032 -0.5274 -0.5274 -0.0348 -0.0348 0.0058 0.0058 0.1069 0.1069 0.1249 0.1249 3.1222 3.1222 3.3520 3.3520 3.4379 3.4379 3.8734 3.8734 3.9824 3.9824 4.2848 4.2848 4.5311 4.5311 4.7330 4.7330 5.4262 5.4262 5.6638 5.6638 11.4127 11.4127 11.6337 11.6337 12.4529 12.4529 12.9811 12.9811 13.2715 13.2715 14.0001 14.0001 k = 0.6435 0.2840-0.4513 ( 6147 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3067 -19.3067 -16.2218 -16.2218 -16.1602 -16.1602 -13.1047 -13.1047 -12.9722 -12.9722 -12.9320 -12.9320 -12.8121 -12.8121 -5.9472 -5.9472 -4.0693 -4.0693 -3.9584 -3.9584 -2.1366 -2.1366 -1.6925 -1.6925 -0.8032 -0.8032 -0.5274 -0.5274 -0.0348 -0.0348 0.0058 0.0058 0.1069 0.1069 0.1249 0.1249 3.1222 3.1222 3.3520 3.3520 3.4379 3.4379 3.8734 3.8734 3.9824 3.9824 4.2848 4.2848 4.5311 4.5311 4.7330 4.7330 5.4262 5.4262 5.6638 5.6638 11.4127 11.4127 11.6337 11.6337 12.4529 12.4529 12.9811 12.9811 13.2715 13.2715 14.0001 14.0001 k = 0.6390 0.2820-0.4327 ( 6149 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3076 -19.3076 -16.2214 -16.2214 -16.1616 -16.1616 -13.1031 -13.1031 -12.9714 -12.9714 -12.9276 -12.9276 -12.8121 -12.8121 -5.9478 -5.9478 -4.0695 -4.0695 -3.9606 -3.9606 -2.1698 -2.1698 -1.7000 -1.7000 -0.7884 -0.7884 -0.5088 -0.5088 -0.0433 -0.0433 0.0031 0.0031 0.1025 0.1025 0.1192 0.1192 3.1253 3.1253 3.3562 3.3562 3.4573 3.4573 3.8803 3.8803 3.9882 3.9882 4.2761 4.2761 4.5339 4.5339 4.7414 4.7414 5.4395 5.4395 5.6679 5.6679 11.3851 11.3851 11.5951 11.5951 12.4793 12.4793 12.9813 12.9813 13.2700 13.2700 13.9869 13.9869 k = 0.6346 0.2800-0.4141 ( 6150 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3086 -19.3086 -16.2215 -16.2215 -16.1627 -16.1627 -13.1008 -13.1008 -12.9704 -12.9704 -12.9229 -12.9229 -12.8121 -12.8121 -5.9486 -5.9486 -4.0698 -4.0698 -3.9632 -3.9632 -2.2045 -2.2045 -1.7119 -1.7119 -0.7719 -0.7719 -0.4882 -0.4882 -0.0534 -0.0534 0.0003 0.0003 0.0967 0.0967 0.1146 0.1146 3.1300 3.1300 3.3607 3.3607 3.4794 3.4794 3.8872 3.8872 3.9942 3.9942 4.2672 4.2672 4.5371 4.5371 4.7501 4.7501 5.4549 5.4549 5.6735 5.6735 11.3557 11.3557 11.5546 11.5546 12.5056 12.5056 12.9838 12.9838 13.2692 13.2692 13.9717 13.9717 k = 0.6301 0.2781-0.3955 ( 6150 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3097 -19.3097 -16.2222 -16.2222 -16.1633 -16.1633 -13.0978 -13.0978 -12.9693 -12.9693 -12.9180 -12.9180 -12.8121 -12.8121 -5.9495 -5.9495 -4.0703 -4.0703 -3.9661 -3.9661 -2.2402 -2.2402 -1.7277 -1.7277 -0.7541 -0.7541 -0.4662 -0.4662 -0.0651 -0.0651 -0.0025 -0.0025 0.0899 0.0899 0.1109 0.1109 3.1363 3.1363 3.3657 3.3657 3.5040 3.5040 3.8943 3.8943 4.0005 4.0005 4.2583 4.2583 4.5409 4.5409 4.7588 4.7588 5.4725 5.4725 5.6805 5.6805 11.3246 11.3246 11.5126 11.5126 12.5315 12.5315 12.9884 12.9884 13.2691 13.2691 13.9547 13.9547 k = 0.6256 0.2761-0.3769 ( 6154 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3109 -19.3109 -16.2233 -16.2233 -16.1636 -16.1636 -13.0942 -13.0942 -12.9680 -12.9680 -12.9130 -12.9130 -12.8122 -12.8122 -5.9505 -5.9505 -4.0709 -4.0709 -3.9694 -3.9694 -2.2768 -2.2768 -1.7471 -1.7471 -0.7352 -0.7352 -0.4431 -0.4431 -0.0783 -0.0783 -0.0050 -0.0050 0.0823 0.0823 0.1078 0.1078 3.1442 3.1442 3.3710 3.3710 3.5307 3.5307 3.9014 3.9014 4.0067 4.0067 4.2493 4.2493 4.5453 4.5453 4.7678 4.7678 5.4921 5.4921 5.6889 5.6889 11.2919 11.2919 11.4695 11.4695 12.5570 12.5570 12.9952 12.9952 13.2696 13.2696 13.9359 13.9359 k = 0.6211 0.2741-0.3583 ( 6162 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3123 -19.3123 -16.2250 -16.2250 -16.1634 -16.1634 -13.0899 -13.0899 -12.9666 -12.9666 -12.9078 -12.9078 -12.8122 -12.8122 -5.9517 -5.9517 -4.0716 -4.0716 -3.9730 -3.9730 -2.3137 -2.3137 -1.7696 -1.7696 -0.7155 -0.7155 -0.4193 -0.4193 -0.0927 -0.0927 -0.0071 -0.0071 0.0743 0.0743 0.1050 0.1050 3.1535 3.1535 3.3765 3.3765 3.5589 3.5589 3.9086 3.9086 4.0130 4.0130 4.2402 4.2402 4.5505 4.5505 4.7768 4.7768 5.5137 5.5137 5.6986 5.6986 11.2575 11.2575 11.4255 11.4255 12.5820 12.5820 13.0041 13.0041 13.2709 13.2709 13.9156 13.9156 k = 0.6166 0.2721-0.3397 ( 6160 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3137 -19.3137 -16.2272 -16.2272 -16.1627 -16.1627 -13.0850 -13.0850 -12.9651 -12.9651 -12.9025 -12.9025 -12.8123 -12.8123 -5.9529 -5.9529 -4.0725 -4.0725 -3.9769 -3.9769 -2.3509 -2.3509 -1.7948 -1.7948 -0.6955 -0.6955 -0.3951 -0.3951 -0.1082 -0.1082 -0.0089 -0.0089 0.0661 0.0661 0.1023 0.1023 3.1642 3.1642 3.3823 