Program PWSCF v.5.1.1 starts on 13Jun2015 at 3: 8:38 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./BaS2.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 42 35 10 1107 829 130 Max 43 36 11 1111 844 132 Sum 2057 1707 489 53277 40181 6275 bravais-lattice index = 14 lattice parameter (alat) = 15.6247 a.u. unit-cell volume = 1175.8478 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 44.00 number of Kohn-Sham states= 52 kinetic-energy cutoff = 40.0000 Ry charge density cutoff = 193.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 15.624656 celldm(2)= 1.000000 celldm(3)= 1.133750 celldm(4)= 0.832258 celldm(5)= 0.832258 celldm(6)= 0.835952 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.835952 0.548802 0.000000 ) a(3) = ( 0.943573 0.282052 0.561699 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.523231 -0.914977 ) b(2) = ( 0.000000 1.822150 -0.914977 ) b(3) = ( 0.000000 0.000000 1.780312 ) PseudoPot. # 1 for S read from file: /home/autes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ba read from file: /home/autes/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 atomic species valence mass pseudopotential S 6.00 32.06500 S( 1.00) Ba 10.00 137.32700 Ba( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 323 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 2) = ( 0.0121951 0.0036454 -0.0223165), wk = 0.0030960 k( 3) = ( 0.0243902 0.0072907 -0.0446330), wk = 0.0030960 k( 4) = ( 0.0365854 0.0109361 -0.0669495), wk = 0.0030960 k( 5) = ( 0.0487805 0.0145814 -0.0892660), wk = 0.0030960 k( 6) = ( 0.0609756 0.0182268 -0.1115825), wk = 0.0030960 k( 7) = ( 0.0731707 0.0218722 -0.1338990), wk = 0.0030960 k( 8) = ( 0.0853658 0.0255175 -0.1562155), wk = 0.0030960 k( 9) = ( 0.0975610 0.0291629 -0.1785320), wk = 0.0030960 k( 10) = ( 0.1097561 0.0328082 -0.2008485), wk = 0.0030960 k( 11) = ( 0.1219512 0.0364536 -0.2231650), wk = 0.0030960 k( 12) = ( 0.1341463 0.0400990 -0.2454815), wk = 0.0030960 k( 13) = ( 0.1463415 0.0437443 -0.2677980), wk = 0.0030960 k( 14) = ( 0.1585366 0.0473897 -0.2901145), wk = 0.0030960 k( 15) = ( 0.1707317 0.0510351 -0.3124310), wk = 0.0030960 k( 16) = ( 0.1829268 0.0546804 -0.3347475), wk = 0.0030960 k( 17) = ( 0.1951219 0.0583258 -0.3570640), wk = 0.0030960 k( 18) = ( 0.2073171 0.0619711 -0.3793805), wk = 0.0030960 k( 19) = ( 0.2195122 0.0656165 -0.4016970), wk = 0.0030960 k( 20) = ( 0.2317073 0.0692619 -0.4240135), wk = 0.0030960 k( 21) = ( 0.2439024 0.0729072 -0.4463300), wk = 0.0030960 k( 22) = ( 0.2560976 0.0765526 -0.4686465), wk = 0.0030960 k( 23) = ( 0.2682927 0.0801979 -0.4909630), wk = 0.0030960 k( 24) = ( 0.2804878 0.0838433 -0.5132795), wk = 0.0030960 k( 25) = ( 0.2926829 0.0874887 -0.5355960), wk = 0.0030960 k( 26) = ( 0.3048781 0.0911340 -0.5579125), wk = 0.0030960 k( 27) = ( 0.3170732 0.0947794 -0.5802290), wk = 0.0030960 k( 28) = ( 0.3292683 0.0984247 -0.6025455), wk = 0.0030960 k( 29) = ( 0.3414634 0.1020701 -0.6248620), wk = 0.0030960 k( 30) = ( 0.3536585 0.1057155 -0.6471786), wk = 0.0030960 k( 31) = ( 0.3658537 0.1093608 -0.6694950), wk = 0.0030960 k( 32) = ( 0.3780488 0.1130062 -0.6918115), wk = 0.0030960 k( 33) = ( 0.3902439 0.1166515 -0.7141280), wk = 0.0030960 k( 34) = ( 0.4024390 0.1202969 -0.7364445), wk = 0.0030960 k( 35) = ( 0.4146341 0.1239423 -0.7587611), wk = 0.0030960 k( 36) = ( 0.4268293 0.1275876 -0.7810776), wk = 0.0030960 k( 37) = ( 0.4390244 0.1312330 -0.8033941), wk = 0.0030960 k( 38) = ( 0.4512195 0.1348783 -0.8257106), wk = 0.0030960 k( 39) = ( 0.4634146 0.1385237 -0.8480271), wk = 0.0030960 k( 40) = ( 0.4756098 0.1421691 -0.8703436), wk = 0.0030960 k( 41) = ( 0.4878049 0.1458144 -0.8926601), wk = 0.0030960 k( 42) = ( 0.5000000 0.1494598 -0.9149766), wk = 0.0030960 k( 43) = ( 0.5000000 0.1494598 -0.9149766), wk = 0.0030960 k( 44) = ( 0.4791524 0.1432280 -0.9273869), wk = 0.0030960 k( 45) = ( 0.4583048 0.1369963 -0.9397973), wk = 0.0030960 k( 46) = ( 0.4583048 0.1369963 -0.9397973), wk = 0.0030960 k( 47) = ( 0.4594961 0.1373524 -0.9136551), wk = 0.0030960 k( 48) = ( 0.4606874 0.1377085 -0.8875129), wk = 0.0030960 k( 49) = ( 0.4618787 0.1380646 -0.8613707), wk = 0.0030960 k( 50) = ( 0.4630700 0.1384207 -0.8352285), wk = 0.0030960 k( 51) = ( 0.4642613 0.1387768 -0.8090863), wk = 0.0030960 k( 52) = ( 0.4654526 0.1391329 -0.7829442), wk = 0.0030960 k( 53) = ( 0.4666439 0.1394890 -0.7568020), wk = 0.0030960 k( 54) = ( 0.4678352 0.1398451 -0.7306598), wk = 0.0030960 k( 55) = ( 0.4690264 0.1402012 -0.7045176), wk = 0.0030960 k( 56) = ( 0.4702177 0.1405573 -0.6783754), wk = 0.0030960 k( 57) = ( 0.4714090 0.1409134 -0.6522332), wk = 0.0030960 k( 58) = ( 0.4726003 0.1412695 -0.6260910), wk = 0.0030960 k( 59) = ( 0.4737916 0.1416256 -0.5999488), wk = 0.0030960 k( 60) = ( 0.4749829 0.1419817 -0.5738066), wk = 0.0030960 k( 61) = ( 0.4761742 0.1423378 -0.5476645), wk = 0.0030960 k( 62) = ( 0.4773655 0.1426939 -0.5215223), wk = 0.0030960 k( 63) = ( 0.4785568 0.1430500 -0.4953801), wk = 0.0030960 k( 64) = ( 0.4797481 0.1434061 -0.4692379), wk = 0.0030960 k( 65) = ( 0.4809394 0.1437622 -0.4430957), wk = 0.0030960 k( 66) = ( 0.4821306 0.1441183 -0.4169535), wk = 0.0030960 k( 67) = ( 0.4833219 0.1444744 -0.3908113), wk = 0.0030960 k( 68) = ( 0.4845132 0.1448305 -0.3646692), wk = 0.0030960 k( 69) = ( 0.4857045 0.1451866 -0.3385270), wk = 0.0030960 k( 70) = ( 0.4868958 0.1455427 -0.3123848), wk = 0.0030960 k( 71) = ( 0.4880871 0.1458988 -0.2862426), wk = 0.0030960 k( 72) = ( 0.4892784 0.1462549 -0.2601004), wk = 0.0030960 k( 73) = ( 0.4904697 0.1466110 -0.2339582), wk = 0.0030960 k( 74) = ( 0.4916610 0.1469671 -0.2078160), wk = 0.0030960 k( 75) = ( 0.4928523 0.1473232 -0.1816738), wk = 0.0030960 k( 76) = ( 0.4940435 0.1476793 -0.1555316), wk = 0.0030960 k( 77) = ( 0.4952348 0.1480354 -0.1293895), wk = 0.0030960 k( 78) = ( 0.4964261 0.1483915 -0.1032473), wk = 0.0030960 k( 79) = ( 0.4976174 0.1487476 -0.0771051), wk = 0.0030960 k( 80) = ( 0.4988087 0.1491037 -0.0509629), wk = 0.0030960 k( 81) = ( 0.5000000 0.1494598 -0.0248207), wk = 0.0030960 k( 82) = ( 0.5000000 0.1494598 -0.0248207), wk = 0.0030960 k( 83) = ( 0.5075027 0.1243604 -0.0248207), wk = 0.0030960 k( 84) = ( 0.5150054 0.0992610 -0.0248207), wk = 0.0030960 k( 85) = ( 0.5225081 0.0741617 -0.0248207), wk = 0.0030960 k( 86) = ( 0.5300108 0.0490623 -0.0248207), wk = 0.0030960 k( 87) = ( 0.5375135 0.0239629 -0.0248207), wk = 0.0030960 k( 88) = ( 0.5450162 -0.0011365 -0.0248207), wk = 0.0030960 k( 89) = ( 0.5525189 -0.0262358 -0.0248207), wk = 0.0030960 k( 90) = ( 0.5600216 -0.0513352 -0.0248207), wk = 0.0030960 k( 91) = ( 0.5675242 -0.0764346 -0.0248207), wk = 0.0030960 k( 92) = ( 0.5750269 -0.1015339 -0.0248207), wk = 0.0030960 k( 93) = ( 0.5825296 -0.1266333 -0.0248207), wk = 0.0030960 k( 94) = ( 0.5900323 -0.1517327 -0.0248207), wk = 0.0030960 k( 95) = ( 0.5975350 -0.1768321 -0.0248207), wk = 0.0030960 k( 96) = ( 0.6050377 -0.2019314 -0.0248207), wk = 0.0030960 k( 97) = ( 0.6125404 -0.2270308 -0.0248207), wk = 0.0030960 k( 98) = ( 0.6200431 -0.2521302 -0.0248207), wk = 0.0030960 k( 99) = ( 0.6275458 -0.2772296 -0.0248207), wk = 0.0030960 k( 100) = ( 0.6350485 -0.3023289 -0.0248207), wk = 0.0030960 k( 101) = ( 0.6425512 -0.3274283 -0.0248207), wk = 0.0030960 k( 102) = ( 0.6500539 -0.3525277 -0.0248207), wk = 0.0030960 k( 103) = ( 0.6575566 -0.3776271 -0.0248207), wk = 0.0030960 k( 104) = ( 0.6650593 -0.4027265 -0.0248207), wk = 0.0030960 k( 105) = ( 0.6725620 -0.4278258 -0.0248207), wk = 0.0030960 k( 106) = ( 0.6800647 -0.4529252 -0.0248207), wk = 0.0030960 k( 107) = ( 0.6875674 -0.4780246 -0.0248207), wk = 0.0030960 k( 108) = ( 0.6950701 -0.5031240 -0.0248207), wk = 0.0030960 k( 109) = ( 0.7025727 -0.5282233 -0.0248207), wk = 0.0030960 k( 110) = ( 0.7100754 -0.5533227 -0.0248207), wk = 0.0030960 k( 111) = ( 0.7175781 -0.5784221 -0.0248207), wk = 0.0030960 k( 112) = ( 0.7250808 -0.6035214 -0.0248207), wk = 0.0030960 k( 113) = ( 0.7325835 -0.6286208 -0.0248207), wk = 0.0030960 k( 114) = ( 0.7400862 -0.6537202 -0.0248207), wk = 0.0030960 k( 115) = ( 0.7475889 -0.6788196 -0.0248207), wk = 0.0030960 k( 116) = ( 0.7550916 -0.7039189 -0.0248207), wk = 0.0030960 k( 117) = ( 0.7625943 -0.7290183 -0.0248207), wk = 0.0030960 k( 118) = ( 0.7700970 -0.7541177 -0.0248207), wk = 0.0030960 k( 119) = ( 0.7775997 -0.7792170 -0.0248207), wk = 0.0030960 k( 120) = ( 0.7851024 -0.8043164 -0.0248207), wk = 0.0030960 k( 121) = ( 0.7926051 -0.8294158 -0.0248207), wk = 0.0030960 k( 122) = ( 0.2073949 -0.6938151 0.8901558), wk = 0.0030960 k( 123) = ( 0.1999880 -0.6690360 0.8901558), wk = 0.0030960 k( 124) = ( 0.1925810 -0.6442569 0.8901558), wk = 0.0030960 k( 125) = ( 0.1851740 -0.6194778 0.8901558), wk = 0.0030960 k( 126) = ( 0.1777671 -0.5946986 0.8901558), wk = 0.0030960 k( 127) = ( 0.1703601 -0.5699195 0.8901558), wk = 0.0030960 k( 128) = ( 0.1629531 -0.5451404 0.8901558), wk = 0.0030960 k( 129) = ( 0.1555462 -0.5203613 0.8901558), wk = 0.0030960 k( 130) = ( 0.1481392 -0.4955822 0.8901558), wk = 0.0030960 k( 131) = ( 0.1407323 -0.4708031 0.8901558), wk = 0.0030960 k( 132) = ( 0.1333253 -0.4460240 0.8901558), wk = 0.0030960 k( 133) = ( 0.1259183 -0.4212449 0.8901558), wk = 0.0030960 k( 134) = ( 0.1185114 -0.3964658 0.8901558), wk = 0.0030960 k( 135) = ( 0.1111044 -0.3716867 0.8901558), wk = 0.0030960 k( 136) = ( 0.1036975 -0.3469076 0.8901558), wk = 0.0030960 k( 137) = ( 0.0962905 -0.3221284 0.8901558), wk = 0.0030960 k( 138) = ( 0.0888835 -0.2973493 0.8901558), wk = 0.0030960 k( 139) = ( 0.0814766 -0.2725702 0.8901558), wk = 0.0030960 k( 140) = ( 0.0740696 -0.2477911 0.8901558), wk = 0.0030960 k( 141) = ( 0.0666627 -0.2230120 0.8901558), wk = 0.0030960 k( 142) = ( 0.0592557 -0.1982329 0.8901558), wk = 0.0030960 k( 143) = ( 0.0518487 -0.1734538 0.8901558), wk = 0.0030960 k( 144) = ( 0.0444418 -0.1486747 0.8901558), wk = 0.0030960 k( 145) = ( 0.0370348 -0.1238956 0.8901558), wk = 0.0030960 k( 146) = ( 0.0296279 -0.0991165 0.8901558), wk = 0.0030960 k( 147) = ( 0.0222209 -0.0743373 0.8901558), wk = 0.0030960 k( 148) = ( 0.0148139 -0.0495582 0.8901558), wk = 0.0030960 k( 149) = ( 0.0074070 -0.0247791 0.8901558), wk = 0.0030960 k( 150) = ( 0.0000000 0.0000000 0.8901558), wk = 0.0030960 k( 151) = ( 0.0000000 0.0000000 0.8901558), wk = 0.0030960 k( 152) = ( 0.0246225 0.0073602 0.8901558), wk = 0.0030960 k( 153) = ( 0.0492450 0.0147203 0.8901559), wk = 0.0030960 k( 154) = ( 0.0738675 0.0220804 0.8901559), wk = 0.0030960 k( 155) = ( 0.0984900 0.0294406 0.8901558), wk = 0.0030960 k( 156) = ( 0.1231125 0.0368007 0.8901558), wk = 0.0030960 k( 157) = ( 0.1477350 0.0441609 0.8901559), wk = 0.0030960 k( 158) = ( 0.1723575 0.0515210 0.8901558), wk = 0.0030960 k( 159) = ( 0.1969801 0.0588812 0.8901558), wk = 0.0030960 k( 160) = ( 0.2216026 0.0662413 0.8901558), wk = 0.0030960 k( 161) = ( 0.2462251 0.0736015 0.8901558), wk = 0.0030960 k( 162) = ( 0.2708476 0.0809616 0.8901558), wk = 0.0030960 k( 163) = ( 0.2954701 0.0883218 0.8901559), wk = 0.0030960 k( 164) = ( 0.3200926 0.0956819 0.8901559), wk = 0.0030960 k( 165) = ( 0.3447151 0.1030421 0.8901559), wk = 0.0030960 k( 166) = ( 0.3693376 0.1104022 0.8901559), wk = 0.0030960 k( 167) = ( 0.3939601 0.1177624 0.8901558), wk = 0.0030960 k( 168) = ( 0.4185826 0.1251225 0.8901559), wk = 0.0030960 k( 169) = ( 0.4432051 0.1324827 0.8901559), wk = 0.0030960 k( 170) = ( 0.4678276 0.1398428 0.8901558), wk = 0.0030960 k( 171) = ( 0.4924501 0.1472030 0.8901558), wk = 