3.3823 3.5884 3.5884 3.9159 3.9159 4.0190 4.0190 4.2312 4.2312 4.5567 4.5567 4.7859 4.7859 5.5373 5.5373 5.7097 5.7097 11.2216 11.2216 11.3810 11.3810 12.6064 12.6064 13.0151 13.0151 13.2730 13.2730 13.8940 13.8940 k = 0.6121 0.2702-0.3211 ( 6159 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3153 -19.3153 -16.2299 -16.2299 -16.1617 -16.1617 -13.0795 -13.0795 -12.9634 -12.9634 -12.8972 -12.8972 -12.8125 -12.8125 -5.9542 -5.9542 -4.0734 -4.0734 -3.9811 -3.9811 -2.3879 -2.3879 -1.8224 -1.8224 -0.6755 -0.6755 -0.3707 -0.3707 -0.1246 -0.1246 -0.0101 -0.0101 0.0580 0.0580 0.0997 0.0997 3.1762 3.1762 3.3882 3.3882 3.6186 3.6186 3.9234 3.9234 4.0247 4.0247 4.2224 4.2224 4.5642 4.5642 4.7951 4.7951 5.5625 5.5625 5.7219 5.7219 11.1843 11.1843 11.3363 11.3363 12.6302 12.6302 13.0280 13.0280 13.2758 13.2758 13.8710 13.8710 k = 0.6076 0.2682-0.3025 ( 6163 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3170 -19.3170 -16.2329 -16.2329 -16.1603 -16.1603 -13.0734 -13.0734 -12.9617 -12.9617 -12.8918 -12.8918 -12.8126 -12.8126 -5.9557 -5.9557 -4.0744 -4.0744 -3.9857 -3.9857 -2.4245 -2.4245 -1.8519 -1.8519 -0.6557 -0.6557 -0.3465 -0.3465 -0.1417 -0.1417 -0.0110 -0.0110 0.0501 0.0501 0.0970 0.0970 3.1894 3.1894 3.3943 3.3943 3.6491 3.6491 3.9311 3.9311 4.0299 4.0299 4.2138 4.2138 4.5729 4.5729 4.8043 4.8043 5.5893 5.5893 5.7354 5.7354 11.1455 11.1455 11.2918 11.2918 12.6532 12.6532 13.0429 13.0429 13.2795 13.2795 13.8471 13.8471 k = 0.6032 0.2662-0.2839 ( 6153 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3187 -19.3187 -16.2363 -16.2363 -16.1587 -16.1587 -13.0669 -13.0669 -12.9598 -12.9598 -12.8864 -12.8864 -12.8128 -12.8128 -5.9571 -5.9571 -4.0755 -4.0755 -3.9904 -3.9904 -2.4605 -2.4605 -1.8829 -1.8829 -0.6364 -0.6364 -0.3224 -0.3224 -0.1593 -0.1593 -0.0114 -0.0114 0.0425 0.0425 0.0943 0.0943 3.2036 3.2036 3.4005 3.4005 3.6794 3.6794 3.9391 3.9391 4.0344 4.0344 4.2057 4.2057 4.5831 4.5831 4.8135 4.8135 5.6176 5.6176 5.7500 5.7500 11.1054 11.1054 11.2477 11.2477 12.6753 12.6753 13.0595 13.0595 13.2840 13.2840 13.8222 13.8222 k = 0.5987 0.2642-0.2653 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3205 -19.3205 -16.2399 -16.2399 -16.1569 -16.1569 -13.0600 -13.0600 -12.9579 -12.9579 -12.8811 -12.8811 -12.8130 -12.8130 -5.9587 -5.9587 -4.0767 -4.0767 -3.9955 -3.9955 -2.4958 -2.4958 -1.9151 -1.9151 -0.6178 -0.6178 -0.2986 -0.2986 -0.1774 -0.1774 -0.0115 -0.0115 0.0353 0.0353 0.0915 0.0915 3.2188 3.2188 3.4066 3.4066 3.7090 3.7090 3.9475 3.9475 4.0381 4.0381 4.1981 4.1981 4.5947 4.5947 4.8226 4.8226 5.6470 5.6470 5.7656 5.7656 11.0641 11.0641 11.2044 11.2044 12.6965 12.6965 13.0779 13.0779 13.2895 13.2895 13.7966 13.7966 k = 0.5942 0.2622-0.2467 ( 6146 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3223 -19.3223 -16.2437 -16.2437 -16.1549 -16.1549 -13.0526 -13.0526 -12.9559 -12.9559 -12.8758 -12.8758 -12.8132 -12.8132 -5.9603 -5.9603 -4.0778 -4.0778 -4.0008 -4.0008 -2.5300 -2.5300 -1.9482 -1.9482 -0.6001 -0.6001 -0.2754 -0.2754 -0.1956 -0.1956 -0.0115 -0.0115 0.0286 0.0286 0.0888 0.0888 3.2347 3.2347 3.4128 3.4128 3.7375 3.7375 3.9563 3.9563 4.0407 4.0407 4.1913 4.1913 4.6080 4.6080 4.8317 4.8317 5.6773 5.6773 5.7822 5.7822 11.0219 11.0219 11.1620 11.1620 12.7165 12.7165 13.0977 13.0977 13.2961 13.2961 13.7705 13.7705 k = 0.5897 0.2603-0.2281 ( 6144 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3242 -19.3242 -16.2477 -16.2477 -16.1527 -16.1527 -13.0449 -13.0449 -12.9539 -12.9539 -12.8707 -12.8707 -12.8135 -12.8135 -5.9619 -5.9619 -4.0790 -4.0790 -4.0062 -4.0062 -2.5631 -2.5631 -1.9820 -1.9820 -0.5835 -0.5835 -0.2526 -0.2526 -0.2139 -0.2139 -0.0115 -0.0115 0.0227 0.0227 0.0860 0.0860 3.2513 3.2513 3.4189 3.4189 3.7644 3.7644 3.9657 3.9657 4.0422 4.0422 4.1855 4.1855 4.6228 4.6228 4.8407 4.8407 5.7083 5.7083 5.7998 5.7998 10.9789 10.9789 11.1206 11.1206 12.7354 12.7354 13.1189 13.1189 13.3039 13.3039 13.7440 13.7440 k = 0.5852 0.2583-0.2095 ( 6148 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3261 -19.3261 -16.2517 -16.2517 -16.1505 -16.1505 -13.0370 -13.0370 -12.9518 -12.9518 -12.8657 -12.8657 -12.8138 -12.8138 -5.9636 -5.9636 -4.0802 -4.0802 -4.0119 -4.0119 -2.5948 -2.5948 -2.0160 -2.0160 -0.5679 -0.5679 -0.2325 -0.2325 -0.2302 -0.2302 -0.0118 -0.0118 0.0176 0.0176 0.0833 0.0833 3.2684 3.2684 3.4250 3.4250 3.7894 3.7894 3.9757 3.9757 4.0425 4.0425 4.1807 4.1807 4.6391 4.6391 4.8496 4.8496 5.7397 5.7397 5.8182 5.8182 10.9355 10.9355 11.0805 11.0805 12.7529 12.7529 13.1412 13.1412 13.3129 13.3129 13.7173 13.7173 k = 0.5807 0.2563-0.1909 ( 6150 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3279 -19.3279 -16.2558 -16.2558 -16.1483 -16.1483 -13.0288 -13.0288 -12.9496 -12.9496 -12.8608 -12.8608 -12.8141 -12.8141 -5.9653 -5.9653 -4.0814 -4.0814 -4.0177 -4.0177 -2.6251 -2.6251 -2.0502 -2.0502 -0.5535 -0.5535 -0.2503 -0.2503 -0.2090 -0.2090 -0.0126 -0.0126 0.0136 0.0136 0.0806 0.0806 3.2858 3.2858 3.4309 3.4309 3.8120 3.8120 3.9863 3.9863 4.0418 4.0418 4.1770 4.1770 4.6570 4.6570 4.8582 4.8582 5.7709 5.7709 5.8376 5.8376 10.8920 10.8920 11.0417 11.0417 12.7690 12.7690 13.1640 13.1640 13.3237 13.3237 13.6906 13.6906 k = 0.5762 0.2543-0.1723 ( 6151 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3298 -19.3298 -16.2599 -16.2599 -16.1460 -16.1460 -13.0205 -13.0205 -12.9475 -12.9475 -12.8562 -12.8562 -12.8144 -12.8144 -5.9670 -5.9670 -4.0826 -4.0826 -4.0236 -4.0236 -2.6539 -2.6539 -2.0841 -2.0841 -0.5401 -0.5401 -0.2680 -0.2680 -0.1883 -0.1883 -0.0142 -0.0142 0.0108 0.0108 0.0780 0.0780 3.3034 3.3034 3.4367 3.4367 3.8322 3.8322 3.9972 3.9972 4.0406 4.0406 4.1745 4.1745 4.6761 4.6761 4.8667 4.8667 5.8015 5.8015 5.8580 5.8580 10.8488 10.8488 11.0043 11.0043 12.7838 12.7838 13.1867 13.1867 13.3363 13.3363 13.6642 13.6642 k = 0.5718 0.2523-0.1537 ( 6155 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3317 -19.3317 -16.2639 -16.2639 -16.1438 -16.1438 -13.0121 -13.0121 -12.9453 -12.9453 -12.8518 -12.8518 -12.8148 -12.8148 -5.9687 -5.9687 -4.0838 -4.0838 -4.0296 -4.0296 -2.6809 -2.6809 -2.1176 -2.1176 -0.5279 -0.5279 -0.2853 -0.2853 -0.1686 -0.1686 -0.0164 -0.0164 0.0092 0.0092 0.0755 0.0755 3.3210 3.3210 3.4423 3.4423 3.8496 3.8496 4.0070 4.0070 4.0401 4.0401 4.1730 4.1730 4.6964 4.6964 4.8749 4.8749 5.8308 5.8308 5.8798 5.8798 10.8060 10.8060 10.9683 10.9683 12.7971 12.7971 13.2088 13.2088 13.3514 13.3514 13.6382 13.6382 k = 0.5673 0.2504-0.1351 ( 6155 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3335 -19.3335 -16.2678 -16.2678 -16.1415 -16.1415 -13.0037 -13.0037 -12.9432 -12.9432 -12.8476 -12.8476 -12.8152 -12.8152 -5.9703 -5.9703 -4.0850 -4.0850 -4.0356 -4.0356 -2.7063 -2.7063 -2.1505 -2.1505 -0.5167 -0.5167 -0.3021 -0.3021 -0.1499 -0.1499 -0.0189 -0.0189 0.0083 0.0083 0.0732 0.0732 3.3384 3.3384 3.4478 3.4478 3.8645 3.8645 4.0128 4.0128 4.0435 4.0435 4.1723 4.1723 4.7175 4.7175 4.8828 4.8828 5.8580 5.8580 5.9034 5.9034 10.7642 10.7642 10.9339 10.9339 12.8090 12.8090 13.2293 13.2293 13.3694 13.3694 13.6128 13.6128 k = 0.5628 0.2484-0.1165 ( 6164 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3353 -19.3353 -16.2717 -16.2717 -16.1394 -16.1394 -12.9954 -12.9954 -12.9410 -12.9410 -12.8438 -12.8438 -12.8156 -12.8156 -5.9719 -5.9719 -4.0862 -4.0862 -4.0415 -4.0415 -2.7299 -2.7299 -2.1825 -2.1825 -0.5064 -0.5064 -0.3183 -0.3183 -0.1325 -0.1325 -0.0215 -0.0215 0.0080 0.0080 0.0710 0.0710 3.3555 3.3555 3.4530 3.4530 3.8769 3.8769 4.0129 4.0129 4.0527 4.0527 4.1724 4.1724 4.7392 4.7392 4.8904 4.8904 5.8827 5.8827 5.9287 5.9287 10.7236 10.7236 10.9010 10.9010 12.8195 12.8195 13.2477 13.2477 13.3903 13.3903 13.5883 13.5883 k = 0.5583 0.2464-0.0979 ( 6165 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3370 -19.3370 -16.2754 -16.2754 -16.1373 -16.1373 -12.9872 -12.9872 -12.9390 -12.9390 -12.8401 -12.8401 -12.8160 -12.8160 -5.9735 -5.9735 -4.0874 -4.0874 -4.0472 -4.0472 -2.7517 -2.7517 -2.2134 -2.2134 -0.4970 -0.4970 -0.3338 -0.3338 -0.1166 -0.1166 -0.0237 -0.0237 0.0080 0.0080 0.0691 0.0691 3.3722 3.3722 3.4580 3.4580 3.8871 3.8871 4.0093 4.0093 4.0653 4.0653 4.1731 4.1731 4.7612 4.7612 4.8977 4.8977 5.9049 5.9049 5.9552 5.9552 10.6845 10.6845 10.8698 10.8698 12.8287 12.8287 13.2636 13.2636 13.4142 13.4142 13.5649 13.5649 k = 0.5538 0.2444-0.0792 ( 6165 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3386 -19.3386 -16.2789 -16.2789 -16.1353 -16.1353 -12.9792 -12.9792 -12.9370 -12.9370 -12.8368 -12.8368 -12.8164 -12.8164 -5.9750 -5.9750 -4.0887 -4.0887 -4.0526 -4.0526 -2.7717 -2.7717 -2.2430 -2.2430 -0.4885 -0.4885 -0.3484 -0.3484 -0.1026 -0.1026 -0.0254 -0.0254 0.0082 0.0082 0.0674 0.0674 3.3882 3.3882 3.4627 3.4627 3.8953 3.8953 4.0044 4.0044 4.0792 4.0792 4.1741 4.1741 4.7832 4.7832 4.9047 4.9047 5.9251 5.9251 5.9823 5.9823 10.6471 10.6471 10.8404 10.8404 12.8367 12.8367 13.2771 13.2771 