0.0030960 k( 172) = ( 0.5170727 0.1545631 0.8901559), wk = 0.0030960 k( 173) = ( 0.5416952 0.1619233 0.8901559), wk = 0.0030960 k( 174) = ( 0.5000000 0.1494598 -0.9149766), wk = 0.0030960 k( 175) = ( 0.5072269 0.1252829 -0.9149766), wk = 0.0030960 k( 176) = ( 0.5144539 0.1011060 -0.9149766), wk = 0.0030960 k( 177) = ( 0.5216808 0.0769291 -0.9149766), wk = 0.0030960 k( 178) = ( 0.5289078 0.0527522 -0.9149766), wk = 0.0030960 k( 179) = ( 0.5361347 0.0285753 -0.9149766), wk = 0.0030960 k( 180) = ( 0.5433617 0.0043984 -0.9149766), wk = 0.0030960 k( 181) = ( 0.5505886 -0.0197785 -0.9149766), wk = 0.0030960 k( 182) = ( 0.5578156 -0.0439554 -0.9149766), wk = 0.0030960 k( 183) = ( 0.5650425 -0.0681323 -0.9149766), wk = 0.0030960 k( 184) = ( 0.5722695 -0.0923092 -0.9149766), wk = 0.0030960 k( 185) = ( 0.5794964 -0.1164861 -0.9149766), wk = 0.0030960 k( 186) = ( 0.5867234 -0.1406630 -0.9149766), wk = 0.0030960 k( 187) = ( 0.5939503 -0.1648399 -0.9149766), wk = 0.0030960 k( 188) = ( 0.6011773 -0.1890168 -0.9149766), wk = 0.0030960 k( 189) = ( 0.6084042 -0.2131937 -0.9149766), wk = 0.0030960 k( 190) = ( 0.6156312 -0.2373706 -0.9149766), wk = 0.0030960 k( 191) = ( 0.6228581 -0.2615475 -0.9149766), wk = 0.0030960 k( 192) = ( 0.6300851 -0.2857244 -0.9149766), wk = 0.0030960 k( 193) = ( 0.6373120 -0.3099013 -0.9149766), wk = 0.0030960 k( 194) = ( 0.6445390 -0.3340782 -0.9149766), wk = 0.0030960 k( 195) = ( 0.6517659 -0.3582551 -0.9149766), wk = 0.0030960 k( 196) = ( 0.6589929 -0.3824320 -0.9149766), wk = 0.0030960 k( 197) = ( 0.3410071 -1.1407989 -0.0000000), wk = 0.0030960 k( 198) = ( 0.3335939 -1.1159989 -0.0000000), wk = 0.0030960 k( 199) = ( 0.3261807 -1.0911989 -0.0000000), wk = 0.0030960 k( 200) = ( 0.3187675 -1.0663990 -0.0000000), wk = 0.0030960 k( 201) = ( 0.3113543 -1.0415990 -0.0000000), wk = 0.0030960 k( 202) = ( 0.3039411 -1.0167990 -0.0000000), wk = 0.0030960 k( 203) = ( 0.2965279 -0.9919990 -0.0000000), wk = 0.0030960 k( 204) = ( 0.2891147 -0.9671991 -0.0000000), wk = 0.0030960 k( 205) = ( 0.2817015 -0.9423991 -0.0000000), wk = 0.0030960 k( 206) = ( 0.2742883 -0.9175991 -0.0000000), wk = 0.0030960 k( 207) = ( 0.2668751 -0.8927991 -0.0000000), wk = 0.0030960 k( 208) = ( 0.2594619 -0.8679991 -0.0000000), wk = 0.0030960 k( 209) = ( 0.2520487 -0.8431992 -0.0000000), wk = 0.0030960 k( 210) = ( 0.2446356 -0.8183992 -0.0000000), wk = 0.0030960 k( 211) = ( 0.2372223 -0.7935992 -0.0000000), wk = 0.0030960 k( 212) = ( 0.2298091 -0.7687993 -0.0000000), wk = 0.0030960 k( 213) = ( 0.2223960 -0.7439993 -0.0000000), wk = 0.0030960 k( 214) = ( 0.2149828 -0.7191993 -0.0000000), wk = 0.0030960 k( 215) = ( 0.2075695 -0.6943993 -0.0000000), wk = 0.0030960 k( 216) = ( 0.2001564 -0.6695994 -0.0000000), wk = 0.0030960 k( 217) = ( 0.1927432 -0.6447994 -0.0000000), wk = 0.0030960 k( 218) = ( 0.1853300 -0.6199994 -0.0000000), wk = 0.0030960 k( 219) = ( 0.1779168 -0.5951994 -0.0000000), wk = 0.0030960 k( 220) = ( 0.1705036 -0.5703994 -0.0000000), wk = 0.0030960 k( 221) = ( 0.1630904 -0.5455995 -0.0000000), wk = 0.0030960 k( 222) = ( 0.1556772 -0.5207995 -0.0000000), wk = 0.0030960 k( 223) = ( 0.1482640 -0.4959995 -0.0000000), wk = 0.0030960 k( 224) = ( 0.1408508 -0.4711995 -0.0000000), wk = 0.0030960 k( 225) = ( 0.1334376 -0.4463996 -0.0000000), wk = 0.0030960 k( 226) = ( 0.1260244 -0.4215996 -0.0000000), wk = 0.0030960 k( 227) = ( 0.1186112 -0.3967996 -0.0000000), wk = 0.0030960 k( 228) = ( 0.1111980 -0.3719997 -0.0000000), wk = 0.0030960 k( 229) = ( 0.1037848 -0.3471997 -0.0000000), wk = 0.0030960 k( 230) = ( 0.0963716 -0.3223997 -0.0000000), wk = 0.0030960 k( 231) = ( 0.0889584 -0.2975997 -0.0000000), wk = 0.0030960 k( 232) = ( 0.0815452 -0.2727997 -0.0000000), wk = 0.0030960 k( 233) = ( 0.0741320 -0.2479997 -0.0000000), wk = 0.0030960 k( 234) = ( 0.0667188 -0.2231998 -0.0000000), wk = 0.0030960 k( 235) = ( 0.0593056 -0.1983998 -0.0000000), wk = 0.0030960 k( 236) = ( 0.0518924 -0.1735998 -0.0000000), wk = 0.0030960 k( 237) = ( 0.0444792 -0.1487999 -0.0000000), wk = 0.0030960 k( 238) = ( 0.0370660 -0.1239999 -0.0000000), wk = 0.0030960 k( 239) = ( 0.0296528 -0.0991999 -0.0000000), wk = 0.0030960 k( 240) = ( 0.0222396 -0.0743999 -0.0000000), wk = 0.0030960 k( 241) = ( 0.0148264 -0.0496000 -0.0000000), wk = 0.0030960 k( 242) = ( 0.0074132 -0.0248000 -0.0000000), wk = 0.0030960 k( 243) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 244) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 245) = ( 0.0128205 -0.0195286 -0.0117305), wk = 0.0030960 k( 246) = ( 0.0256410 -0.0390572 -0.0234609), wk = 0.0030960 k( 247) = ( 0.0384615 -0.0585858 -0.0351914), wk = 0.0030960 k( 248) = ( 0.0512821 -0.0781144 -0.0469219), wk = 0.0030960 k( 249) = ( 0.0641026 -0.0976430 -0.0586523), wk = 0.0030960 k( 250) = ( 0.0769231 -0.1171716 -0.0703828), wk = 0.0030960 k( 251) = ( 0.0897436 -0.1367002 -0.0821133), wk = 0.0030960 k( 252) = ( 0.1025641 -0.1562288 -0.0938437), wk = 0.0030960 k( 253) = ( 0.1153846 -0.1757574 -0.1055742), wk = 0.0030960 k( 254) = ( 0.1282051 -0.1952860 -0.1173047), wk = 0.0030960 k( 255) = ( 0.1410256 -0.2148146 -0.1290352), wk = 0.0030960 k( 256) = ( 0.1538461 -0.2343432 -0.1407656), wk = 0.0030960 k( 257) = ( 0.1666667 -0.2538718 -0.1524961), wk = 0.0030960 k( 258) = ( 0.1794872 -0.2734004 -0.1642266), wk = 0.0030960 k( 259) = ( 0.1923077 -0.2929290 -0.1759570), wk = 0.0030960 k( 260) = ( 0.2051282 -0.3124576 -0.1876875), wk = 0.0030960 k( 261) = ( 0.2179487 -0.3319862 -0.1994180), wk = 0.0030960 k( 262) = ( 0.2307692 -0.3515148 -0.2111484), wk = 0.0030960 k( 263) = ( 0.2435897 -0.3710434 -0.2228789), wk = 0.0030960 k( 264) = ( 0.2564103 -0.3905720 -0.2346094), wk = 0.0030960 k( 265) = ( 0.2692308 -0.4101006 -0.2463398), wk = 0.0030960 k( 266) = ( 0.2820513 -0.4296292 -0.2580703), wk = 0.0030960 k( 267) = ( 0.2948718 -0.4491578 -0.2698008), wk = 0.0030960 k( 268) = ( 0.3076923 -0.4686864 -0.2815313), wk = 0.0030960 k( 269) = ( 0.3205128 -0.4882150 -0.2932617), wk = 0.0030960 k( 270) = ( 0.3333333 -0.5077436 -0.3049922), wk = 0.0030960 k( 271) = ( 0.3461538 -0.5272722 -0.3167227), wk = 0.0030960 k( 272) = ( 0.3589744 -0.5468008 -0.3284531), wk = 0.0030960 k( 273) = ( 0.3717949 -0.5663294 -0.3401836), wk = 0.0030960 k( 274) = ( 0.3846154 -0.5858580 -0.3519141), wk = 0.0030960 k( 275) = ( 0.3974359 -0.6053866 -0.3636445), wk = 0.0030960 k( 276) = ( 0.4102564 -0.6249152 -0.3753750), wk = 0.0030960 k( 277) = ( 0.4230769 -0.6444438 -0.3871055), wk = 0.0030960 k( 278) = ( 0.4358974 -0.6639725 -0.3988359), wk = 0.0030960 k( 279) = ( 0.4487179 -0.6835010 -0.4105664), wk = 0.0030960 k( 280) = ( 0.4615385 -0.7030296 -0.4222969), wk = 0.0030960 k( 281) = ( 0.4743590 -0.7225582 -0.4340273), wk = 0.0030960 k( 282) = ( 0.4871795 -0.7420869 -0.4457578), wk = 0.0030960 k( 283) = ( 0.5000000 -0.7616155 -0.4574883), wk = 0.0030960 k( 284) = ( 0.5000000 -0.7616155 0.4326676), wk = 0.0030960 k( 285) = ( 0.4871795 -0.7420869 0.4215735), wk = 0.0030960 k( 286) = ( 0.4743590 -0.7225582 0.4104795), wk = 0.0030960 k( 287) = ( 0.4615385 -0.7030296 0.3993854), wk = 0.0030960 k( 288) = ( 0.4487179 -0.6835010 0.3882914), wk = 0.0030960 k( 289) = ( 0.4358974 -0.6639725 0.3771974), wk = 0.0030960 k( 290) = ( 0.4230769 -0.6444438 0.3661033), wk = 0.0030960 k( 291) = ( 0.4102564 -0.6249152 0.3550093), wk = 0.0030960 k( 292) = ( 0.3974359 -0.6053866 0.3439152), wk = 0.0030960 k( 293) = ( 0.3846154 -0.5858580 0.3328212), wk = 0.0030960 k( 294) = ( 0.3717949 -0.5663294 0.3217272), wk = 0.0030960 k( 295) = ( 0.3589744 -0.5468008 0.3106331), wk = 0.0030960 k( 296) = ( 0.3461538 -0.5272722 0.2995391), wk = 0.0030960 k( 297) = ( 0.3333333 -0.5077436 0.2884450), wk = 0.0030960 k( 298) = ( 0.3205128 -0.4882150 0.2773510), wk = 0.0030960 k( 299) = ( 0.3076923 -0.4686864 0.2662570), wk = 0.0030960 k( 300) = ( 0.2948718 -0.4491578 0.2551629), wk = 0.0030960 k( 301) = ( 0.2820513 -0.4296292 0.2440689), wk = 0.0030960 k( 302) = ( 0.2692308 -0.4101006 0.2329748), wk = 0.0030960 k( 303) = ( 0.2564103 -0.3905720 0.2218808), wk = 0.0030960 k( 304) = ( 0.2435897 -0.3710434 0.2107868), wk = 0.0030960 k( 305) = ( 0.2307692 -0.3515148 0.1996927), wk = 0.0030960 k( 306) = ( 0.2179487 -0.3319862 0.1885987), wk = 0.0030960 k( 307) = ( 0.2051282 -0.3124576 0.1775046), wk = 0.0030960 k( 308) = ( 0.1923077 -0.2929290 0.1664106), wk = 0.0030960 k( 309) = ( 0.1794872 -0.2734004 0.1553166), wk = 0.0030960 k( 310) = ( 0.1666667 -0.2538718 0.1442225), wk = 0.0030960 k( 311) = ( 0.1538461 -0.2343432 0.1331285), wk = 0.0030960 k( 312) = ( 0.1410256 -0.2148146 0.1220344), wk = 0.0030960 k( 313) = ( 0.1282051 -0.1952860 0.1109404), wk = 0.0030960 k( 314) = ( 0.1153846 -0.1757574 0.0998464), wk = 0.0030960 k( 315) = ( 0.1025641 -0.1562288 0.0887523), wk = 0.0030960 k( 316) = ( 0.0897436 -0.1367002 0.0776583), wk = 0.0030960 k( 317) = ( 0.0769231 -0.1171716 0.0665642), wk = 0.0030960 k( 318) = ( 0.0641026 -0.0976430 0.0554702), wk = 0.0030960 k( 319) = ( 0.0512821 -0.0781144 0.0443762), wk = 0.0030960 k( 320) = ( 0.0384615 -0.0585858 0.0332821), wk = 0.0030960 k( 321) = ( 0.0256410 -0.0390572 0.0221881), wk = 0.0030960 k( 322) = ( 0.0128205 -0.0195286 0.0110940), wk = 0.0030960 k( 323) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 2) = ( 0.0121951 0.0121951 -0.0000000), wk = 0.0030960 k( 3) = ( 0.0243902 0.0243902 -0.0000000), wk = 0.0030960 k( 4) = ( 0.0365854 0.0365854 -0.0000000), wk = 0.0030960 k( 5) = ( 0.0487805 0.0487805 -0.0000000), wk = 0.0030960 k( 6) = ( 0.0609756 0.0609756 -0.0000000), wk = 0.0030960 k( 7) = ( 0.0731707 0.0731707 -0.0000000), wk = 0.0030960 k( 8) = ( 0.0853658 0.0853658 -0.0000000), wk = 0.0030960 k( 9) = ( 0.0975610 0.0975610 -0.0000000), wk = 0.0030960 k( 10) = ( 0.1097561 0.1097561 -0.0000000), wk = 0.0030960 k( 11) = ( 0.1219512 0.1219512 -0.0000000), wk = 0.0030960 k( 12) = ( 0.1341463 0.1341463 0.0000000), wk = 0.0030960 k( 13) = ( 0.1463415 0.1463415 -0.0000000), wk = 0.0030960 k( 14) = ( 0.1585366 0.1585366 0.0000000), wk = 0.0030960 k( 15) = ( 0.1707317 0.1707317 -0.0000000), wk = 0.0030960 k( 16) = ( 0.1829268 0.1829268 0.0000000), wk = 0.0030960 k( 17) = ( 0.1951219 0.1951219 -0.0000000), wk = 0.0030960 k( 18) = ( 0.2073171 0.2073171 -0.0000000), wk = 0.0030960 k( 19) = ( 0.2195122 0.2195122 -0.0000000), wk = 0.0030960 k( 20) = ( 0.2317073 0.2317073 0.0000000), wk = 0.0030960 k( 21) = ( 0.2439024 0.2439024 -0.0000000), wk = 0.0030960 k( 22) = ( 0.2560976 0.2560976 -0.0000000), wk = 0.0030960 k( 23) = ( 0.2682927 0.2682927 0.0000000), wk = 0.0030960 k( 24) = ( 0.2804878 0.2804878 -0.0000000), wk = 0.0030960 k( 25) = ( 0.2926829 0.2926829 -0.0000000), wk = 0.0030960 k( 26) = ( 0.3048781 0.3048780 -0.0000000), wk = 0.0030960 k( 27) = ( 0.3170732 0.3170732 -0.0000000), wk = 0.0030960 k( 28) = ( 0.3292683 0.3292683 -0.0000000), wk = 0.0030960 k( 29) = ( 0.3414634 0.3414634 -0.0000000), wk = 0.0030960 k( 30) = ( 0.3536585 0.3536585 -0.0000000), wk = 0.0030960 k( 31) = ( 0.3658537 0.3658537 0.0000000), wk = 0.0030960 k( 32) = ( 0.3780488 0.3780488 -0.0000000), wk = 0.0030960 k( 33) = ( 0.3902439 0.3902439 -0.0000000), wk = 0.0030960 k( 34) = ( 0.4024390 0.4024390 -0.0000000), wk = 0.0030960 k( 35) = ( 0.4146341 0.4146341 -0.0000000), wk = 0.0030960 k( 36) = ( 0.4268293 0.4268293 -0.0000000), wk = 0.0030960 k( 37) = ( 0.4390244 0.4390244 -0.0000000), wk = 0.0030960 k( 38) = ( 0.4512195 0.4512195 -0.0000000), wk = 0.0030960 k( 39) = ( 0.4634146 