13.4405 13.4405 13.5430 13.5430 k = 0.5493 0.2424-0.0606 ( 6165 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3402 -19.3402 -16.2822 -16.2822 -16.1334 -16.1334 -12.9714 -12.9714 -12.9350 -12.9350 -12.8338 -12.8338 -12.8169 -12.8169 -5.9764 -5.9764 -4.0902 -4.0902 -4.0576 -4.0576 -2.7898 -2.7898 -2.2711 -2.2711 -0.4807 -0.4807 -0.3621 -0.3621 -0.0907 -0.0907 -0.0263 -0.0263 0.0086 0.0086 0.0660 0.0660 3.4035 3.4035 3.4672 3.4672 3.9019 3.9019 3.9990 3.9990 4.0932 4.0932 4.1753 4.1753 4.8048 4.8048 4.9112 4.9112 5.9436 5.9436 6.0089 6.0089 10.6118 10.6118 10.8128 10.8128 12.8436 12.8436 13.2882 13.2882 13.4679 13.4679 13.5232 13.5232 k = 0.5449 0.2405-0.0420 ( 6163 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6385 -33.6385 -19.3416 -19.3416 -16.2853 -16.2853 -16.1316 -16.1316 -12.9640 -12.9640 -12.9332 -12.9332 -12.8312 -12.8312 -12.8173 -12.8173 -5.9778 -5.9778 -4.0919 -4.0919 -4.0620 -4.0620 -2.8061 -2.8061 -2.2976 -2.2976 -0.4736 -0.4736 -0.3749 -0.3749 -0.0813 -0.0813 -0.0262 -0.0262 0.0095 0.0095 0.0650 0.0650 3.4180 3.4180 3.4713 3.4713 3.9069 3.9069 3.9937 3.9937 4.1069 4.1069 4.1768 4.1768 4.8257 4.8257 4.9174 4.9174 5.9607 5.9607 6.0346 6.0346 10.5787 10.5787 10.7873 10.7873 12.8494 12.8494 13.2971 13.2971 13.4902 13.4902 13.5115 13.5115 k = 0.5404 0.2385-0.0234 ( 6157 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3430 -19.3430 -16.2882 -16.2882 -16.1299 -16.1299 -12.9570 -12.9570 -12.9315 -12.9315 -12.8288 -12.8288 -12.8177 -12.8177 -5.9790 -5.9790 -4.0940 -4.0940 -4.0658 -4.0658 -2.8207 -2.8207 -2.3221 -2.3221 -0.4673 -0.4673 -0.3866 -0.3866 -0.0746 -0.0746 -0.0254 -0.0254 0.0108 0.0108 0.0643 0.0643 3.4314 3.4314 3.4752 3.4752 3.9107 3.9107 3.9888 3.9888 4.1198 4.1198 4.1783 4.1783 4.8455 4.8455 4.9233 4.9233 5.9764 5.9764 6.0588 6.0588 10.5481 10.5481 10.7638 10.7638 12.8543 12.8543 13.3042 13.3042 13.4829 13.4829 13.5315 13.5315 k = 0.5359 0.2365-0.0048 ( 6149 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3442 -19.3442 -16.2908 -16.2908 -16.1284 -16.1284 -12.9505 -12.9505 -12.9298 -12.9298 -12.8268 -12.8268 -12.8181 -12.8181 -5.9802 -5.9802 -4.0963 -4.0963 -4.0689 -4.0689 -2.8335 -2.8335 -2.3447 -2.3447 -0.4616 -0.4616 -0.3973 -0.3973 -0.0704 -0.0704 -0.0240 -0.0240 0.0126 0.0126 0.0642 0.0642 3.4437 3.4437 3.4787 3.4787 3.9132 3.9132 3.9844 3.9844 4.1317 4.1317 4.1799 4.1799 4.8639 4.8639 4.9288 4.9288 5.9908 5.9908 6.0813 6.0813 10.5202 10.5202 10.7424 10.7424 12.8583 12.8583 13.3093 13.3093 13.4695 13.4695 13.5595 13.5595 k = 0.5314 0.2345 0.0138 ( 6133 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3453 -19.3453 -16.2932 -16.2932 -16.1271 -16.1271 -12.9445 -12.9445 -12.9284 -12.9284 -12.8250 -12.8250 -12.8185 -12.8185 -5.9812 -5.9812 -4.0989 -4.0989 -4.0712 -4.0712 -2.8446 -2.8446 -2.3650 -2.3650 -0.4566 -0.4566 -0.4067 -0.4067 -0.0679 -0.0679 -0.0228 -0.0228 0.0149 0.0149 0.0646 0.0646 3.4548 3.4548 3.4819 3.4819 3.9148 3.9148 3.9808 3.9808 4.1424 4.1424 4.1817 4.1817 4.8804 4.8804 4.9341 4.9341 6.0038 6.0038 6.1017 6.1017 10.4952 10.4952 10.7234 10.7234 12.8615 12.8615 13.3127 13.3127 13.4578 13.4578 13.5870 13.5870 k = 0.5269 0.2325 0.0324 ( 6127 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3463 -19.3463 -16.2953 -16.2953 -16.1259 -16.1259 -12.9391 -12.9391 -12.9271 -12.9271 -12.8236 -12.8236 -12.8188 -12.8188 -5.9821 -5.9821 -4.1015 -4.1015 -4.0729 -4.0729 -2.8541 -2.8541 -2.3829 -2.3829 -0.4523 -0.4523 -0.4150 -0.4150 -0.0667 -0.0667 -0.0219 -0.0219 0.0174 0.0174 0.0655 0.0655 3.4647 3.4647 3.4847 3.4847 3.9155 3.9155 3.9779 3.9779 4.1516 4.1516 4.1836 4.1836 4.8948 4.8948 4.9392 4.9392 6.0152 6.0152 6.1199 6.1199 10.4731 10.4731 10.7067 10.7067 12.8641 12.8641 13.3145 13.3145 13.4483 13.4483 13.6129 13.6129 k = 0.5224 0.2306 0.0510 ( 6127 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3471 -19.3471 -16.2970 -16.2970 -16.1249 -16.1249 -12.9344 -12.9344 -12.9259 -12.9259 -12.8224 -12.8224 -12.8191 -12.8191 -5.9829 -5.9829 -4.1041 -4.1041 -4.0740 -4.0740 -2.8620 -2.8620 -2.3984 -2.3984 -0.4487 -0.4487 -0.4219 -0.4219 -0.0662 -0.0662 -0.0216 -0.0216 0.0197 0.0197 0.0668 0.0668 3.4731 3.4731 3.4871 3.4871 3.9156 3.9156 3.9756 3.9756 4.1591 4.1591 4.1857 4.1857 4.9068 4.9068 4.9441 4.9441 6.0250 6.0250 6.1355 6.1355 10.4542 10.4542 10.6924 10.6924 12.8661 12.8661 13.3149 13.3149 13.4412 13.4412 13.6363 13.6363 k = 0.5179 0.2286 0.0696 ( 6129 