0.4634146 -0.0000000), wk = 0.0030960 k( 40) = ( 0.4756098 0.4756098 -0.0000000), wk = 0.0030960 k( 41) = ( 0.4878049 0.4878049 -0.0000000), wk = 0.0030960 k( 42) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030960 k( 43) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030960 k( 44) = ( 0.4791524 0.4791524 -0.0283998), wk = 0.0030960 k( 45) = ( 0.4583048 0.4583048 -0.0567996), wk = 0.0030960 k( 46) = ( 0.4583048 0.4583048 -0.0567996), wk = 0.0030960 k( 47) = ( 0.4594961 0.4594961 -0.0408910), wk = 0.0030960 k( 48) = ( 0.4606874 0.4606874 -0.0249824), wk = 0.0030960 k( 49) = ( 0.4618787 0.4618787 -0.0090739), wk = 0.0030960 k( 50) = ( 0.4630700 0.4630700 0.0068347), wk = 0.0030960 k( 51) = ( 0.4642613 0.4642613 0.0227432), wk = 0.0030960 k( 52) = ( 0.4654526 0.4654526 0.0386518), wk = 0.0030960 k( 53) = ( 0.4666439 0.4666439 0.0545604), wk = 0.0030960 k( 54) = ( 0.4678352 0.4678352 0.0704689), wk = 0.0030960 k( 55) = ( 0.4690264 0.4690264 0.0863775), wk = 0.0030960 k( 56) = ( 0.4702177 0.4702177 0.1022860), wk = 0.0030960 k( 57) = ( 0.4714090 0.4714090 0.1181946), wk = 0.0030960 k( 58) = ( 0.4726003 0.4726003 0.1341032), wk = 0.0030960 k( 59) = ( 0.4737916 0.4737916 0.1500117), wk = 0.0030960 k( 60) = ( 0.4749829 0.4749829 0.1659203), wk = 0.0030960 k( 61) = ( 0.4761742 0.4761742 0.1818288), wk = 0.0030960 k( 62) = ( 0.4773655 0.4773655 0.1977374), wk = 0.0030960 k( 63) = ( 0.4785568 0.4785568 0.2136459), wk = 0.0030960 k( 64) = ( 0.4797481 0.4797481 0.2295545), wk = 0.0030960 k( 65) = ( 0.4809394 0.4809394 0.2454631), wk = 0.0030960 k( 66) = ( 0.4821306 0.4821306 0.2613716), wk = 0.0030960 k( 67) = ( 0.4833219 0.4833219 0.2772802), wk = 0.0030960 k( 68) = ( 0.4845132 0.4845132 0.2931887), wk = 0.0030960 k( 69) = ( 0.4857045 0.4857045 0.3090973), wk = 0.0030960 k( 70) = ( 0.4868958 0.4868958 0.3250059), wk = 0.0030960 k( 71) = ( 0.4880871 0.4880871 0.3409144), wk = 0.0030960 k( 72) = ( 0.4892784 0.4892784 0.3568230), wk = 0.0030960 k( 73) = ( 0.4904697 0.4904697 0.3727315), wk = 0.0030960 k( 74) = ( 0.4916610 0.4916610 0.3886401), wk = 0.0030960 k( 75) = ( 0.4928523 0.4928523 0.4045486), wk = 0.0030960 k( 76) = ( 0.4940435 0.4940435 0.4204572), wk = 0.0030960 k( 77) = ( 0.4952348 0.4952348 0.4363658), wk = 0.0030960 k( 78) = ( 0.4964261 0.4964261 0.4522743), wk = 0.0030960 k( 79) = ( 0.4976174 0.4976174 0.4681829), wk = 0.0030960 k( 80) = ( 0.4988087 0.4988087 0.4840914), wk = 0.0030960 k( 81) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030960 k( 82) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030960 k( 83) = ( 0.5075027 0.4924973 0.5000000), wk = 0.0030960 k( 84) = ( 0.5150054 0.4849946 0.5000000), wk = 0.0030960 k( 85) = ( 0.5225081 0.4774919 0.5000000), wk = 0.0030960 k( 86) = ( 0.5300108 0.4699892 0.5000000), wk = 0.0030960 k( 87) = ( 0.5375135 0.4624865 0.5000000), wk = 0.0030960 k( 88) = ( 0.5450162 0.4549838 0.5000000), wk = 0.0030960 k( 89) = ( 0.5525189 0.4474811 0.5000000), wk = 0.0030960 k( 90) = ( 0.5600216 0.4399784 0.5000000), wk = 0.0030960 k( 91) = ( 0.5675242 0.4324757 0.5000000), wk = 0.0030960 k( 92) = ( 0.5750269 0.4249731 0.5000000), wk = 0.0030960 k( 93) = ( 0.5825296 0.4174704 0.5000000), wk = 0.0030960 k( 94) = ( 0.5900323 0.4099677 0.5000000), wk = 0.0030960 k( 95) = ( 0.5975350 0.4024650 0.5000000), wk = 0.0030960 k( 96) = ( 0.6050377 0.3949623 0.5000000), wk = 0.0030960 k( 97) = ( 0.6125404 0.3874596 0.5000000), wk = 0.0030960 k( 98) = ( 0.6200431 0.3799569 0.5000000), wk = 0.0030960 k( 99) = ( 0.6275458 0.3724542 0.5000000), wk = 0.0030960 k( 100) = ( 0.6350485 0.3649515 0.5000000), wk = 0.0030960 k( 101) = ( 0.6425512 0.3574488 0.5000000), wk = 0.0030960 k( 102) = ( 0.6500539 0.3499461 0.5000000), wk = 0.0030960 k( 103) = ( 0.6575566 0.3424434 0.5000000), wk = 0.0030960 k( 104) = ( 0.6650593 0.3349407 0.5000000), wk = 0.0030960 k( 105) = ( 0.6725620 0.3274380 0.5000000), wk = 0.0030960 k( 106) = ( 0.6800647 0.3199353 0.5000000), wk = 0.0030960 k( 107) = ( 0.6875674 0.3124326 0.5000000), wk = 0.0030960 k( 108) = ( 0.6950701 0.3049299 0.5000000), wk = 0.0030960 k( 109) = ( 0.7025727 0.2974272 0.5000000), wk = 0.0030960 k( 110) = ( 0.7100754 0.2899246 0.5000000), wk = 0.0030960 k( 111) = ( 0.7175781 0.2824219 0.5000000), wk = 0.0030960 k( 112) = ( 0.7250808 0.2749192 0.5000000), wk = 0.0030960 k( 113) = ( 0.7325835 0.2674165 0.5000000), wk = 0.0030960 k( 114) = ( 0.7400862 0.2599138 0.5000000), wk = 0.0030960 k( 115) = ( 0.7475889 0.2524111 0.5000000), wk = 0.0030960 k( 116) = ( 0.7550916 0.2449084 0.5000000), wk = 0.0030960 k( 117) = ( 0.7625943 0.2374057 0.5000000), wk = 0.0030960 k( 118) = ( 0.7700970 0.2299030 0.5000000), wk = 0.0030960 k( 119) = ( 0.7775997 0.2224003 0.5000000), wk = 0.0030960 k( 120) = ( 0.7851024 0.2148976 0.5000000), wk = 0.0030960 k( 121) = ( 0.7926051 0.2073949 0.5000000), wk = 0.0030960 k( 122) = ( 0.2073949 -0.2073949 0.5000000), wk = 0.0030960 k( 123) = ( 0.1999880 -0.1999880 0.5000000), wk = 0.0030960 k( 124) = ( 0.1925810 -0.1925810 0.5000000), wk = 0.0030960 k( 125) = ( 0.1851740 -0.1851740 0.5000000), wk = 0.0030960 k( 126) = ( 0.1777671 -0.1777671 0.5000000), wk = 0.0030960 k( 127) = ( 0.1703601 -0.1703601 0.5000000), wk = 0.0030960 k( 128) = ( 0.1629531 -0.1629531 0.5000000), wk = 0.0030960 k( 129) = ( 0.1555462 -0.1555462 0.5000000), wk = 0.0030960 k( 130) = ( 0.1481392 -0.1481392 0.5000000), wk = 0.0030960 k( 131) = ( 0.1407323 -0.1407323 0.5000000), wk = 0.0030960 k( 132) = ( 0.1333253 -0.1333253 0.5000000), wk = 0.0030960 k( 133) = ( 0.1259183 -0.1259183 0.5000000), wk = 0.0030960 k( 134) = ( 0.1185114 -0.1185114 0.5000000), wk = 0.0030960 k( 135) = ( 0.1111044 -0.1111044 0.5000000), wk = 0.0030960 k( 136) = ( 0.1036975 -0.1036975 0.5000000), wk = 0.0030960 k( 137) = ( 0.0962905 -0.0962905 0.5000000), wk = 0.0030960 k( 138) = ( 0.0888835 -0.0888835 0.5000000), wk = 0.0030960 k( 139) = ( 0.0814766 -0.0814766 0.5000000), wk = 0.0030960 k( 140) = ( 0.0740696 -0.0740696 0.5000000), wk = 0.0030960 k( 141) = ( 0.0666627 -0.0666627 0.5000000), wk = 0.0030960 k( 142) = ( 0.0592557 -0.0592557 0.5000000), wk = 0.0030960 k( 143) = ( 0.0518487 -0.0518487 0.5000000), wk = 0.0030960 k( 144) = ( 0.0444418 -0.0444418 0.5000000), wk = 0.0030960 k( 145) = ( 0.0370348 -0.0370348 0.5000000), wk = 0.0030960 k( 146) = ( 0.0296279 -0.0296279 0.5000000), wk = 0.0030960 k( 147) = ( 0.0222209 -0.0222209 0.5000000), wk = 0.0030960 k( 148) = ( 0.0148139 -0.0148139 0.5000000), wk = 0.0030960 k( 149) = ( 0.0074070 -0.0074070 0.5000000), wk = 0.0030960 k( 150) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030960 k( 151) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030960 k( 152) = ( 0.0246225 0.0246225 0.5253091), wk = 0.0030960 k( 153) = ( 0.0492450 0.0492450 0.5506181), wk = 0.0030960 k( 154) = ( 0.0738675 0.0738675 0.5759272), wk = 0.0030960 k( 155) = ( 0.0984900 0.0984900 0.6012363), wk = 0.0030960 k( 156) = ( 0.1231125 0.1231125 0.6265454), wk = 0.0030960 k( 157) = ( 0.1477350 0.1477350 0.6518544), wk = 0.0030960 k( 158) = ( 0.1723575 0.1723575 0.6771635), wk = 0.0030960 k( 159) = ( 0.1969801 0.1969801 0.7024726), wk = 0.0030960 k( 160) = ( 0.2216026 0.2216026 0.7277816), wk = 0.0030960 k( 161) = ( 0.2462251 0.2462251 0.7530907), wk = 0.0030960 k( 162) = ( 0.2708476 0.2708476 0.7783998), wk = 0.0030960 k( 163) = ( 0.2954701 0.2954701 0.8037089), wk = 0.0030960 k( 164) = ( 0.3200926 0.3200926 0.8290179), wk = 0.0030960 k( 165) = ( 0.3447151 0.3447151 0.8543270), wk = 0.0030960 k( 166) = ( 0.3693376 0.3693376 0.8796361), wk = 0.0030960 k( 167) = ( 0.3939601 0.3939601 0.9049451), wk = 0.0030960 k( 168) = ( 0.4185826 0.4185826 0.9302542), wk = 0.0030960 k( 169) = ( 0.4432051 0.4432051 0.9555633), wk = 0.0030960 k( 170) = ( 0.4678276 0.4678276 0.9808723), wk = 0.0030960 k( 171) = ( 0.4924501 0.4924501 1.0061814), wk = 0.0030960 k( 172) = ( 0.5170727 0.5170727 1.0314905), wk = 0.0030960 k( 173) = ( 0.5416952 0.5416952 1.0567996), wk = 0.0030960 k( 174) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030960 k( 175) = ( 0.5072269 0.4927730 -0.0000000), wk = 0.0030960 k( 176) = ( 0.5144539 0.4855461 -0.0000000), wk = 0.0030960 k( 177) = ( 0.5216808 0.4783191 -0.0000000), wk = 0.0030960 k( 178) = ( 0.5289078 0.4710922 0.0000000), wk = 0.0030960 k( 179) = ( 0.5361347 0.4638653 -0.0000000), wk = 0.0030960 k( 180) = ( 0.5433617 0.4566383 -0.0000000), wk = 0.0030960 k( 181) = ( 0.5505886 0.4494114 -0.0000000), wk = 0.0030960 k( 182) = ( 0.5578156 0.4421844 0.0000000), wk = 0.0030960 k( 183) = ( 0.5650425 0.4349575 -0.0000000), wk = 0.0030960 k( 184) = ( 0.5722695 0.4277305 -0.0000000), wk = 0.0030960 k( 185) = ( 0.5794964 0.4205036 0.0000000), wk = 0.0030960 k( 186) = ( 0.5867234 0.4132766 -0.0000000), wk = 0.0030960 k( 187) = ( 0.5939503 0.4060497 0.0000000), wk = 0.0030960 k( 188) = ( 0.6011773 0.3988227 -0.0000000), wk = 0.0030960 k( 189) = ( 0.6084042 0.3915958 0.0000000), wk = 0.0030960 k( 190) = ( 0.6156312 0.3843688 -0.0000000), wk = 0.0030960 k( 191) = ( 0.6228581 0.3771419 -0.0000000), wk = 0.0030960 k( 192) = ( 0.6300851 0.3699149 -0.0000000), wk = 0.0030960 k( 193) = ( 0.6373120 0.3626880 0.0000000), wk = 0.0030960 k( 194) = ( 0.6445390 0.3554610 -0.0000000), wk = 0.0030960 k( 195) = ( 0.6517659 0.3482341 -0.0000000), wk = 0.0030960 k( 196) = ( 0.6589929 0.3410071 -0.0000000), wk = 0.0030960 k( 197) = ( 0.3410071 -0.3410071 -0.0000000), wk = 0.0030960 k( 198) = ( 0.3335939 -0.3335939 -0.0000000), wk = 0.0030960 k( 199) = ( 0.3261807 -0.3261807 -0.0000000), wk = 0.0030960 k( 200) = ( 0.3187675 -0.3187675 -0.0000000), wk = 0.0030960 k( 201) = ( 0.3113543 -0.3113543 -0.0000000), wk = 0.0030960 k( 202) = ( 0.3039411 -0.3039411 -0.0000000), wk = 0.0030960 k( 203) = ( 0.2965279 -0.2965279 -0.0000000), wk = 0.0030960 k( 204) = ( 0.2891147 -0.2891147 -0.0000000), wk = 0.0030960 k( 205) = ( 0.2817015 -0.2817015 -0.0000000), wk = 0.0030960 k( 206) = ( 0.2742883 -0.2742883 -0.0000000), wk = 0.0030960 k( 207) = ( 0.2668751 -0.2668751 -0.0000000), wk = 0.0030960 k( 208) = ( 0.2594619 -0.2594619 -0.0000000), wk = 0.0030960 k( 209) = ( 0.2520487 -0.2520487 -0.0000000), wk = 0.0030960 k( 210) = ( 0.2446356 -0.2446356 -0.0000000), wk = 0.0030960 k( 211) = ( 0.2372223 -0.2372223 -0.0000000), wk = 0.0030960 k( 212) = ( 0.2298091 -0.2298092 -0.0000000), wk = 0.0030960 k( 213) = ( 0.2223960 -0.2223960 -0.0000000), wk = 0.0030960 k( 214) = ( 0.2149828 -0.2149828 -0.0000000), wk = 0.0030960 k( 215) = ( 0.2075695 -0.2075695 -0.0000000), wk = 0.0030960 k( 216) = ( 0.2001564 -0.2001564 -0.0000000), wk = 0.0030960 k( 217) = ( 0.1927432 -0.1927432 -0.0000000), wk = 0.0030960 k( 218) = ( 0.1853300 -0.1853300 -0.0000000), wk = 0.0030960 k( 219) = ( 0.1779168 -0.1779168 -0.0000000), wk = 0.0030960 k( 220) = ( 0.1705036 -0.1705036 -0.0000000), wk = 0.0030960 k( 221) = ( 0.1630904 -0.1630904 -0.0000000), wk = 0.0030960 k( 222) = ( 0.1556772 -0.1556772 -0.0000000), wk = 0.0030960 k( 223) = ( 0.1482640 -0.1482640 -0.0000000), wk = 0.0030960 k( 224) = ( 0.1408508 -0.1408508 -0.0000000), wk = 0.0030960 k( 225) = ( 0.1334376 -0.1334376 -0.0000000), wk = 0.0030960 k( 226) = ( 0.1260244 -0.1260244 -0.0000000), wk = 0.0030960 k( 227) = ( 0.1186112 -0.1186112 0.0000000), wk = 0.0030960 k( 228) = ( 0.1111980 -0.1111980 0.0000000), wk = 0.0030960 k( 229) = ( 0.1037848 -0.1037848 -0.0000000), wk = 0.0030960 k( 230) = ( 0.0963716 -0.0963716 -0.0000000), wk = 