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3478 -19.3478 -16.2985 -16.2985 -16.1240 -16.1240 -12.9305 -12.9305 -12.9250 -12.9250 -12.8216 -12.8216 -12.8193 -12.8193 -5.9836 -5.9836 -4.1064 -4.1064 -4.0749 -4.0749 -2.8684 -2.8684 -2.4113 -2.4113 -0.4459 -0.4459 -0.4274 -0.4274 -0.0661 -0.0661 -0.0215 -0.0215 0.0216 0.0216 0.0684 0.0684 3.4800 3.4800 3.4891 3.4891 3.9154 3.9154 3.9740 3.9740 4.1649 4.1649 4.1880 4.1880 4.9160 4.9160 4.9490 4.9490 6.0332 6.0332 6.1485 6.1485 10.4386 10.4386 10.6806 10.6806 12.8676 12.8676 13.3143 13.3143 13.4361 13.4361 13.6566 13.6566 k = 0.5135 0.2266 0.0882 ( 6131 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3483 -19.3483 -16.2996 -16.2996 -16.1234 -16.1234 -12.9274 -12.9274 -12.9242 -12.9242 -12.8210 -12.8210 -12.8195 -12.8195 -5.9841 -5.9841 -4.1083 -4.1083 -4.0754 -4.0754 -2.8733 -2.8733 -2.4213 -2.4213 -0.4441 -0.4441 -0.4313 -0.4313 -0.0662 -0.0662 -0.0217 -0.0217 0.0230 0.0230 0.0699 0.0699 3.4855 3.4855 3.4906 3.4906 3.9149 3.9149 3.9728 3.9728 4.1689 4.1689 4.1903 4.1903 4.9227 4.9227 4.9534 4.9534 6.0396 6.0396 6.1588 6.1588 10.4263 10.4263 10.6714 10.6714 12.8686 12.8686 13.3132 13.3132 13.4327 13.4327 13.6731 13.6731 k = 0.5090 0.2246 0.1068 ( 6133 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3487 -19.3487 -16.3005 -16.3005 -16.1229 -16.1229 -12.9252 -12.9252 -12.9236 -12.9236 -12.8206 -12.8206 -12.8195 -12.8195 -5.9845 -5.9845 -4.1097 -4.1097 -4.0757 -4.0757 -2.8768 -2.8768 -2.4286 -2.4286 -0.4434 -0.4434 -0.4336 -0.4336 -0.0663 -0.0663 -0.0219 -0.0219 0.0240 0.0240 0.0712 0.0712 3.4895 3.4895 3.4918 3.4918 3.9144 3.9144 3.9721 3.9721 4.1714 4.1714 4.1923 4.1923 4.9270 4.9270 4.9572 4.9572 6.0442 6.0442 6.1662 6.1662 10.4175 10.4175 10.6648 10.6648 12.8693 12.8693 13.3121 13.3121 13.4307 13.4307 13.6854 13.6854 k = 0.5045 0.2226 0.1254 ( 6133 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3490 -19.3490 -16.3010 -16.3010 -16.1226 -16.1226 -12.9240 -12.9240 -12.9231 -12.9231 -12.8205 -12.8205 -12.8195 -12.8195 -5.9847 -5.9847 -4.1106 -4.1106 -4.0759 -4.0759 -2.8788 -2.8788 -2.4330 -2.4330 -0.4435 -0.4435 -0.4345 -0.4345 -0.0663 -0.0663 -0.0220 -0.0220 0.0245 0.0245 0.0721 0.0721 3.4919 3.4919 3.4925 3.4925 3.9141 3.9141 3.9717 3.9717 4.1728 4.1728 4.1937 4.1937 4.9295 4.9295 4.9596 4.9596 6.0470 6.0470 6.1707 6.1707 10.4122 10.4122 10.6608 10.6608 12.8698 12.8698 13.3112 13.3112 13.4296 13.4296 13.6929 13.6929 k = 0.5000 0.2207 0.1440 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6385 -33.6385 -19.3491 -19.3491 -16.3011 -16.3011 -16.1225 -16.1225 -12.9237 -12.9237 -12.9229 -12.9229 -12.8204 -12.8204 -12.8195 -12.8195 -5.9848 -5.9848 -4.1109 -4.1109 -4.0760 -4.0760 -2.8795 -2.8795 -2.4345 -2.4345 -0.4436 -0.4436 -0.4347 -0.4347 -0.0664 -0.0664 -0.0221 -0.0221 0.0246 0.0246 0.0724 0.0724 3.4926 3.4926 3.4927 3.4927 3.9139 3.9139 3.9716 3.9716 4.1732 4.1732 4.1942 4.1942 4.9302 4.9302 4.9604 4.9604 6.0479 6.0479 6.1722 6.1722 10.4104 10.4104 10.6595 10.6595 12.8699 12.8699 13.3109 13.3109 13.4292 13.4292 13.6954 13.6954 k = 0.5000-0.4561-0.2977 ( 6130 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3062 -19.3062 -16.1971 -16.1971 -16.1816 -16.1816 -13.1103 -13.1103 -12.9346 -12.9346 -12.8959 -12.8959 -12.8917 -12.8917 -5.9524 -5.9524 -4.0956 -4.0956 -3.9446 -3.9446 -1.9272 -1.9272 -1.7852 -1.7852 -0.8599 -0.8599 -0.5968 -0.5968 -0.0861 -0.0861 -0.0426 -0.0426 0.1310 0.1310 0.1887 0.1887 3.3453 3.3453 3.4539 3.4539 3.4930 3.4930 3.9173 3.9173 4.1442 4.1442 4.2107 4.2107 4.3954 4.3954 4.4066 4.4066 5.4234 5.4234 5.5698 5.5698 11.5082 11.5082 11.9069 11.9069 12.0339 12.0339 13.2038 13.2038 13.5522 13.5522 13.9985 13.9985 k = 0.5144-0.4451-0.2905 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3062 -19.3062 -16.1972 -16.1972 -16.1815 -16.1815 -13.1103 -13.1103 -12.9346 -12.9346 -12.8992 -12.8992 -12.8884 -12.8884 -5.9524 -5.9524 -4.0955 -4.0955 -3.9447 -3.9447 -1.9291 -1.9291 -1.7837 -1.7837 -0.8596 -0.8596 -0.5967 -0.5967 -0.0858 -0.0858 -0.0425 -0.0425 0.1309 0.1309 0.1884 0.1884 3.3448 3.3448 3.4535 3.4535 3.4924 3.4924 3.9157 3.9157 4.1443 4.1443 4.2133 4.2133 4.3797 4.3797 4.4224 4.4224 5.4232 5.4232 5.5702 5.5702 11.5081 11.5081 11.9049 11.9049 12.0362 12.0362 13.2000 13.2000 13.5507 13.5507 13.9986 13.9986 k = 0.5287-0.4341-0.2833 ( 6140 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3062 -19.3062 -16.1975 -16.1975 -16.1812 -16.1812 -13.1104 -13.1104 -12.9345 -12.9345 -12.9039 -12.9039 -12.8837 -12.8837 -5.9523 -5.9523 -4.0951 -4.0951 -3.9448 -3.9448 -1.9342 -1.9342 -1.7794 -1.7794 -0.8589 -0.8589 -0.5962 -0.5962 -0.0850 -0.0850 -0.0423 -0.0423 0.1306 0.1306 0.1877 0.1877 3.3432 3.3432 3.4522 3.4522 3.4906 3.4906 3.9115 3.9115 4.1443 4.1443 4.2210 4.2210 4.3599 4.3599 4.4428 4.4428 5.4226 5.4226 5.5716 5.5716 11.5077 11.5077 11.8993 11.8993 12.0427 12.0427 13.1891 13.1891 13.5463 13.5463 13.9986 13.9986 k = 0.5431-0.4230-0.2761 ( 6129 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3062 -19.3062 -16.1979 -16.1979 -16.1809 -16.1809 -13.1104 -13.1104 -12.9344 -12.9344 -12.9086 -12.9086 -12.8789 -12.8789 -5.9522 -5.9522 -4.0946 -4.0946 -3.9451 -3.9451 -1.9421 -1.9421 -1.7730 -1.7730 -0.8577 -0.8577 -0.5953 -0.5953 -0.0837 -0.0837 -0.0418 -0.0418 0.1301 0.1301 0.1866 0.1866 3.3405 3.3405 3.4500 3.4500 3.4876 3.4876 3.9052 3.9052 4.1444 4.1444 4.2328 4.2328 4.3403 4.3403 4.4635 4.4635 5.4216 5.4216 5.5738 5.5738 11.5070 11.5070 11.8905 11.8905 12.0531 12.0531 13.1721 13.1721 13.5391 13.5391 13.9988 13.9988 k = 0.5574-0.4120-0.2689 ( 6135 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3061 -19.3061 -16.1986 -16.1986 -16.1803 -16.1803 -13.1105 -13.1105 -12.9342 -12.9342 -12.9134 -12.9134 -12.8741 -12.8741 -5.9520 -5.9520 -4.0938 -4.0938 -3.9455 -3.9455 -1.9521 -1.9521 -1.7650 -1.7650 -0.8560 -0.8560 -0.5941 -0.5941 -0.0819 -0.0819 -0.0412 -0.0412 0.1294 0.1294 0.1850 0.1850 3.3367 3.3367 3.4470 3.4470 3.4834 3.4834 3.8977 3.8977 4.1446 4.1446 4.2478 4.2478 4.3215 4.3215 4.4841 4.4841 5.4204 5.4204 5.5768 5.5768 11.5059 11.5059 11.8791 11.8791 12.0668 12.0668 13.1505 13.1505 13.5294 13.5294 13.9991 13.9991 k = 0.5718-0.4010-0.2617 ( 6134 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3061 -19.3061 -16.1993 -16.1993 -16.1797 -16.1797 -13.1106 -13.1106 -12.9340 -12.9340 -12.9181 -12.9181 -12.8693 -12.8693 -5.9518 -5.9518 -4.0928 -4.0928 -3.9459 -3.9459 -1.9636 -1.9636 -1.7563 -1.7563 -0.8539 -0.8539 -0.5926 -0.5926 -0.0796 -0.0796 -0.0404 -0.0404 0.1286 0.1286 0.1829 0.1829 3.3317 3.3317 3.4433 3.4433 3.4781 3.4781 3.8899 3.8899 4.1446 4.1446 4.2643 4.2643 4.3042 4.3042 4.5046 4.5046 5.4189 5.4189 5.5805 5.5805 11.5046 11.5046 11.8655 11.8655 12.0834 12.0834 13.1257 13.1257 13.5174 13.5174 13.9995 13.9995 k = 0.5861-0.3899-0.2545 ( 6137 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3061 -19.3061 -16.2002 -16.2002 -16.1789 -16.1789 -13.1107 -13.1107 -12.9337 -12.9337 -12.9227 -12.9227 -12.8645 -12.8645 -5.9516 -5.9516 -4.0916 -4.0916 -3.9465 -3.9465 -1.9759 -1.9759 -1.7471 -1.7471 -0.8514 -0.8514 -0.5907 -0.5907 -0.0767 -0.0767 -0.0395 -0.0395 0.1275 0.1275 0.1805 0.1805 3.3254 3.3254 3.4388 3.4388 3.4718 3.4718 3.8826 3.8826 4.1442 4.1442 4.2756 4.2756 4.2951 4.2951 4.5249 4.5249 5.4174 5.4174 5.5847 5.5847 11.5029 11.5029 11.8499 11.8499 12.1027 12.1027 13.0994 13.0994 13.5033 13.5033 14.0001 14.0001 k = 0.6005-0.3789-0.2473 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3061 -19.3061 -16.2013 -16.2013 -16.1780 -16.1780 -13.1108 -13.1108 -12.9335 -12.9335 -12.9273 -12.9273 -12.8598 -12.8598 -5.9513 -5.9513 -4.0903 -4.0903 -3.9471 -3.9471 -1.9889 -1.9889 -1.7380 -1.7380 -0.8485 -0.8485 -0.5884 -0.5884 -0.0734 -0.0734 -0.0384 -0.0384 0.1263 0.1263 0.1778 0.1778 3.3177 3.3177 3.4338 3.4338 3.4650 3.4650 3.8762 3.8762 4.1429 4.1429 4.2664 4.2664 4.3090 4.3090 4.5449 4.5449 5.4158 5.4158 5.5895 5.5895 11.5008 11.5008 11.8328 11.8328 12.1244 12.1244 13.0727 13.0727 13.4875 13.4875 14.0007 14.0007 k = 0.6148-0.3679-0.2401 ( 6120 PWs) bands (ev): -66.9789 -66.9789 -33.9302 -33.9302 -33.6466 -33.6466 -33.6386 -33.6386 -19.3061 -19.3061 -16.2024 -16.2024 -16.1770 -16.1770 -13.1108 -13.1108 -12.9333 -12.9333 -12.9315 -12.9315 -12.8553 -12.8553 -5.9509 -5.9509 -4.0888 -4.0888 -3.9478 -3.9478 -2.0021 -2.0021 -1.7292 -1.7292 -0.8453 -0.8453 -0.5858 -0.5858 -0.0696 -0.0696 -0.0373 -0.0373 0.1250 0.1250 0.1747 0.1747 3.3084 3.3084 3.4282 3.4282 3.4579 3.4579 3.8710 3.8710 4.1400 4.1400 4.2542 4.2542 4.3290 4.3290 4.5644 4.5644 5.4143 5.4143 5.5947 5.5947 11.4982 11.4982 11.8144 11.8144 12.1483 12.1483 13.0466 13.0466 13.4704 13.4704 14.0014 14.0015 k = 0.6292-0.3568-0.2329 ( 6131 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3061 -19.3061 -16.2036 -16.2036 -16.1760 -16.1760 -13.1109 -13.1109 -12.9362 -12.9362 -12.9327 -12.9327 -12.8508 -12.8508 -5.9506 -5.9506 -4.0872 -4.0872 -3.9486 -3.9486 -2.0155 -2.0155 -1.7209 -1.7209 -0.8419 -0.8419 -0.5828 -0.5828 -0.0653 -0.0653 -0.0362 -0.0362 0.1235 0.1235 0.1712 0.1712 3.2973 3.2973 3.4221 3.4221 3.4509 3.4509 3.8672 3.8672 4.1348 4.1348 4.2443 4.2443 4.3497 4.3497 4.5834 4.5834 5.4129 5.4129 5.6002 5.6002 11.4951 11.4951 11.7951 11.7951 12.1742 12.1742 13.0221 13.0221 13.4521 13.4521 14.0022 14.0022 k = 0.6435-0.3458-0.2257 ( 6131 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3061 -19.3061 -16.2050 -16.2050 -16.1748 -16.1748 -13.1108 -13.1108 -12.9403 -12.9403 -12.9324 -12.9324 -12.8464 -12.8464 -5.9503 -5.9503 -4.0855 -4.0855 -3.9494 -3.9494 -2.0287 -2.0287 -1.7133 -1.7133 -0.8383 -0.8383 -0.5795 -0.5795 -0.0606 -0.0606 -0.0350 -0.0350 0.1220 0.1220 0.1676 0.1676 3.2845 3.2845 3.4156 3.4156 3.4445 3.4445 3.8648 3.8648 4.1268 4.1268 4.2378 4.2378 4.3703 4.3703 4.6019 4.6019 5.4119 5.4119 5.6059 5.6059 11.4914 11.4914 11.7752 11.7752 12.2018 12.2018 12.9996 12.9996 13.4331 13.4331 14.0028 14.0028 k = 0.6579-0.3348-0.2185 ( 6130 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3061 -19.3061 -16.2064 -16.2064 -16.1736 -16.1736 -13.1108 -13.1108 -12.9443 -12.9443 -12.9322 -12.9322 -12.8422 -12.8422 -5.9499 -5.9499 -4.0837 -4.0837 -3.9503 -3.9503 -2.0418 -2.0418 -1.7065 -1.7065 -0.8346 -0.8346 -0.5757 -0.5757 -0.0555 -0.0555 -0.0339 -0.0339 0.1204 0.1204 0.1637 0.1637 3.2700 3.2700 3.4090 3.4090 3.4390 3.4390 3.8635 3.8635 4.1162 4.1162 4.2347 4.2347 4.3907 4.3907 4.6196 4.6196 5.4111 5.4111 5.6118 5.6118 11.4870 11.4870 11.7552 11.7552 12.2309 12.2309 12.9796 12.9796 13.4136 13.4136 14.0035 14.0035 k = 0.6722-0.3237-0.2113 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3061 -19.3061 -16.2079 -16.2079 -16.1723 -16.1723 -13.1106 -13.1106 -12.9482 -12.9482 -12.9319 -12.9319 -12.8381 -12.8381 -5.9495 -5.9495 -4.0819 -4.0819 -3.9511 -3.9511 -2.0545 -2.0545 -1.7006 -1.7006 -0.8307 -0.8307 -0.5717 -0.5717 -0.0500 -0.0500 -0.0329 -0.0329 0.1188 0.1188 0.1596 0.1596 3.2541 3.2541 3.4022 3.4022 3.4346 3.4346 3.8632 3.8632 4.1034 4.1034 4.2345 4.2345 4.4104 4.4104 4.6365 4.6365 5.4108 5.4108 5.6178 5.6178 11.4818 11.4818 11.7354 11.7354 12.2608 12.2608 12.9627 12.9627 13.3941 13.3941 14.0039 14.0040 k = 0.6866-0.3127-0.2041 ( 6135 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3062 -19.3062 -16.2095 -16.2095 -16.1710 -16.1710 -13.1103 -13.1103 -12.9519 -12.9519 -12.9317 -12.9317 -12.8342 -12.8342 -5.9491 -5.9491 -4.0801 -4.0801 -3.9521 -3.9521 -2.0669 -2.0669 -1.6956 -1.6956 -0.8269 -0.8269 -0.5672 -0.5672 -0.0443 -0.0443 -0.0318 -0.0318 0.1171 0.1171 0.1554 0.1554 3.2371 3.2371 3.3953 3.3953 3.4314 3.4314 3.8638 3.8638 4.0891 4.0891 4.2368 4.2368 4.4293 4.4293 4.6525 4.6525 5.4109 5.4109 5.6238 5.6238 11.4758 11.4758 11.7165 11.7165 12.2912 12.2912 12.9490 12.9490 13.3749 13.3749 14.0043 14.0043 k = 0.7009-0.3017-0.1969 ( 6132 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3062 -19.3062 -16.2111 -16.2111 -16.1696 -16.1696 -13.1100 -13.1100 -12.9554 -12.9554 -12.9315 -12.9315 -12.8304 -12.8304 -5.9488 -5.9488 -4.0782 -4.0782 -3.9530 -3.9530 -2.0787 -2.0787 -1.6918 -1.6918 -0.8231 -0.8231 -0.5624 -0.5624 -0.0385 -0.0385 -0.0306 -0.0306 0.1155 0.1155 0.1511 0.1511 3.2193 3.2193 3.3885 3.3885 3.4294 3.4294 3.8649 3.8649 4.0738 4.0738 4.2409 4.2409 4.4473 4.4473 4.6676 4.6676 5.4114 5.4114 5.6298 5.6298 11.4688 11.4688 11.6988 11.6988 12.3214 12.3214 12.9391 12.9391 13.3563 13.3563 14.0044 14.0044 k = 0.7153-0.2906-0.1897 ( 6136 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3062 -19.3062 -16.2128 -16.2128 -16.1681 -16.1681 -13.1095 -13.1095 -12.9587 -12.9587 -12.9314 -12.9314 -12.8269 -12.8269 -5.9484 -5.9484 -4.0765 -4.0765 -3.9539 -3.9539 -2.0900 -2.0900 -1.6890 -1.6890 -0.8194 -0.8194 -0.5573 -0.5573 -0.0340 -0.0340 -0.0281 -0.0281 0.1139 0.1139 0.1467 0.1467 3.2014 3.2014 3.3818 3.3818 3.4285 3.4285 3.8664 3.8664 4.0581 4.0581 4.2463 4.2463 4.4643 4.4643 4.6816 4.6816 5.4126 5.4126 5.6357 5.6357 11.4609 11.4609 11.6827 11.6827 12.3507 12.3507 12.9333 12.9333 13.3386 13.3386 14.0044 14.0044 k = 0.7296-0.2796-0.1825 ( 6136 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3063 -19.3063 -16.2146 -16.2146 -16.1666 -16.1666 -13.1088 -13.1088 -12.9619 -12.9619 -12.9314 -12.9314 -12.8235 -12.8235 -5.9481 -5.9481 -4.0748 -4.0748 -3.9549 -3.9549 -2.1007 -2.1007 -1.6874 -1.6874 -0.8158 -0.8158 -0.5518 -0.5518 -0.0324 -0.0324 -0.0226 -0.0226 0.1124 0.1124 0.1422 0.1422 3.1836 3.1836 3.3752 3.3752 3.4287 3.4287 3.8681 3.8681 4.0423 4.0423 4.2527 4.2527 4.4802 4.4802 4.6944 4.6944 5.4143 5.4143 5.6415 5.6415 11.4521 11.4521 11.6686 11.6686 12.3781 12.3781 12.9321 12.9321 13.3220 13.3220 14.0041 14.0041 k = 0.7440-0.2686-0.1753 ( 6138 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3064 -19.3064 -16.2163 -16.2163 -16.1650 -16.1650 -13.1080 -13.1080 -12.9648 -12.9648 -12.9314 -12.9314 -12.8203 -12.8203 -5.9478 -5.9478 -4.0732 -4.0732 -3.9558 -3.9558 -2.1108 -2.1108 -1.6869 -1.6869 -0.8123 -0.8123 -0.5461 -0.5461 -0.0322 -0.0322 -0.0159 -0.0159 0.1110 0.1110 0.1377 0.1377 3.1665 3.1665 3.3689 3.3689 3.4299 3.4299 3.8697 3.8697 4.0266 4.0266 4.2599 4.2599 4.4948 4.4948 4.7060 4.7060 5.4165 5.4165 5.6472 5.6472 11.4426 11.4426 11.6567 11.6567 12.4027 12.4027 12.9360 12.9360 13.3068 13.3068 14.0035 14.0035 k = 0.7583-0.2575-0.1681 ( 6143 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3065 -19.3065 -16.2181 -16.2181 -16.1635 -16.1635 -13.1071 -13.1071 -12.9675 -12.9675 -12.9315 -12.9315 -12.8174 -12.8174 -5.9476 -5.9476 -4.0717 -4.0717 -3.9567 -3.9567 -2.1201 -2.1201 -1.6876 -1.6876 -0.8091 -0.8091 -0.5401 -0.5401 -0.0327 -0.0327 -0.0088 -0.0088 0.1096 0.1096 0.1333 0.1333 3.1503 3.1503 3.3629 3.3629 3.4318 3.4318 3.8713 3.8713 4.0114 4.0114 4.2677 4.2677 4.5082 4.5082 4.7163 4.7163 5.4193 5.4193 5.6528 5.6528 11.4326 11.4326 11.6469 11.6469 12.4238 12.4238 12.9453 12.9453 13.2932 13.2932 14.0027 14.0027 k = 0.7727-0.2465-0.1609 ( 6143 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3066 -19.3066 -16.2200 -16.2200 -16.1619 -16.1619 -13.1060 -13.1060 -12.9700 -12.9700 -12.9317 -12.9317 -12.8146 -12.8146 -5.9474 -5.9474 -4.0704 -4.0704 -3.9576 -3.9576 -2.1288 -2.1288 -1.6895 -1.6895 -0.8060 -0.8060 -0.5338 -0.5338 -0.0335 -0.0335 -0.0015 -0.0015 0.1082 0.1082 0.1289 0.1289 3.1354 3.1354 3.3572 3.3572 3.4346 3.4346 3.8725 3.8725 3.9966 3.9966 4.2761 4.2761 4.5204 4.5204 4.7253 4.7253 5.4225 5.4225 5.6583 5.6583 11.4225 11.4225 11.6393 11.6393 12.4407 12.4407 12.9604 12.9604 13.2814 13.2814 14.0015 14.0015 k = 0.7870-0.2355-0.1537 ( 6147 PWs) bands (ev): -66.9789 -66.9789 -33.9303 -33.9303 -33.6466 -33.6466 -33.6386 -33.6386 -19.3067 -19.3067 -16.2218 -16.2218 -16.1602 -16.1602 -13.1047 -13.1047 -12.9722 -12.9722 -12.9320 -12.9320 -12.8121 -12.8121 -5.9472 -5.9472 -4.0693 -4.0693 -3.9584 -3.9584 -2.1366 -2.1366 -1.6925 -1.6925 -0.8032 -0.8032 -0.5274 -0.5274 -0.0348 -0.0348 0.0058 0.0058 0.1069 0.1069 0.1249 0.1249 3.1222 3.1222 3.3520 3.3520 3.4379 3.4379 3.8734 3.8734 3.9825 3.9825 4.2848 4.2848 4.5311 4.5311 4.7330 4.7330 5.4262 5.4262 5.6638 5.6638 11.4127 11.4127 11.6337 11.6337 12.4529 12.4529 12.9811 12.9811 13.2715 13.2715 14.0001 14.0001 Writing output data file BaMgxCO3x2.save init_run : 0.42s CPU 0.60s WALL ( 1 calls) electrons : 485.85s CPU 491.00s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.04s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 485.83s CPU 490.99s 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 : 0.04s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.05s WALL ( 267 calls) cegterg : 461.09s CPU 465.58s WALL ( 639 calls) Called by sum_band: Called by *egterg: h_psi : 236.63s CPU 240.82s WALL ( 11255 calls) s_psi : 6.41s CPU 6.63s WALL ( 11255 calls) g_psi : 0.26s CPU 0.27s WALL ( 10349 calls) cdiaghg : 197.37s CPU 198.09s WALL ( 10616 calls) cegterg:over : 17.43s CPU 17.30s WALL ( 10349 calls) cegterg:upda : 10.15s CPU 10.12s WALL ( 10349 calls) cegterg:last : 6.03s CPU 6.05s WALL ( 1433 calls) cdiaghg:chol : 7.78s CPU 7.80s WALL ( 10616 calls) cdiaghg:inve : 5.61s CPU 5.69s WALL ( 10616 calls) cdiaghg:para : 12.20s CPU 12.25s WALL ( 21232 calls) Called by h_psi: h_psi:vloc : 219.10s CPU 222.89s WALL ( 11255 calls) h_psi:vnl : 17.28s CPU 17.67s WALL ( 11255 calls) add_vuspsi : 7.76s CPU 7.87s WALL ( 11255 calls) General routines calbec : 9.49s CPU 9.77s WALL ( 11255 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 208.32s CPU 211.84s WALL ( 1262464 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.12s CPU 0.17s WALL ( 534 calls) Parallel routines fft_scatter : 132.48s CPU 134.65s WALL ( 1262487 calls) PWSCF : 8m47.72s CPU 9m14.13s WALL This run was terminated on: 4:42:25 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=