0.0030960 k( 231) = ( 0.0889584 -0.0889584 -0.0000000), wk = 0.0030960 k( 232) = ( 0.0815452 -0.0815452 -0.0000000), wk = 0.0030960 k( 233) = ( 0.0741320 -0.0741320 -0.0000000), wk = 0.0030960 k( 234) = ( 0.0667188 -0.0667188 0.0000000), wk = 0.0030960 k( 235) = ( 0.0593056 -0.0593056 -0.0000000), wk = 0.0030960 k( 236) = ( 0.0518924 -0.0518924 -0.0000000), wk = 0.0030960 k( 237) = ( 0.0444792 -0.0444792 -0.0000000), wk = 0.0030960 k( 238) = ( 0.0370660 -0.0370660 -0.0000000), wk = 0.0030960 k( 239) = ( 0.0296528 -0.0296528 -0.0000000), wk = 0.0030960 k( 240) = ( 0.0222396 -0.0222396 -0.0000000), wk = 0.0030960 k( 241) = ( 0.0148264 -0.0148264 -0.0000000), wk = 0.0030960 k( 242) = ( 0.0074132 -0.0074132 -0.0000000), wk = 0.0030960 k( 243) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 244) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 245) = ( 0.0128205 -0.0000000 -0.0000000), wk = 0.0030960 k( 246) = ( 0.0256410 0.0000000 -0.0000000), wk = 0.0030960 k( 247) = ( 0.0384615 0.0000000 -0.0000000), wk = 0.0030960 k( 248) = ( 0.0512821 -0.0000000 -0.0000000), wk = 0.0030960 k( 249) = ( 0.0641026 -0.0000000 -0.0000000), wk = 0.0030960 k( 250) = ( 0.0769231 0.0000000 -0.0000000), wk = 0.0030960 k( 251) = ( 0.0897436 -0.0000000 -0.0000000), wk = 0.0030960 k( 252) = ( 0.1025641 -0.0000000 -0.0000000), wk = 0.0030960 k( 253) = ( 0.1153846 -0.0000000 -0.0000000), wk = 0.0030960 k( 254) = ( 0.1282051 -0.0000000 -0.0000000), wk = 0.0030960 k( 255) = ( 0.1410256 -0.0000000 0.0000000), wk = 0.0030960 k( 256) = ( 0.1538461 -0.0000000 -0.0000000), wk = 0.0030960 k( 257) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0030960 k( 258) = ( 0.1794872 -0.0000000 -0.0000000), wk = 0.0030960 k( 259) = ( 0.1923077 -0.0000000 -0.0000000), wk = 0.0030960 k( 260) = ( 0.2051282 0.0000000 -0.0000000), wk = 0.0030960 k( 261) = ( 0.2179487 -0.0000000 -0.0000000), wk = 0.0030960 k( 262) = ( 0.2307692 -0.0000000 -0.0000000), wk = 0.0030960 k( 263) = ( 0.2435897 0.0000000 -0.0000000), wk = 0.0030960 k( 264) = ( 0.2564103 -0.0000000 -0.0000000), wk = 0.0030960 k( 265) = ( 0.2692308 -0.0000000 -0.0000000), wk = 0.0030960 k( 266) = ( 0.2820513 -0.0000000 0.0000000), wk = 0.0030960 k( 267) = ( 0.2948718 -0.0000000 -0.0000000), wk = 0.0030960 k( 268) = ( 0.3076923 -0.0000000 -0.0000000), wk = 0.0030960 k( 269) = ( 0.3205128 -0.0000000 -0.0000000), wk = 0.0030960 k( 270) = ( 0.3333333 0.0000000 -0.0000000), wk = 0.0030960 k( 271) = ( 0.3461538 -0.0000000 -0.0000000), wk = 0.0030960 k( 272) = ( 0.3589744 -0.0000000 -0.0000000), wk = 0.0030960 k( 273) = ( 0.3717949 0.0000000 -0.0000000), wk = 0.0030960 k( 274) = ( 0.3846154 -0.0000000 -0.0000000), wk = 0.0030960 k( 275) = ( 0.3974359 -0.0000000 -0.0000000), wk = 0.0030960 k( 276) = ( 0.4102564 -0.0000000 -0.0000000), wk = 0.0030960 k( 277) = ( 0.4230769 0.0000000 -0.0000000), wk = 0.0030960 k( 278) = ( 0.4358974 -0.0000000 -0.0000000), wk = 0.0030960 k( 279) = ( 0.4487179 0.0000000 -0.0000000), wk = 0.0030960 k( 280) = ( 0.4615385 -0.0000000 -0.0000000), wk = 0.0030960 k( 281) = ( 0.4743590 -0.0000000 -0.0000000), wk = 0.0030960 k( 282) = ( 0.4871795 -0.0000000 -0.0000000), wk = 0.0030960 k( 283) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0030960 k( 284) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0030960 k( 285) = ( 0.4871795 -0.0000000 0.4871795), wk = 0.0030960 k( 286) = ( 0.4743590 -0.0000000 0.4743590), wk = 0.0030960 k( 287) = ( 0.4615385 -0.0000000 0.4615385), wk = 0.0030960 k( 288) = ( 0.4487179 0.0000000 0.4487179), wk = 0.0030960 k( 289) = ( 0.4358974 -0.0000000 0.4358974), wk = 0.0030960 k( 290) = ( 0.4230769 0.0000000 0.4230769), wk = 0.0030960 k( 291) = ( 0.4102564 -0.0000000 0.4102564), wk = 0.0030960 k( 292) = ( 0.3974359 -0.0000000 0.3974359), wk = 0.0030960 k( 293) = ( 0.3846154 -0.0000000 0.3846154), wk = 0.0030960 k( 294) = ( 0.3717949 0.0000000 0.3717949), wk = 0.0030960 k( 295) = ( 0.3589744 -0.0000000 0.3589744), wk = 0.0030960 k( 296) = ( 0.3461538 -0.0000000 0.3461538), wk = 0.0030960 k( 297) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0030960 k( 298) = ( 0.3205128 -0.0000000 0.3205128), wk = 0.0030960 k( 299) = ( 0.3076923 -0.0000000 0.3076923), wk = 0.0030960 k( 300) = ( 0.2948718 -0.0000000 0.2948718), wk = 0.0030960 k( 301) = ( 0.2820513 -0.0000000 0.2820513), wk = 0.0030960 k( 302) = ( 0.2692308 -0.0000000 0.2692308), wk = 0.0030960 k( 303) = ( 0.2564103 -0.0000000 0.2564103), wk = 0.0030960 k( 304) = ( 0.2435897 0.0000000 0.2435897), wk = 0.0030960 k( 305) = ( 0.2307692 -0.0000000 0.2307692), wk = 0.0030960 k( 306) = ( 0.2179487 -0.0000000 0.2179487), wk = 0.0030960 k( 307) = ( 0.2051282 0.0000000 0.2051282), wk = 0.0030960 k( 308) = ( 0.1923077 -0.0000000 0.1923077), wk = 0.0030960 k( 309) = ( 0.1794872 -0.0000000 0.1794872), wk = 0.0030960 k( 310) = ( 0.1666667 -0.0000000 0.1666667), wk = 0.0030960 k( 311) = ( 0.1538461 -0.0000000 0.1538461), wk = 0.0030960 k( 312) = ( 0.1410256 -0.0000000 0.1410256), wk = 0.0030960 k( 313) = ( 0.1282051 -0.0000000 0.1282051), wk = 0.0030960 k( 314) = ( 0.1153846 -0.0000000 0.1153846), wk = 0.0030960 k( 315) = ( 0.1025641 -0.0000000 0.1025641), wk = 0.0030960 k( 316) = ( 0.0897436 -0.0000000 0.0897436), wk = 0.0030960 k( 317) = ( 0.0769231 0.0000000 0.0769231), wk = 0.0030960 k( 318) = ( 0.0641026 -0.0000000 0.0641026), wk = 0.0030960 k( 319) = ( 0.0512821 -0.0000000 0.0512820), wk = 0.0030960 k( 320) = ( 0.0384615 0.0000000 0.0384615), wk = 0.0030960 k( 321) = ( 0.0256410 0.0000000 0.0256410), wk = 0.0030960 k( 322) = ( 0.0128205 -0.0000000 0.0128205), wk = 0.0030960 k( 323) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 Dense grid: 53277 G-vectors FFT dimensions: ( 72, 72, 80) Smooth grid: 40181 G-vectors FFT dimensions: ( 64, 64, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.18 Mb ( 226, 52) NL pseudopotentials 0.36 Mb ( 113, 206) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.01 Mb ( 1111) G-vector shells 0.01 Mb ( 1073) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.72 Mb ( 226, 208) Each subspace H/S matrix 0.66 Mb ( 208, 208) Each matrix 0.33 Mb ( 206, 2, 52) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./BaS2.save/charge-density.dat Starting wfc are 52 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 47.7 secs Computing kpt #: 2 total cpu time spent up to now is 56.5 secs Computing kpt #: 3 total cpu time spent up to now is 60.5 secs Computing kpt #: 4 total cpu time spent up to now is 64.5 secs Computing kpt #: 5 total cpu time spent up to now is 70.8 secs Computing kpt #: 6 total cpu time spent up to now is 76.4 secs Computing kpt #: 7 total cpu time spent up to now is 80.9 secs Computing kpt #: 8 total cpu time spent up to now is 84.9 secs Computing kpt #: 9 total cpu time spent up to now is 88.9 secs Computing kpt #: 10 total cpu time spent up to now is 92.6 secs Computing kpt #: 11 total cpu time spent up to now is 97.0 secs Computing kpt #: 12 total cpu time spent up to now is 101.7 secs Computing kpt #: 13 total cpu time spent up to now is 106.4 secs Computing kpt #: 14 total cpu time spent up to now is 110.6 secs Computing kpt #: 15 total cpu time spent up to now is 114.8 secs Computing kpt #: 16 total cpu time spent up to now is 119.9 secs Computing kpt #: 17 total cpu time spent up to now is 125.8 secs Computing kpt #: 18 total cpu time spent up to now is 130.0 secs Computing kpt #: 19 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 138.0 secs Computing kpt #: 20 total cpu time spent up to now is 142.8 secs Computing kpt #: 21 total cpu time spent up to now is 148.3 secs Computing kpt #: 22 total cpu time spent up to now is 152.6 secs Computing kpt #: 23 total cpu time spent up to now is 161.6 secs Computing kpt #: 24 total cpu time spent up to now is 170.7 secs Computing kpt #: 25 total cpu time spent up to now is 178.0 secs Computing kpt #: 26 total cpu time spent up to now is 185.1 secs Computing kpt #: 27 total cpu time spent up to now is 189.7 secs Computing kpt #: 28 total cpu time spent up to now is 194.2 secs Computing kpt #: 29 total cpu time spent up to now is 198.3 secs Computing kpt #: 30 total cpu time spent up to now is 202.9 secs Computing kpt #: 31 total cpu time spent up to now is 207.1 secs Computing kpt #: 32 total cpu time spent up to now is 210.8 secs Computing kpt #: 33 total cpu time spent up to now is 214.7 secs Computing kpt #: 34 total cpu time spent up to now is 218.2 secs Computing kpt #: 35 total cpu time spent up to now is 221.9 secs Computing kpt #: 36 total cpu time spent up to now is 226.4 secs Computing kpt #: 37 total cpu time spent up to now is 230.8 secs Computing kpt #: 38 total cpu time spent up to now is 234.8 secs Computing kpt #: 39 total cpu time spent up to now is 238.7 secs Computing kpt #: 40 total cpu time spent up to now is 242.8 secs Computing kpt #: 41 total cpu time spent up to now is 246.3 secs Computing kpt #: 42 total cpu time spent up to now is 250.6 secs Computing kpt #: 43 total cpu time spent up to now is 255.2 secs Computing kpt #: 44 total cpu time spent up to now is 259.5 secs Computing kpt #: 45 total cpu time spent up to now is 264.3 secs Computing kpt #: 46 total cpu time spent up to now is 268.8 secs Computing kpt #: 47 total cpu time spent up to now is 273.8 secs Computing kpt #: 48 total cpu time spent up to now is 278.3 secs Computing kpt #: 49 total cpu time spent up to now is 283.4 secs Computing kpt #: 50 total cpu time spent up to now is 289.0 secs Computing kpt #: 51 total cpu time spent up to now is 292.6 secs Computing kpt #: 52 total cpu time spent up to now is 297.2 secs Computing kpt #: 53 total cpu time spent up to now is 300.7 secs Computing kpt #: 54 total cpu time spent up to now is 304.8 secs Computing kpt #: 55 total cpu time spent up to now is 309.3 secs Computing kpt #: 56 total cpu time spent up to now is 312.6 secs Computing kpt #: 57 total cpu time spent up to now is 316.4 secs Computing kpt #: 58 total cpu time spent up to now is 320.1 secs Computing kpt #: 59 total cpu time spent up to now is 324.1 secs Computing kpt #: 60 total cpu time spent up to now is 327.3 secs Computing kpt #: 61 total cpu time spent up to now is 330.6 secs Computing kpt #: 62 total cpu time spent up to now is 334.1 secs Computing kpt #: 63 total cpu time spent up to now is 337.7 secs Computing kpt #: 64 total cpu time spent up to now is 342.1 secs Computing kpt #: 65 total cpu time spent up to now is 346.5 secs Computing kpt #: 66 total cpu time spent up to now is 351.9 secs Computing kpt #: 67 total cpu time spent up to now is 355.2 secs Computing kpt #: 68 total cpu time spent up to now is 358.8 secs Computing kpt #: 69 total cpu time spent up to now is 365.4 secs Computing kpt #: 70 total cpu time spent up to now is 370.3 secs Computing kpt #: 71 total cpu time spent up to now is 375.0 secs Computing kpt #: 72 total cpu time spent up to now is 378.9 secs Computing kpt #: 73 total cpu time spent up to now is 383.8 secs Computing kpt #: 74 total cpu time spent up to now is 387.6 secs Computing kpt #: 75 total cpu time spent up to now is 392.4 secs Computing kpt #: 76 total cpu time spent up to now is 395.7 secs Computing kpt #: 77 total cpu time spent up to now is 400.1 secs Computing kpt #: 78 total cpu time spent up to now is 403.9 secs Computing kpt #: 79 total cpu time spent up to now is 407.5 secs Computing kpt #: 80 total cpu time spent up to now is 412.8 secs Computing kpt #: 81 total cpu time spent up to now is 415.7 secs Computing kpt #: 82 total cpu time spent up to now is 418.6 secs Computing kpt #: 83 total cpu time spent up to now is 422.6 secs Computing kpt #: 84 total cpu time spent up to now is 426.7 secs Computing kpt #: 85 total cpu time spent up to now is 430.7 secs Computing kpt #: 86 total cpu time spent up to now is 434.8 secs Computing kpt #: 87 total cpu time spent up to now is 439.1 secs Computing kpt #: 88 total cpu time spent up to now is 442.3 secs Computing kpt #: 89 total cpu time spent up to now is 446.6 secs Computing kpt #: 90 total cpu time spent up to now is 450.4 secs Computing kpt #: 91 total cpu time spent up to now is 455.6 secs Computing kpt #: 92 total cpu time spent up to now is 460.3 secs Computing kpt #: 93 total cpu time spent up to now is 464.8 secs Computing kpt #: 94 total cpu time spent up to now is 470.3 secs Computing kpt #: 95 total cpu time spent up to now is 475.0 secs Computing kpt #: 96 total cpu time spent up to now is 478.7 secs Computing kpt #: 97 total cpu time spent up to now is 482.4 secs Computing kpt #: 98 total cpu time spent up to now is 487.0 secs Computing kpt #: 99 total cpu time spent up to now is 491.1 secs Computing kpt #: 100 total cpu time spent up to now is 494.7 secs Computing kpt #: 101 total cpu time spent up to now is 499.0 secs Computing kpt #: 102 total cpu time spent up to now is 503.2 secs Computing kpt #: 103 total cpu time spent up to now is 507.0 secs Computing kpt #: 104 total cpu time spent up to now is 510.2 secs Computing kpt #: 105 total cpu time spent up to now is 513.8 secs Computing kpt #: 106 total cpu time spent up to now is 517.2 secs Computing kpt #: 107 total cpu time spent up to now is 520.7 secs Computing kpt #: 108 total cpu time spent up to now is 525.4 secs Computing kpt #: 109 total cpu time spent up to now is 529.9 secs Computing kpt #: 110 total cpu time spent up to now is 533.0 secs Computing kpt #: 111 total cpu time spent up to now is 536.0 secs Computing kpt #: 112 total cpu time spent up to now is 539.5 secs Computing kpt #: 113 total cpu time spent up to now is 544.0 secs Computing kpt #: 114 total cpu time spent up to now is 549.4 secs Computing kpt #: 115 total cpu time spent up to now is 552.8 secs Computing kpt #: 116 total cpu time spent up to now is 557.7 secs Computing kpt #: 117 total cpu time spent up to now is 563.2 secs Computing kpt #: 118 total cpu time spent up to now is 567.7 secs Computing kpt #: 119 total cpu time spent up to now is 574.4 secs Computing kpt #: 120 total cpu time spent up to now is 577.9 secs Computing kpt #: 121 total cpu time spent up to now is 581.9 secs Computing kpt #: 122 total cpu time spent up to now is 585.5 secs Computing kpt #: 123 total cpu time spent up to now is 589.0 secs Computing kpt #: 124 total cpu time spent up to now is 592.2 secs Computing kpt #: 125 total cpu time spent up to now is 595.6 secs Computing kpt #: 126 total cpu time spent up to now is 599.9 secs Computing kpt #: 127 total cpu time spent up to now is 604.1 secs Computing kpt #: 128 total cpu time spent up to now is 608.0 secs Computing kpt #: 129 total cpu time spent up to now is 611.4 secs Computing kpt #: 130 total cpu time spent up to now is 615.1 secs Computing kpt #: 131 total cpu time spent up to now is 619.0 secs Computing kpt #: 132 total cpu time spent up to now is 624.2 secs Computing kpt #: 133 total cpu time spent up to now is 628.3 secs Computing kpt #: 134 total cpu time spent up to now is 632.0 secs Computing kpt #: 135 total cpu time spent up to now is 635.6 secs Computing kpt #: 136 total cpu time spent up to now is 639.5 secs Computing kpt #: 137 total cpu time spent up to now is 643.7 secs Computing kpt #: 138 total cpu time spent up to now is 648.5 secs Computing kpt #: 139 total cpu time spent up to now is 653.2 secs Computing kpt #: 140 total cpu time spent up to now is 656.9 secs Computing kpt #: 141 total cpu time spent up to now is 661.9 secs Computing kpt #: 142 total cpu time spent up to now is 666.1 secs Computing kpt #: 143 total cpu time spent up to now is 670.4 secs Computing kpt #: 144 total cpu time spent up to now is 674.1 secs Computing kpt #: 145 total cpu time spent up to now is 678.0 secs Computing kpt #: 146 total cpu time spent up to now is 681.6 secs Computing kpt #: 147 total cpu time spent up to now is 686.6 secs Computing kpt #: 148 total cpu time spent up to now is 690.3 secs Computing kpt #: 149 total cpu time spent up to now is 694.7 secs Computing kpt #: 150 total cpu time spent up to now is 699.7 secs Computing kpt #: 151 total cpu time spent up to now is 704.7 secs Computing kpt #: 152 total cpu time spent up to now is 708.9 secs Computing kpt #: 153 total cpu time spent up to now is 712.7 secs Computing kpt #: 154 total cpu time spent up to now is 716.4 secs Computing kpt #: 155 total cpu time spent up to now is 721.0 secs Computing kpt #: 156 total cpu time spent up to now is 725.9 secs Computing kpt #: 157 total cpu time spent up to now is 731.4 secs Computing kpt #: 158 total cpu time spent up to now is 737.2 secs Computing kpt #: 159 total cpu time spent up to now is 741.8 secs Computing kpt #: 160 total cpu time spent up to now is 746.4 secs Computing kpt #: 161 total cpu time spent up to now is 751.4 secs Computing kpt #: 162 total cpu time spent up to now is 758.0 secs Computing kpt #: 163 total cpu time spent up to now is 763.0 secs Computing kpt #: 164 total cpu time spent up to now is 769.0 secs Computing kpt #: 165 total cpu time spent up to now is 773.1 secs Computing kpt #: 166 total cpu time spent up to now is 777.3 secs Computing kpt #: 167 total cpu time spent up to now is 782.4 secs Computing kpt #: 168 total cpu time spent up to now is 787.3 secs Computing kpt #: 169 total cpu time spent up to now is 791.3 secs Computing kpt #: 170 total cpu time spent up to now is 795.3 secs Computing kpt #: 171 total cpu time spent up to now is 799.6 secs Computing kpt #: 172 total cpu time spent up to now is 804.3 secs Computing kpt #: 173 total cpu time spent up to now is 808.5 secs Computing kpt #: 174 total cpu time spent up to now is 812.6 secs Computing kpt #: 175 total cpu time spent up to now is 817.9 secs Computing kpt #: 176 total cpu time spent up to now is 822.3 secs Computing kpt #: 177 total cpu time spent up to now is 826.0 secs Computing kpt #: 178 total cpu time spent up to now is 829.8 secs Computing kpt #: 179 total cpu time spent up to now is 834.7 secs Computing kpt #: 180 total cpu time spent up to now is 840.5 secs Computing kpt #: 181 total cpu time spent up to now is 845.0 secs Computing kpt #: 182 total cpu time spent up to now is 849.3 secs Computing kpt #: 183 total cpu time spent up to now is 852.8 secs Computing kpt #: 184 total cpu time spent up to now is 857.1 secs Computing kpt #: 185 total cpu time spent up to now is 861.6 secs Computing kpt #: 186 total cpu time spent up to now is 864.7 secs Computing kpt #: 187 total cpu time spent up to now is 869.2 secs Computing kpt #: 188 total cpu time spent up to now is 872.3 secs Computing kpt #: 189 total cpu time spent up to now is 875.8 secs Computing kpt #: 190 total cpu time spent up to now is 880.1 secs Computing kpt #: 191 total cpu time spent up to now is 884.1 secs Computing kpt #: 192 total cpu time spent up to now is 888.5 secs Computing kpt #: 193 total cpu time spent up to now is 892.9 secs Computing kpt #: 194 total cpu time spent up to now is 896.5 secs Computing kpt #: 195 total cpu time spent up to now is 900.5 secs Computing kpt #: 196 total cpu time spent up to now is 904.4 secs Computing kpt #: 197 total cpu time spent up to now is 909.2 secs Computing kpt #: 198 total cpu time spent up to now is 913.5 secs Computing kpt #: 199 total cpu time spent up to now is 919.3 secs Computing kpt #: 200 total cpu time spent up to now is 924.4 secs Computing kpt #: 201 total cpu time spent up to now is 930.8 secs Computing kpt #: 202 total cpu time spent up to now is 935.4 secs Computing kpt #: 203 total cpu time spent up to now is 939.8 secs Computing kpt #: 204 total cpu time spent up to now is 945.2 secs Computing kpt #: 205 total cpu time spent up to now is 949.9 secs Computing kpt #: 206 total cpu time spent up to now is 953.5 secs Computing kpt #: 207 total cpu time spent up to now is 958.3 secs Computing kpt #: 208 total cpu time spent up to now is 963.1 secs Computing kpt #: 209 total cpu time spent up to now is 968.1 secs Computing kpt #: 210 total cpu time spent up to now is 973.0 secs Computing kpt #: 211 total cpu time spent up to now is 978.0 secs Computing kpt #: 212 total cpu time spent up to now is 982.7 secs Computing kpt #: 213 total cpu time spent up to now is 987.5 secs Computing kpt #: 214 total cpu time spent up to now is 992.5 secs Computing kpt #: 215 total cpu time spent up to now is 997.0 secs Computing kpt #: 216 total cpu time spent up to now is 1002.4 secs Computing kpt #: 217 total cpu time spent up to now is 1007.2 secs Computing kpt #: 218 total cpu time spent up to now is 1012.4 secs Computing kpt #: 219 total cpu time spent up to now is 1017.3 secs Computing kpt #: 220 total cpu time spent up to now is 1022.0 secs Computing kpt #: 221 total cpu time spent up to now is 1026.5 secs Computing kpt #: 222 total cpu time spent up to now is 1030.7 secs Computing kpt #: 223 total cpu time spent up to now is 1035.1 secs Computing kpt #: 224 total cpu time spent up to now is 1039.1 secs Computing kpt #: 225 total cpu time spent up to now is 1043.6 secs Computing kpt #: 226 total cpu time spent up to now is 1048.4 secs Computing kpt #: 227 total cpu time spent up to now is 1052.2 secs Computing kpt #: 228 total cpu time spent up to now is 1057.6 secs Computing kpt #: 229 total cpu time spent up to now is 1062.3 secs Computing kpt #: 230 total cpu time spent up to now is 1067.1 secs Computing kpt #: 231 total cpu time spent up to now is 1070.9 secs Computing kpt #: 232 total cpu time spent up to now is 1075.5 secs Computing kpt #: 233 total cpu time spent up to now is 1079.6 secs Computing kpt #: 234 total cpu time spent up to now is 1084.6 secs Computing kpt #: 235 total cpu time spent up to now is 1089.2 secs Computing kpt #: 236 total cpu time spent up to now is 1094.4 secs Computing kpt #: 237 total cpu time spent up to now is 1099.0 secs Computing kpt #: 238 total cpu time spent up to now is 1105.0 secs Computing kpt #: 239 total cpu time spent up to now is 1109.5 secs Computing kpt #: 240 total cpu time spent up to now is 1114.6 secs Computing kpt #: 241 total cpu time spent up to now is 1119.6 secs Computing kpt #: 242 total cpu time spent up to now is 1125.4 secs Computing kpt #: 243 total cpu time spent up to now is 1129.9 secs Computing kpt #: 244 total cpu time spent up to now is 1134.9 secs Computing kpt #: 245 total cpu time spent up to now is 1140.0 secs Computing kpt #: 246 total cpu time spent up to now is 1145.0 secs Computing kpt #: 247 total cpu time spent up to now is 1150.0 secs Computing kpt #: 248 total cpu time spent up to now is 1155.2 secs Computing kpt #: 249 total cpu time spent up to now is 1158.9 secs Computing kpt #: 250 total cpu time spent up to now is 1163.6 secs Computing kpt #: 251 total cpu time spent up to now is 1167.5 secs Computing kpt #: 252 total cpu time spent up to now is 1171.6 secs Computing kpt #: 253 total cpu time spent up to now is 1176.5 secs Computing kpt #: 254 total cpu time spent up to now is 1180.7 secs Computing kpt #: 255 total cpu time spent up to now is 1185.1 secs Computing kpt #: 256 total cpu time spent up to now is 1188.4 secs Computing kpt #: 257 total cpu time spent up to now is 1193.0 secs Computing kpt #: 258 total cpu time spent up to now is 1196.1 secs Computing kpt #: 259 total cpu time spent up to now is 1199.2 secs Computing kpt #: 260 total cpu time spent up to now is 1204.4 secs Computing kpt #: 261 total cpu time spent up to now is 1208.2 secs Computing kpt #: 262 total cpu time spent up to now is 1212.2 secs Computing kpt #: 263 total cpu time spent up to now is 1215.3 secs Computing kpt #: 264 total cpu time spent up to now is 1219.0 secs Computing kpt #: 265 total cpu time spent up to now is 1223.1 secs Computing kpt #: 266 total cpu time spent up to now is 1227.3 secs Computing kpt #: 267 total cpu time spent up to now is 1231.3 secs Computing kpt #: 268 total cpu time spent up to now is 1234.8 secs Computing kpt #: 269 total cpu time spent up to now is 1238.1 secs Computing kpt #: 270 total cpu time spent up to now is 1242.1 secs Computing kpt #: 271 total cpu time spent up to now is 1246.6 secs Computing kpt #: 272 total cpu time spent up to now is 1251.3 secs Computing kpt #: 273 total cpu time spent up to now is 1255.1 secs Computing kpt #: 274 total cpu time spent up to now is 1258.9 secs Computing kpt #: 275 total cpu time spent up to now is 1263.0 secs Computing kpt #: 276 total cpu time spent up to now is 1267.9 secs Computing kpt #: 277 total cpu time spent up to now is 1271.6 secs Computing kpt #: 278 total cpu time spent up to now is 1275.2 secs Computing kpt #: 279 total cpu time spent up to now is 1279.9 secs Computing kpt #: 280 total cpu time spent up to now is 1283.4 secs Computing kpt #: 281 total cpu time spent up to now is 1287.8 secs Computing kpt #: 282 total cpu time spent up to now is 1292.2 secs Computing kpt #: 283 total cpu time spent up to now is 1295.6 secs Computing kpt #: 284 total cpu time spent up to now is 1300.2 secs Computing kpt #: 285 total cpu time spent up to now is 1305.2 secs Computing kpt #: 286 total cpu time spent up to now is 1309.3 secs Computing kpt #: 287 total cpu time spent up to now is 1312.8 secs Computing kpt #: 288 total cpu time spent up to now is 1317.0 secs Computing kpt #: 289 total cpu time spent up to now is 1320.4 secs Computing kpt #: 290 total cpu time spent up to now is 1325.2 secs Computing kpt #: 291 total cpu time spent up to now is 1328.7 secs Computing kpt #: 292 total cpu time spent up to now is 1332.2 secs Computing kpt #: 293 total cpu time spent up to now is 1336.6 secs Computing kpt #: 294 total cpu time spent up to now is 1341.1 secs Computing kpt #: 295 total cpu time spent up to now is 1344.7 secs Computing kpt #: 296 total cpu time spent up to now is 1349.8 secs Computing kpt #: 297 total cpu time spent up to now is 1353.8 secs Computing kpt #: 298 total cpu time spent up to now is 1358.1 secs Computing kpt #: 299 total cpu time spent up to now is 1361.3 secs Computing kpt #: 300 total cpu time spent up to now is 1365.3 secs Computing kpt #: 301 total cpu time spent up to now is 1368.9 secs Computing kpt #: 302 total cpu time spent up to now is 1372.6 secs Computing kpt #: 303 total cpu time spent up to now is 1375.7 secs Computing kpt #: 304 total cpu time spent up to now is 1380.8 secs Computing kpt #: 305 total cpu time spent up to now is 1384.3 secs Computing kpt #: 306 total cpu time spent up to now is 1387.3 secs Computing kpt #: 307 total cpu time spent up to now is 1390.4 secs Computing kpt #: 308 total cpu time spent up to now is 1393.6 secs Computing kpt #: 309 total cpu time spent up to now is 1397.2 secs Computing kpt #: 310 total cpu time spent up to now is 1401.3 secs Computing kpt #: 311 total cpu time spent up to now is 1407.6 secs Computing kpt #: 312 total cpu time spent up to now is 1412.8 secs Computing kpt #: 313 total cpu time spent up to now is 1416.8 secs Computing kpt #: 314 total cpu time spent up to now is 1423.4 secs Computing kpt #: 315 total cpu time spent up to now is 1427.2 secs Computing kpt #: 316 total cpu time spent up to now is 1431.9 secs Computing kpt #: 317 total cpu time spent up to now is 1435.7 secs Computing kpt #: 318 total cpu time spent up to now is 1439.7 secs Computing kpt #: 319 total cpu time spent up to now is 1444.0 secs Computing kpt #: 320 total cpu time spent up to now is 1447.7 secs Computing kpt #: 321 total cpu time spent up to now is 1453.1 secs Computing kpt #: 322 total cpu time spent up to now is 1458.0 secs Computing kpt #: 323 total cpu time spent up to now is 1463.2 secs ethr = 2.27E-11, avg # of iterations = 43.1 total cpu time spent up to now is 1463.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4987 PWs) bands (ev): -20.5465 -20.5465 -20.5246 -20.5246 -8.4395 -8.4395 -7.9628 -7.9628 -7.1856 -7.1856 -6.9232 -6.9232 -5.2153 -5.2153 -5.2052 -5.2052 -5.1609 -5.1609 -4.8313 -4.8313 -3.6894 -3.6894 -3.5659 -3.5659 1.1538 1.1538 1.2267 1.2267 2.2423 2.2423 3.0897 3.0897 3.4788 3.4788 3.6699 3.6699 4.9461 4.9461 5.1999 5.1999 5.6302 5.6302 5.8774 5.8774 8.8366 8.8366 9.5288 9.5288 9.6901 9.6901 10.1429 10.1429 k = 0.0122 0.0036-0.0223 ( 4988 PWs) bands (ev): -20.5465 -20.5465 -20.5246 -20.5246 -8.4391 -8.4391 -7.9630 -7.9630 -7.1854 -7.1854 -6.9234 -6.9234 -5.2160 -5.2160 -5.2054 -5.2054 -5.1609 -5.1609 -4.8318 -4.8318 -3.6890 -3.6890 -3.5673 -3.5673 1.1567 1.1567 1.2280 1.2280 2.2441 2.2441 3.0893 3.0893 3.4792 3.4792 3.6690 3.6690 4.9462 4.9462 5.2016 5.2016 5.6281 5.6281 5.8764 5.8764 8.8364 8.8364 9.5281 9.5281 9.6902 9.6902 10.1150 10.1150 k = 0.0244 0.0073-0.0446 ( 4976 PWs) bands (ev): -20.5464 -20.5464 -20.5247 -20.5247 -8.4379 -8.4379 -7.9636 -7.9636 -7.1849 -7.1849 -6.9239 -6.9239 -5.2181 -5.2181 -5.2057 -5.2057 -5.1607 -5.1607 -4.8330 -4.8330 -3.6877 -3.6877 -3.5716 -3.5716 1.1654 1.1654 1.2318 1.2318 2.2494 2.2494 3.0881 3.0881 3.4805 3.4805 3.6664 3.6664 4.9466 4.9466 5.2069 5.2069 5.6216 5.6216 5.8734 5.8734 8.8358 8.8358 9.5263 9.5263 9.6902 9.6902 10.0603 10.0603 k = 0.0366 0.0109-0.0669 ( 4979 PWs) bands (ev): -20.5463 -20.5463 -20.5247 -20.5247 -8.4358 -8.4358 -7.9646 -7.9646 -7.1840 -7.1840 -6.9247 -6.9247 -5.2217 -5.2217 -5.2064 -5.2064 -5.1605 -5.1605 -4.8351 -4.8351 -3.6857 -3.6857 -3.5785 -3.5785 1.1797 1.1797 1.2383 1.2383 2.2582 2.2582 3.0862 3.0862 3.4824 3.4824 3.6622 3.6622 4.9472 4.9472 5.2156 5.2156 5.6110 5.6110 5.8684 5.8684 8.8350 8.8350 9.5239 9.5239 9.6894 9.6894 10.0005 10.0005 k = 0.0488 0.0146-0.0893 ( 4973 PWs) bands (ev): -20.5461 -20.5461 -20.5248 -20.5248 -8.4329 -8.4329 -7.9659 -7.9659 -7.1829 -7.1829 -6.9258 -6.9258 -5.2265 -5.2265 -5.2073 -5.2073 -5.1603 -5.1603 -4.8378 -4.8378 -3.6832 -3.6832 -3.5880 -3.5880 1.1992 1.1992 1.2479 1.2479 2.2704 2.2704 3.0835 3.0835 3.4851 3.4851 3.6567 3.6567 4.9476 4.9476 5.2276 5.2276 5.5964 5.5964 5.8614 5.8614 8.8341 8.8341 9.5218 9.5218 9.6863 9.6863 9.9425 9.9425 k = 0.0610 0.0182-0.1116 ( 4976 PWs) bands (ev): -20.5459 -20.5459 -20.5248 -20.5248 -8.4292 -8.4292 -7.9674 -7.9674 -7.1816 -7.1816 -6.9272 -6.9272 -5.2326 -5.2326 -5.2085 -5.2085 -5.1603 -5.1603 -4.8410 -4.8410 -3.6804 -3.6804 -3.5996 -3.5996 1.2231 1.2231 1.2612 1.2612 2.2857 2.2857 3.0801 3.0801 3.4884 3.4884 3.6502 3.6502 4.9477 4.9477 5.2426 5.2426 5.5781 5.5781 5.8526 5.8526 8.8335 8.8335 9.5211 9.5211 9.6783 9.6783 9.8914 9.8914 k = 0.0732 0.0219-0.1339 ( 4978 PWs) bands (ev): -20.5456 -20.5456 -20.5249 -20.5249 -8.4249 -8.4249 -7.9692 -7.9692 -7.1802 -7.1802 -6.9289 -6.9289 -5.2398 -5.2398 -5.2100 -5.2100 -5.1605 -5.1605 -4.8447 -4.8447 -3.6775 -3.6775 -3.6131 -3.6131 1.2492 1.2492 1.2804 1.2804 2.3041 2.3041 3.0760 3.0760 3.4920 3.4920 3.6431 3.6431 4.9473 4.9473 5.2604 5.2604 5.5563 5.5563 5.8421 5.8421 8.8335 8.8335 9.5226 9.5226 9.6611 9.6611 9.8523 9.8523 k = 0.0854 0.0255-0.1562 ( 4986 PWs) bands (ev): -20.5453 -20.5453 -20.5251 -20.5251 -8.4198 -8.4198 -7.9711 -7.9711 -7.1786 -7.1786 -6.9307 -6.9307 -5.2480 -5.2480 -5.2118 -5.2118 -5.1612 -5.1612 -4.8487 -4.8487 -3.6750 -3.6750 -3.6278 -3.6278 1.2742 1.2742 1.3086 1.3086 2.3254 2.3254 3.0713 3.0713 3.4959 3.4959 3.6359 3.6359 4.9463 4.9463 5.2805 5.2805 5.5315 5.5315 5.8299 5.8299 8.8343 8.8343 9.5273 9.5273 9.6322 9.6322 9.8288 9.8288 k = 0.0976 0.0292-0.1785 ( 4988 PWs) bands (ev): -20.5450 -20.5450 -20.5252 -20.5252 -8.4141 -8.4141 -7.9731 -7.9731 -7.1771 -7.1771 -6.9326 -6.9326 -5.2572 -5.2572 -5.2140 -5.2140 -5.1624 -5.1624 -4.8527 -4.8527 -3.6735 -3.6735 -3.6432 -3.6432 1.2978 1.2978 1.3460 1.3460 2.3492 2.3492 3.0661 3.0661 3.4998 3.4998 3.6288 3.6288 4.9445 4.9445 5.3022 5.3022 5.5041 5.5041 5.8161 5.8161 8.8364 8.8364 9.5358 9.5358 9.5937 9.5937 9.8192 9.8192 k = 0.1098 0.0328-0.2008 ( 4989 PWs) bands (ev): -20.5446 -20.5446 -20.5253 -20.5253 -8.4078 -8.4078 -7.9750 -7.9750 -7.1757 -7.1757 -6.9346 -6.9346 -5.2671 -5.2671 -5.2165 -5.2165 -5.1645 -5.1645 -4.8568 -4.8568 -3.6752 -3.6752 -3.6567 -3.6567 1.3223 1.3223 1.3899 1.3899 2.3753 2.3753 3.0605 3.0605 3.5034 3.5034 3.6225 3.6225 4.9418 4.9418 5.3251 5.3251 5.4748 5.4748 5.8009 5.8009 8.8400 8.8400 9.5457 9.5457 9.5534 9.5534 9.8186 9.8186 k = 0.1220 0.0365-0.2232 ( 4984 PWs) bands (ev): -20.5441 -20.5441 -20.5255 -20.5255 -8.4011 -8.4011 -7.9768 -7.9768 -7.1744 -7.1744 -6.9366 -6.9366 -5.2775 -5.2775 -5.2195 -5.2195 -5.1674 -5.1674 -4.8607 -4.8607 -3.6848 -3.6848 -3.6636 -3.6636 1.3493 1.3493 1.4387 1.4387 2.4035 2.4035 3.0547 3.0547 3.5064 3.5064 3.6171 3.6171 4.9384 4.9384 5.3483 5.3483 5.4442 5.4442 5.7843 5.7843 8.8455 8.8455 9.5051 9.5051 9.5671 9.5671 9.8235 9.8235 k = 0.1341 0.0401-0.2455 ( 4992 PWs) bands (ev): -20.5437 -20.5437 -20.5257 -20.5257 -8.3939 -8.3939 -7.9784 -7.9784 -7.1734 -7.1734 -6.9385 -6.9385 -5.2884 -5.2884 -5.2231 -5.2231 -5.1714 -5.1714 -4.8644 -4.8644 -3.6996 -3.6996 -3.6663 -3.6663 1.3791 1.3791 1.4916 1.4916 2.4335 2.4335 3.0487 3.0487 3.5086 3.5086 3.6131 3.6131 4.9341 4.9341 5.3698 5.3698 5.4143 5.4143 5.7666 5.7666 8.8532 8.8532 9.4616 9.4616 9.5896 9.5896 9.8316 9.8316 k = 0.1463 0.0437-0.2678 ( 4994 PWs) bands (ev): -20.5431 -20.5431 -20.5258 -20.5258 -8.3864 -8.3864 -7.9797 -7.9797 -7.1728 -7.1728 -6.9404 -6.9404 -5.2994 -5.2994 -5.2275 -5.2275 -5.1764 -5.1764 -4.8677 -4.8677 -3.7151 -3.7151 -3.6692 -3.6692 1.4122 1.4122 1.5481 1.5481 2.4651 2.4651 3.0428 3.0428 3.5098 3.5098 3.6105 3.6105 4.9291 4.9291 5.3715 5.3715 5.4033 5.4033 5.7479 5.7479 8.8632 8.8632 9.4196 9.4196 9.6168 9.6168 9.8418 9.8418 k = 0.1585 0.0474-0.2901 ( 4987 PWs) bands (ev): -20.5426 -20.5426 -20.5260 -20.5260 -8.3786 -8.3786 -7.9807 -7.9807 -7.1726 -7.1726 -6.9420 -6.9420 -5.3106 -5.3106 -5.2329 -5.2329 -5.1823 -5.1823 -4.8706 -4.8706 -3.7299 -3.7299 -3.6735 -3.6735 1.4487 1.4487 1.6075 1.6075 2.4979 2.4979 3.0370 3.0370 3.5100 3.5100 3.6092 3.6092 4.9233 4.9233 5.3433 5.3433 5.4213 5.4213 5.7283 5.7283 8.8757 8.8757 9.3795 9.3795 9.6476 9.6476 9.8535 9.8535 k = 0.1707 0.0510-0.3124 ( 4998 PWs) bands (ev): -20.5420 -20.5420 -20.5262 -20.5262 -8.3707 -8.3707 -7.9811 -7.9811 -7.1729 -7.1729 -6.9434 -6.9434 -5.3217 -5.3217 -5.2398 -5.2398 -5.1888 -5.1888 -4.8730 -4.8730 -3.7432 -3.7432 -3.6795 -3.6795 1.4885 1.4885 1.6697 1.6697 2.5316 2.5316 3.0317 3.0317 3.5093 3.5093 3.6089 3.6089 4.9168 4.9168 5.3126 5.3126 5.4410 5.4410 5.7080 5.7080 8.8907 8.8907 9.3408 9.3408 9.6789 9.6789 9.8658 9.8658 k = 0.1829 0.0547-0.3347 ( 5008 PWs) bands (ev): -20.5415 -20.5415 -20.5264 -20.5264 -8.3626 -8.3626 -7.9811 -7.9811 -7.1737 -7.1737 -6.9445 -6.9445 -5.3328 -5.3328 -5.2486 -5.2486 -5.1954 -5.1954 -4.8750 -4.8750 -3.7548 -3.7548 -3.6876 -3.6876 1.5317 1.5317 1.7340 1.7340 2.5661 2.5661 3.0271 3.0271 3.5080 3.5080 3.6093 3.6093 4.9097 4.9097 5.2828 5.2828 5.4592 5.4592 5.6874 5.6874 8.9081 8.9081 9.3028 9.3028 9.6988 9.6988 9.8752 9.8752 k = 0.1951 0.0583-0.3571 ( 5005 PWs) bands (ev): -20.5409 -20.5409 -20.5267 -20.5267 -8.3546 -8.3546 -7.9804 -7.9804 -7.1751 -7.1751 -6.9452 -6.9452 -5.3437 -5.3437 -5.2596 -5.2596 -5.2016 -5.2016 -4.8764 -4.8764 -3.7644 -3.7644 -3.6978 -3.6978 1.5782 1.5782 1.8002 1.8002 2.6010 2.6010 3.0232 3.0232 3.5063 3.5063 3.6098 3.6098 4.9021 4.9021 5.2547 5.2547 5.4751 5.4751 5.6665 5.6665 8.9275 8.9275 9.2645 9.2645 9.6718 9.6718 9.8640 9.8640 k = 0.2073 0.0620-0.3794 ( 5011 PWs) bands (ev): -20.5402 -20.5402 -20.5269 -20.5269 -8.3467 -8.3467 -7.9790 -7.9790 -7.1771 -7.1771 -6.9456 -6.9456 -5.3546 -5.3546 -5.2729 -5.2729 -5.2070 -5.2070 -4.8774 -4.8774 -3.7717 -3.7717 -3.7103 -3.7103 1.6280 1.6280 1.8678 1.8678 2.6361 2.6361 3.0203 3.0203 3.5044 3.5044 3.6099 3.6099 4.8941 4.8941 5.2290 5.2290 5.4883 5.4883 5.6456 5.6456 8.9482 8.9482 9.2246 9.2246 9.5901 9.5901 9.8894 9.8894 k = 0.2195 0.0656-0.4017 ( 5012 PWs) bands (ev): -20.5396 -20.5396 -20.5271 -20.5271 -8.3389 -8.3389 -7.9770 -7.9770 -7.1798 -7.1798 -6.9454 -6.9454 -5.3660 -5.3660 -5.2880 -5.2880 -5.2117 -5.2117 -4.8780 -4.8780 -3.7768 -3.7768 -3.7250 -3.7250 1.6808 1.6808 1.9364 1.9364 2.6710 2.6710 3.0185 3.0185 3.5023 3.5023 3.6094 3.6094 4.8858 4.8858 5.2061 5.2061 5.4984 5.4984 5.6252 5.6252 8.9684 8.9684 9.1817 9.1817 9.4901 9.4901 9.9214 9.9214 k = 0.2317 0.0693-0.4240 ( 5015 PWs) bands (ev): -20.5389 -20.5389 -20.5273 -20.5273 -8.3314 -8.3314 -7.9742 -7.9742 -7.1832 -7.1832 -6.9448 -6.9448 -5.3784 -5.3784 -5.3037 -5.3037 -5.2155 -5.2155 -4.8782 -4.8782 -3.7798 -3.7798 -3.7417 -3.7417 1.7366 1.7366 2.0057 2.0057 2.7056 2.7056 3.0181 3.0181 3.5002 3.5002 3.6081 3.6081 4.8772 4.8772 5.1862 5.1862 5.5051 5.5051 5.6056 5.6056 8.9841 8.9841 9.1344 9.1344 9.3900 9.3900 9.9356 9.9356 k = 0.2439 0.0729-0.4463 ( 5013 PWs) bands (ev): -20.5383 -20.5383 -20.5276 -20.5276 -8.3243 -8.3243 -7.9706 -7.9706 -7.1874 -7.1874 -6.9437 -6.9437 -5.3929 -5.3929 -5.3187 -5.3187 -5.2186 -5.2186 -4.8780 -4.8780 -3.7815 -3.7815 -3.7595 -3.7595 1.7951 1.7951 2.0753 2.0753 2.7396 2.7396 3.0192 3.0192 3.4980 3.4980 3.6057 3.6057 4.8685 4.8685 5.1696 5.1696 5.5082 5.5082 5.5873 5.5873 8.9859 8.9859 9.0813 9.0813 9.3036 9.3036 9.9456 9.9456 k = 0.2561 0.0766-0.4686 ( 5013 PWs) bands (ev): -20.5376 -20.5376 -20.5278 -20.5278 -8.3175 -8.3175 -7.9662 -7.9662 -7.1923 -7.1923 -6.9419 -6.9419 -5.4106 -5.4106 -5.3315 -5.3315 -5.2211 -5.2211 -4.8775 -4.8775 -3.7894 -3.7894 -3.7713 -3.7713 1.8560 1.8560 2.1449 2.1449 2.7728 2.7728 3.0218 3.0218 3.4956 3.4956 3.6024 3.6024 4.8599 4.8599 5.1564 5.1564 5.5072 5.5072 5.5707 5.5707 8.9565 8.9565 9.0217 9.0217 9.2503 9.2503 9.9518 9.9518 k = 0.2683 0.0802-0.4910 ( 5016 PWs) bands (ev): -20.5370 -20.5370 -20.5280 -20.5280 -8.3111 -8.3111 -7.9610 -7.9610 -7.1979 -7.1979 -6.9396 -6.9396 -5.4319 -5.4319 -5.3412 -5.3412 -5.2230 -5.2230 -4.8767 -4.8767 -3.8101 -3.8101 -3.7702 -3.7702 1.9190 1.9190 2.2140 2.2140 2.8048 2.8048 3.0261 3.0261 3.4928 3.4928 3.5981 3.5981 4.8513 4.8513 5.1465 5.1465 5.5022 5.5022 5.5564 5.5564 8.8874 8.8874 8.9552 8.9552 9.2394 9.2394 9.9553 9.9553 k = 0.2805 0.0838-0.5133 ( 5014 PWs) bands (ev): -20.5363 -20.5363 -20.5283 -20.5283 -8.3053 -8.3053 -7.9550 -7.9550 -7.2044 -7.2044 -6.9367 -6.9367 -5.4563 -5.4563 -5.3478 -5.3478 -5.2243 -5.2243 -4.8756 -4.8756 -3.8352 -3.8352 -3.7649 -3.7649 1.9839 1.9839 2.2823 2.2823 2.8354 2.8354 3.0321 3.0321 3.4896 3.4896 3.5933 3.5933 4.8430 4.8430 5.1398 5.1398 5.4938 5.4938 5.5440 5.5440 8.7932 8.7932 8.8824 8.8824 9.2568 9.2568 9.9593 9.9593 k = 0.2927 0.0875-0.5356 ( 5007 PWs) bands (ev): -20.5357 -20.5357 -20.5285 -20.5285 -8.2999 -8.2999 -7.9481 -7.9481 -7.2117 -7.2117 -6.9332 -6.9332 -5.4830 -5.4830 -5.3520 -5.3520 -5.2248 -5.2248 -4.8743 -4.8743 -3.8625 -3.8625 -3.7576 -3.7576 2.0502 2.0502 2.3494 2.3494 2.8644 2.8644 3.0397 3.0397 3.4856 3.4856 3.5881 3.5881 4.8350 4.8350 5.1358 5.1358 5.4832 5.4832 5.5328 5.5328 8.6888 8.6888 8.8040 8.8040 9.2878 9.2878 9.9664 9.9664 k = 0.3049 0.0911-0.5579 ( 5007 PWs) bands (ev): -20.5351 -20.5351 -20.5287 -20.5287 -8.2951 -8.2951 -7.9405 -7.9405 -7.2198 -7.2198 -6.9290 -6.9290 -5.5112 -5.5112 -5.3543 -5.3543 -5.2247 -5.2247 -4.8728 -4.8728 -3.8915 -3.8915 -3.7488 -3.7488 2.1176 2.1176 2.4150 2.4150 2.8916 2.8916 3.0491 3.0491 3.4807 3.4807 3.5830 3.5830 4.8275 4.8275 5.1343 5.1343 5.4717 5.4717 5.5221 5.5221 8.5813 8.5813 8.7213 8.7213 9.3255 9.3255 9.9781 9.9781 k = 0.3171 0.0948-0.5802 ( 5009 PWs) bands (ev): -20.5345 -20.5345 -20.5289 -20.5289 -8.2907 -8.2907 -7.9321 -7.9321 -7.2287 -7.2287 -6.9243 -6.9243 -5.5401 -5.5401 -5.3551 -5.3551 -5.2237 -5.2237 -4.8711 -4.8711 -3.9220 -3.9220 -3.7389 -3.7389 2.1857 2.1857 2.4788 2.4788 2.9167 2.9167 3.0600 3.0600 3.4746 3.4746 3.5783 3.5783 4.8204 4.8204 5.1347 5.1347 5.4598 5.4598 5.5119 5.5119 8.4741 8.4741 8.6354 8.6354 9.3666 9.3666 9.9946 9.9946 k = 0.3293 0.0984-0.6025 ( 5015 PWs) bands (ev): -20.5339 -20.5339 -20.5291 -20.5291 -8.2870 -8.2870 -7.9230 -7.9230 -7.2384 -7.2384 -6.9191 -6.9191 -5.5693 -5.5693 -5.3549 -5.3549 -5.2218 -5.2218 -4.8691 -4.8691 -3.9536 -3.9536 -3.7281 -3.7281 2.2541 2.2541 2.5403 2.5403 2.9395 2.9395 3.0723 3.0723 3.4675 3.4675 3.5742 3.5742 4.8140 4.8140 5.1367 5.1367 5.4477 5.4477 5.5026 5.5026 8.3690 8.3690 8.5478 8.5478 9.4091 9.4091 10.0158 10.0158 k = 0.3415 0.1021-0.6249 ( 5015 PWs) bands (ev): -20.5333 -20.5333 -20.5293 -20.5293 -8.2837 -8.2837 -7.9133 -7.9133 -7.2487 -7.2487 -6.9134 -6.9134 -5.5982 -5.5982 -5.3538 -5.3538 -5.2190 -5.2190 -4.8670 -4.8670 -3.9861 -3.9861 -3.7168 -3.7168 2.3222 2.3222 2.5994 2.5994 2.9599 2.9599 3.0859 3.0859 3.4593 3.4593 3.5707 3.5707 4.8082 4.8082 5.1396 5.1396 5.4350 5.4350 5.4951 5.4951 8.2671 8.2671 8.4596 8.4596 9.4518 9.4518 10.0408 10.0408 k = 0.3537 0.1057-0.6472 ( 5017 PWs) bands (ev): -20.5328 -20.5328 -20.5295 -20.5295 -8.2809 -8.2809 -7.9031 -7.9031 -7.2597 -7.2597 -6.9074 -6.9074 -5.6264 -5.6264 -5.3523 -5.3523 -5.2150 -5.2150 -4.8646 -4.8646 -4.0191 -4.0191 -3.7052 -3.7052 2.3896 2.3896 2.6557 2.6557 2.9777 2.9777 3.1005 3.1005 3.4503 3.4503 3.5678 3.5678 4.8030 4.8030 5.1433 5.1433 5.4212 5.4212 5.4904 5.4904 8.1693 8.1693 8.3721 8.3721 9.4934 9.4934 10.0690 10.0690 k = 0.3659 0.1094-0.6695 ( 5021 PWs) bands (ev): -20.5323 -20.5323 -20.5297 -20.5297 -8.2786 -8.2786 -7.8924 -7.8924 -7.2711 -7.2711 -6.9011 -6.9011 -5.6536 -5.6536 -5.3505 -5.3505 -5.2100 -5.2100 -4.8619 -4.8619 -4.0524 -4.0524 -3.6935 -3.6935 2.4559 2.4559 2.7090 2.7090 2.9930 2.9930 3.1158 3.1158 3.4406 3.4406 3.5654 3.5654 4.7985 4.7985 5.1472 5.1472 5.4063 5.4063 5.4887 5.4887 8.0762 8.0762 8.2865 8.2865 9.5331 9.5331 10.0995 10.0995 k = 0.3780 0.1130-0.6918 ( 5016 PWs) bands (ev): -20.5318 -20.5318 -20.5298 -20.5298 -8.2766 -8.2766 -7.8814 -7.8814 -7.2829 -7.2829 -6.8947 -6.8947 -5.6795 -5.6795 -5.3487 -5.3487 -5.2040 -5.2040 -4.8591 -4.8591 -4.0854 -4.0854 -3.6821 -3.6821 2.5205 2.5205 2.7591 2.7591 3.0057 3.0057 3.1314 3.1314 3.4305 3.4305 3.5633 3.5633 4.7945 4.7945 5.1513 5.1513 5.3906 5.3906 5.4901 5.4901 7.9884 7.9884 8.2037 8.2037 9.5701 9.5701 10.1315 10.1315 k = 0.3902 0.1167-0.7141 ( 5022 PWs) bands (ev): -20.5314 -20.5314 -20.5300 -20.5300 -8.2751 -8.2751 -7.8702 -7.8702 -7.2949 -7.2949 -6.8883 -6.8883 -5.7038 -5.7038 -5.3470 -5.3470 -5.1972 -5.1972 -4.8560 -4.8560 -4.1178 -4.1178 -3.6711 -3.6711 2.5829 2.5829 2.8057 2.8057 3.0160 3.0160 3.1469 3.1469 3.4201 3.4201 3.5614 3.5614 4.7911 4.7911 5.1554 5.1554 5.3747 5.3747 5.4939 5.4939 7.9067 7.9067 8.1249 8.1249 9.6036 9.6036 10.1642 10.1642 k = 0.4024 0.1203-0.7364 ( 5020 PWs) bands (ev): -20.5310 -20.5310 -20.5301 -20.5301 -8.2739 -8.2739 -7.8591 -7.8591 -7.3068 -7.3068 -6.8820 -6.8820 -5.7262 -5.7262 -5.3454 -5.3454 -5.1896 -5.1896 -4.8526 -4.8526 -4.1492 -4.1492 -3.6608 -3.6608 2.6424 2.6424 2.8487 2.8487 3.0239 3.0239 3.1620 3.1620 3.4095 3.4095 3.5594 3.5594 4.7881 4.7881 5.1594 5.1594 5.3593 5.3593 5.4996 5.4996 7.8315 7.8315 8.0509 8.0509 9.6333 9.6333 10.1968 10.1968 k = 0.4146 0.1239-0.7588 ( 5026 PWs) bands (ev): -20.5306 -20.5306 -20.5303 -20.5303 -8.2729 -8.2729 -7.8483 -7.8483 -7.3184 -7.3184 -6.8761 -6.8761 -5.7466 -5.7466 -5.3441 -5.3441 -5.1817 -5.1817 -4.8491 -4.8491 -4.1790 -4.1790 -3.6512 -3.6512 2.6986 2.6986 2.8877 2.8877 3.0298 3.0298 3.1761 3.1761 3.3987 3.3987 3.5574 3.5574 4.7855 4.7855 5.1633 5.1633 5.3448 5.3448 5.5065 5.5065 7.7633 7.7633 7.9828 7.9828 9.6588 9.6588 10.2285 10.2285 k = 0.4268 0.1276-0.7811 ( 5026 PWs) bands (ev): -20.5304 -20.5304 -20.5303 -20.5303 -8.2722 -8.2722 -7.8381 -7.8381 -7.3295 -7.3295 -6.8705 -6.8705 -5.7646 -5.7646 -5.3430 -5.3430 -5.1738 -5.1738 -4.8455 -4.8455 -4.2067 -4.2067 -3.6426 -3.6426 2.7506 2.7506 2.9227 2.9227 3.0339 3.0339 3.1890 3.1890 3.3878 3.3878 3.5553 3.5553 4.7832 4.7832 5.1671 5.1671 5.3318 5.3318 5.5140 5.5140 7.7028 7.7028 7.9215 7.9215 9.6802 9.6802 10.2585 10.2585 k = 0.4390 0.1312-0.8034 ( 5023 PWs) bands (ev): -20.5305 -20.5305 -20.5300 -20.5300 -8.2717 -8.2717 -7.8286 -7.8286 -7.3397 -7.3397 -6.8656 -6.8656 -5.7802 -5.7802 -5.3421 -5.3421 -5.1662 -5.1662 -4.8419 -4.8419 -4.2317 -4.2317 -3.6351 -3.6351 2.7977 2.7977 2.9532 2.9532 3.0366 3.0366 3.2003 3.2003 3.3771 3.3771 3.5531 3.5531 4.7811 4.7811 5.1707 5.1707 5.3205 5.3205 5.5214 5.5214 7.6505 7.6505 7.8679 7.8679 9.6975 9.6975 10.2858 10.2858 k = 0.4512 0.1349-0.8257 ( 5024 PWs) bands (ev): -20.5305 -20.5305 -20.5298 -20.5298 -8.2713 -8.2713 -7.8203 -7.8203 -7.3486 -7.3486 -6.8613 -6.8613 -5.7932 -5.7932 -5.3415 -5.3415 -5.1593 -5.1593 -4.8385 -4.8385 -4.2534 -4.2534 -3.6288 -3.6288 2.8390 2.8390 2.9790 2.9790 3.0380 3.0380 3.2097 3.2097 3.3668 3.3668 3.5510 3.5510 4.7793 4.7793 5.1740 5.1740 5.3111 5.3111 5.5282 5.5282 7.6069 7.6069 7.8227 7.8227 9.7110 9.7110 10.3097 10.3097 k = 0.4634 0.1385-0.8480 ( 5025 PWs) bands (ev): -20.5306 -20.5306 -20.5297 -20.5297 -8.2711 -8.2711 -7.8134 -7.8134 -7.3560 -7.3560 -6.8579 -6.8579 -5.8035 -5.8035 -5.3410 -5.3410 -5.1535 -5.1535 -4.8354 -4.8354 -4.2710 -4.2710 -3.6237 -3.6237 2.8734 2.8734 2.9996 2.9996 3.0385 3.0385 3.2170 3.2170 3.3576 3.3576 3.5491 3.5491 4.7778 4.7778 5.1767 5.1767 5.3038 5.3038 5.5340 5.5340 7.5725 7.5725 7.7867 7.7867 9.7211 9.7211 10.3293 10.3293 k = 0.4756 0.1422-0.8703 ( 5028 PWs) bands (ev): -20.5306 -20.5306 -20.5295 -20.5295 -8.2709 -8.2709 -7.8082 -7.8082 -7.3616 -7.3616 -6.8554 -6.8554 -5.8108 -5.8108 -5.3407 -5.3407 -5.1491 -5.1491 -4.8330 -4.8330 -4.2842 -4.2842 -3.6201 -3.6201 2.8996 2.8996 3.0147 3.0147 3.0384 3.0384 3.2221 3.2221 3.3501 3.3501 3.5476 3.5476 4.7767 4.7767 5.1788 5.1788 5.2987 5.2987 5.5384 5.5384 7.5476 7.5476 7.7605 7.7605 9.7280 9.7280 10.3439 10.3439 k = 0.4878 0.1458-0.8927 ( 5027 PWs) bands (ev): -20.5307 -20.5307 -20.5295 -20.5295 -8.2708 -8.2708 -7.8050 -7.8050 -7.3650 -7.3650 -6.8538 -6.8538 -5.8153 -5.8153 -5.3405 -5.3405 -5.1464 -5.1464 -4.8315 -4.8315 -4.2923 -4.2923 -3.6179 -3.6179 2.9161 2.9161 3.0239 3.0239 3.0381 3.0381 3.2251 3.2251 3.3452 3.3452 3.5467 3.5467 4.7760 4.7760 5.1801 5.1801 5.2956 5.2956 5.5411 5.5411 7.5325 7.5325 7.7446 7.7446 9.7321 9.7321 10.3529 10.3529 k = 0.5000 0.1495-0.9150 ( 5024 PWs) bands (ev): -20.5307 -20.5307 -20.5294 -20.5294 -8.2708 -8.2708 -7.8039 -7.8039 -7.3662 -7.3662 -6.8533 -6.8533 -5.8168 -5.8168 -5.3404 -5.3404 -5.1455 -5.1455 -4.8309 -4.8309 -4.2950 -4.2950 -3.6172 -3.6172 2.9218 2.9218 3.0270 3.0270 3.0379 3.0379 3.2261 3.2261 3.3435 3.3435 3.5463 3.5463 4.7757 4.7757 5.1806 5.1806 5.2946 5.2946 5.5420 5.5420 7.5274 7.5274 7.7393 7.7393 9.7334 9.7334 10.3559 10.3559 k = 0.5000 0.1495-0.9150 ( 5024 PWs) bands (ev): -20.5307 -20.5307 -20.5294 -20.5294 -8.2708 -8.2708 -7.8039 -7.8039 -7.3662 -7.3662 -6.8533 -6.8533 -5.8168 -5.8168 -5.3404 -5.3404 -5.1455 -5.1455 -4.8309 -4.8309 -4.2950 -4.2950 -3.6172 -3.6172 2.9218 2.9218 3.0270 3.0270 3.0379 3.0379 3.2261 3.2261 3.3435 3.3435 3.5463 3.5463 4.7757 4.7757 5.1806 5.1806 5.2946 5.2946 5.5420 5.5420 7.5274 7.5274 7.7393 7.7393 9.7334 9.7334 10.3559 10.3559 k = 0.4792 0.1432-0.9274 ( 5024 PWs) bands (ev): -20.5307 -20.5307 -20.5294 -20.5294 -8.2702 -8.2702 -7.8056 -7.8056 -7.3648 -7.3648 -6.8539 -6.8539 -5.8162 -5.8162 -5.3401 -5.3401 -5.1455 -5.1455 -4.8318 -4.8318 -4.2939 -4.2939 -3.6174 -3.6174 2.9211 2.9211 3.0249 3.0249 3.0374 3.0374 3.2271 3.2271 3.3436 3.3436 3.5436 3.5436 4.7774 4.7774 5.1807 5.1807 5.2961 5.2961 5.5421 5.5421 7.5295 7.5295 7.7411 7.7411 9.7336 9.7336 10.3559 10.3559 k = 0.4583 0.1370-0.9398 ( 5027 PWs) bands (ev): -20.5308 -20.5308 -20.5294 -20.5294 -8.2685 -8.2685 -7.8108 -7.8108 -7.3607 -7.3607 -6.8556 -6.8556 -5.8142 -5.8142 -5.3391 -5.3391 -5.1457 -5.1457 -4.8345 -4.8345 -4.2905 -4.2905 -3.6180 -3.6180 2.9189 2.9189 3.0186 3.0186 3.0362 3.0362 3.2299 3.2299 3.3438 3.3438 3.5355 3.5355 4.7826 4.7826 5.1808 5.1808 5.3006 5.3006 5.5422 5.5422 7.5356 7.5356 7.7467 7.7467 9.7340 9.7340 10.3557 10.3557 k = 0.4583 0.1370-0.9398 ( 5027 PWs) bands (ev): -20.5308 -20.5308 -20.5294 -20.5294 -8.2685 -8.2685 -7.8108 -7.8108 -7.3607 -7.3607 -6.8556 -6.8556 -5.8142 -5.8142 -5.3391 -5.3391 -5.1457 -5.1457 -4.8345 -4.8345 -4.2905 -4.2905 -3.6180 -3.6180 2.9189 2.9189 3.0186 3.0186 3.0362 3.0362 3.2299 3.2299 3.3438 3.3438 3.5355 3.5355 4.7826 4.7826 5.1808 5.1808 5.3006 5.3006 5.5422 5.5422 7.5356 7.5356 7.7467 7.7467 9.7340 9.7340 10.3557 10.3557 k = 0.4595 0.1374-0.9137 ( 5024 PWs) bands (ev): -20.5307 -20.5307 -20.5294 -20.5294 -8.2694 -8.2694 -7.8073 -7.8073 -7.3630 -7.3630 -6.8553 -6.8553 -5.8149 -5.8149 -5.3404 -5.3404 -5.1475 -5.1475 -4.8332 -4.8332 -4.2900 -4.2900 -3.6190 -3.6190 2.9232 2.9232 3.0264 3.0264 3.0375 3.0375 3.2262 3.2262 3.3422 3.3422 3.5416 3.5416 4.7799 4.7799 5.1814 5.1814 5.2985 5.2985 5.5432 5.5432 7.5285 7.5285 7.7389 7.7389 9.7369 9.7369 10.3564 10.3564 k = 0.4607 0.1377-0.8875 ( 5028 PWs) bands (ev): -20.5306 -20.5306 -20.5295 -20.5295 -8.2701 -8.2701 -7.8072 -7.8072 -7.3624 -7.3624 -6.8558 -6.8558 -5.8126 -5.8126 -5.3411 -5.3411 -5.1497 -5.1497 -4.8332 -4.8332 -4.2854 -4.2854 -3.6205 -3.6205 2.9131 2.9131 3.0237 3.0237 3.0385 3.0385 3.2225 3.2225 3.3453 3.3453 3.5461 3.5461 4.7783 4.7783 5.1805 5.1805 5.2988 5.2988 5.5415 5.5415 7.5355 7.5355 7.7465 7.7465 9.7347 9.7347 10.3503 10.3503 k = 0.4619 0.1381-0.8614 ( 5026 PWs) bands (ev): -20.5306 -20.5306 -20.5296 -20.5296 -8.2708 -8.2708 -7.8105 -7.8105 -7.3588 -7.3588 -6.8571 -6.8571 -5.8072 -5.8072 -5.3412 -5.3412 -5.1523 -5.1523 -4.8344 -4.8344 -4.2766 -4.2766 -3.6226 -3.6226 2.8898 2.8898 3.0105 3.0105 3.0387 3.0387 3.2187 3.2187 3.3526 3.3526 3.5487 3.5487 4.7777 4.7777 5.1783 5.1783 5.3016 5.3016 5.5372 5.5372 7.5565 7.5565 7.7693 7.7693 9.7271 9.7271 10.3378 10.3378 k = 0.4631 0.1384-0.8352 ( 5023 PWs) bands (ev): -20.5306 -20.5306 -20.5297 -20.5297 -8.2713 -8.2713 -7.8170 -7.8170 -7.3526 -7.3526 -6.8591 -6.8591 -5.7989 -5.7989 -5.3408 -5.3408 -5.1551 -5.1551 -4.8368 -4.8368 -4.2641 -4.2641 -3.6252 -3.6252 2.8549 2.8549 2.9872 2.9872 3.0383 3.0383 3.2147 3.2147 3.3628 3.3628 3.5492 3.5492 4.7783 4.7783 5.1750 5.1750 5.3069 5.3069 5.5304 5.5304 7.5911 7.5911 7.8067 7.8067 9.7144 9.7144 10.3196 10.3196 k = 0.4643 0.1388-0.8091 ( 5023 PWs) bands (ev): -20.5306 -20.5306 -20.5299 -20.5299 -8.2717 -8.2717 -7.8263 -7.8263 -7.3440 -7.3440 -6.8617 -6.8617 -5.7877 -5.7877 -5.3398 -5.3398 -5.1582 -5.1582 -4.8400 -4.8400 -4.2481 -4.2481 -3.6284 -3.6284 2.8099 2.8099 2.9550 2.9550 3.0376 3.0376 3.2101 3.2101 3.3739 3.3739 3.5472 3.5472 4.7802 4.7802 5.1710 5.1710 5.3149 5.3149 5.5214 5.5214 7.6385 7.6385 7.8580 7.8580 9.6968 9.6968 10.2960 10.2960 k = 0.4655 0.1391-0.7829 ( 5018 PWs) bands (ev): -20.5307 -20.5307 -20.5300 -20.5300 -8.2721 -8.2721 -7.8380 -7.8380 -7.3335 -7.3335 -6.8650 -6.8650 -5.7737 -5.7737 -5.3382 -5.3382 -5.1614 -5.1614 -4.8440 -4.8440 -4.2288 -4.2288 -3.6320 -3.6320 2.7565 2.7565 2.9150 2.9150 3.0370 3.0370 3.2046 3.2046 3.3846 3.3846 3.5427 3.5427 4.7836 4.7836 5.1667 5.1667 5.3255 5.3255 5.5106 5.5106 7.6979 7.6979 7.9220 7.9220 9.6746 9.6746 10.2675 10.2675 k = 0.4666 0.1395-0.7568 ( 5019 PWs) bands (ev): -20.5308 -20.5308 -20.5302 -20.5302 -8.2724 -8.2724 -7.8518 -7.8518 -7.3214 -7.3214 -6.8688 -6.8688 -5.7570 -5.7570 -5.3361 -5.3361 -5.1645 -5.1645 -4.8486 -4.8486 -4.2068 -4.2068 -3.6360 -3.6360 2.6960 2.6960 2.8682 2.8682 3.0364 3.0364 3.1981 3.1981 3.3935 3.3935 3.5356 3.5356 4.7886 4.7886 5.1624 5.1624 5.3385 5.3385 5.4985 5.4985 7.7680 7.7680 7.9976 7.9976 9.6486 9.6486 10.2345 10.2345 k = 0.4678 0.1398-0.7307 ( 5010 PWs) bands (ev): -20.5309 -20.5309 -20.5304 -20.5304 -8.2726 -8.2726 -7.8671 -7.8671 -7.3083 -7.3083 -6.8731 -6.8731 -5.7379 -5.7379 -5.3336 -5.3336 -5.1676 -5.1676 -4.8536 -4.8536 -4.1824 -4.1824 -3.6403 -3.6403 2.6297 2.6297 2.8154 2.8154 3.0356 3.0356 3.1907 3.1907 3.3998 3.3998 3.5262 3.5262 4.7956 4.7956 5.1585 5.1585 5.3537 5.3537 5.4856 5.4856 7.8477 7.8477 8.0835 8.0835 9.6194 9.6194 10.1974 10.1974 k = 0.4690 0.1402-0.7045 ( 5012 PWs) bands (ev): -20.5310 -20.5310 -20.5306 -20.5306 -8.2728 -8.2728 -7.8836 -7.8836 -7.2944 -7.2944 -6.8778 -6.8778 -5.7164 -5.7164 -5.3305 -5.3305 -5.1703 -5.1703 -4.8589 -4.8589 -4.1559 -4.1559 -3.6450 -3.6450 2.5586 2.5586 2.7575 2.7575 3.0345 3.0345 3.1825 3.1825 3.4026 3.4026 3.5154 3.5154 4.8048 4.8048 5.1554 5.1554 5.3702 5.3702 5.4731 5.4731 7.9355 7.9355 8.1783 8.1783 9.5877 9.5877 10.1568 10.1568 k = 0.4702 0.1406-0.6784 ( 5009 PWs) bands (ev): -20.5311 -20.5311 -20.5308 -20.5308 -8.2729 -8.2729 -7.9010 -7.9010 -7.2800 -7.2800 -6.8828 -6.8828 -5.6928 -5.6928 -5.3270 -5.3270 -5.1728 -5.1728 -4.8644 -4.8644 -4.1277 -4.1277 -3.6499 -3.6499 2.4837 2.4837 2.6950 2.6950 3.0330 3.0330 3.1735 3.1735 3.4010 3.4010 3.5044 3.5044 4.8161 4.8161 5.1532 5.1532 5.3862 5.3862 5.4626 5.4626 8.0303 8.0303 8.2809 8.2809 9.5547 9.5547 10.1130 10.1130 k = 0.4714 0.1409-0.6522 ( 5013 PWs) bands (ev): -20.5313 -20.5313 -20.5310 -20.5310 -8.2730 -8.2730 -7.9190 -7.9190 -7.2653 -7.2653 -6.8881 -6.8881 -5.6674 -5.6674 -5.3231 -5.3231 -5.1747 -5.1747 -4.8699 -4.8699 -4.0981 -4.0981 -3.6550 -3.6550 2.4057 2.4057 2.6287 2.6287 3.0308 3.0308 3.1641 3.1641 3.3942 3.3942 3.4945 3.4945 4.8297 4.8297 5.1521 5.1521 5.3974 5.3974 5.4585 5.4585 8.1304 8.1304 8.3897 8.3897 9.5212 9.5212 10.0665 10.0665 k = 0.4726 0.1413-0.6261 ( 5015 PWs) bands (ev): -20.5315 -20.5315 -20.5313 -20.5313 -8.2730 -8.2730 -7.9373 -7.9373 -7.2507 -7.2507 -6.8935 -6.8935 -5.6402 -5.6402 -5.3189 -5.3189 -5.1760 -5.1760 -4.8755 -4.8755 -4.0674 -4.0674 -3.6601 -3.6601 2.3255 2.3255 2.5591 2.5591 3.0277 3.0277 3.1542 3.1542 3.3819 3.3819 3.4866 3.4866 4.8455 4.8455 5.1520 5.1520 5.3986 5.3986 5.4659 5.4659 8.2343 8.2343 8.5037 8.5037 9.4885 9.4885 10.0176 10.0176 k = 0.4738 0.1416-0.5999 ( 5015 PWs) bands (ev): -20.5317 -20.5317 -20.5315 -20.5315 -8.2730 -8.2730 -7.9558 -7.9558 -7.2362 -7.2362 -6.8990 -6.8990 -5.6117 -5.6117 -5.3143 -5.3143 -5.1766 -5.1766 -4.8812 -4.8812 -4.0360 -4.0360 -3.6652 -3.6652 2.2437 2.2437 2.4868 2.4868 3.0236 3.0236 3.1440 3.1440 3.3648 3.3648 3.4808 3.4808 4.8633 4.8633 5.1529 5.1529 5.3919 5.3919 5.4827 5.4827 8.3403 8.3403 8.6216 8.6216 9.4580 9.4580 9.9666 9.9666 k = 0.4750 0.1420-0.5738 ( 5006 PWs) bands (ev): -20.5319 -20.5319 -20.5318 -20.5318 -8.2730 -8.2730 -7.9743 -7.9743 -7.2220 -7.2220 -6.9046 -6.9046 -5.5820 -5.5820 -5.3095 -5.3095 -5.1764 -5.1764 -4.8868 -4.8868 -4.0041 -4.0041 -3.6702 -3.6702 2.1611 2.1611 2.4122 2.4122 3.0186 3.0186 3.1338 3.1338 3.3442 3.3442 3.4764 3.4764 4.8831 4.8831 5.1547 5.1547 5.3824 5.3824 5.5036 5.5036 8.4459 8.4459 8.7420 8.7420 9.4317 9.4317 9.9139 9.9139 k = 0.4762 0.1423-0.5477 ( 5009 PWs) bands (ev): -20.5321 -20.5321 -20.5320 -20.5320 -8.2730 -8.2730 -7.9926 -7.9926 -7.2081 -7.2081 -6.9102 -6.9102 -5.5515 -5.5515 -5.3045 -5.3045 -5.1753 -5.1753 -4.8924 -4.8924 -3.9720 -3.9720 -3.6749 -3.6749 2.0783 2.0783 2.3361 2.3361 3.0124 3.0124 3.1235 3.1235 3.3216 3.3216 3.4728 3.4728 4.9045 4.9045 5.1574 5.1574 5.3730 5.3730 5.5256 5.5256 8.5482 8.5482 8.8638 8.8638 9.4122 9.4122 9.8597 9.8597 k = 0.4774 0.1427-0.5215 ( 5005 PWs) bands (ev): -20.5323 -20.5323 -20.5323 -20.5323 -8.2730 -8.2730 -8.0107 -8.0107 -7.1946 -7.1946 -6.9158 -6.9158 -5.5206 -5.5206 -5.2993 -5.2993 -5.1732 -5.1732 -4.8980 -4.8980 -3.9400 -3.9400 -3.6793 -3.6793 1.9959 1.9959 2.2587 2.2587 3.0053 3.0053 3.1131 3.1131 3.2981 3.2981 3.4695 3.4695 4.9274 4.9274 5.1609 5.1609 5.3646 5.3646 5.5474 5.5474 8.6432 8.6432 8.9855 8.9855 9.4031 9.4031 9.8043 9.8043 k = 0.4786 0.1430-0.4954 ( 5008 PWs) bands (ev): -20.5326 -20.5326 -20.5325 -20.5325 -8.2729 -8.2729 -8.0284 -8.0284 -7.1816 -7.1816 -6.9213 -6.9213 -5.4894 -5.4894 -5.2940 -5.2940 -5.1701 -5.1701 -4.9036 -4.9036 -3.9084 -3.9084 -3.6832 -3.6832 1.9146 1.9146 2.1808 2.1808 2.9972 2.9972 3.1028 3.1028 3.2744 3.2744 3.4659 3.4659 4.9515 4.9515 5.1653 5.1653 5.3579 5.3579 5.5684 5.5684 8.7255 8.7255 9.1059 9.1059 9.4092 9.4092 9.7479 9.7479 k = 0.4797 0.1434-0.4692 ( 5012 PWs) bands (ev): -20.5329 -20.5329 -20.5328 -20.5328 -8.2727 -8.2727 -8.0456 -8.0456 -7.1690 -7.1690 -6.9268 -6.9268 -5.4585 -5.4585 -5.2886 -5.2886 -5.1659 -5.1659 -4.9091 -4.9091 -3.8774 -3.8774 -3.6865 -3.6865 1.8349 1.8349 2.1027 2.1027 2.9883 2.9883 3.0924 3.0924 3.2516 3.2516 3.4618 3.4618 4.9764 4.9764 5.1705 5.1705 5.3529 5.3529 5.5880 5.5880 8.7898 8.7898 9.2234 9.2234 9.4357 9.4357 9.6908 9.6908 k = 0.4809 0.1438-0.4431 ( 5014 PWs) bands (ev): -20.5331 -20.5331 -20.5330 -20.5330 -8.2725 -8.2725 -8.0624 -8.0624 -7.1570 -7.1570 -6.9322 -6.9322 -5.4281 -5.4281 -5.2831 -5.2831 -5.1605 -5.1605 -4.9147 -4.9147 -3.8474 -3.8474 -3.6890 -3.6890 1.7575 1.7575 2.0249 2.0249 2.9789 2.9789 3.0818 3.0818 3.2301 3.2301 3.4570 3.4570 5.0021 5.0021 5.1770 5.1770 5.3498 5.3498 5.6057 5.6057 8.8325 8.8325 9.3365 9.3365 9.4849 9.4849 9.6337 9.6337 k = 0.4821 0.1441-0.4170 ( 5010 PWs) bands (ev): -20.5334 -20.5334 -20.5333 -20.5333 -8.2722 -8.2722 -8.0785 -8.0785 -7.1454 -7.1454 -6.9375 -6.9375 -5.3987 -5.3987 -5.2775 -5.2775 -5.1541 -5.1541 -4.9201 -4.9201 -3.8186 -3.8186 -3.6907 -3.6907 1.6828 1.6828 1.9480 1.9480 2.9690 2.9690 3.0708 3.0708 3.2108 3.2108 3.4512 3.4512 5.0281 5.0281 5.1848 5.1848 5.3482 5.3482 5.6212 5.6212 8.8549 8.8549 9.4435 9.4435 9.5468 9.5468 9.5852 9.5852 k = 0.4833 0.1445-0.3908 ( 5004 PWs) bands (ev): -20.5336 -20.5336 -20.5335 -20.5335 -8.2718 -8.2718 -8.0940 -8.0940 -7.1343 -7.1343 -6.9427 -6.9427 -5.3707 -5.3707 -5.2718 -5.2718 -5.1466 -5.1466 -4.9256 -4.9256 -3.7913 -3.7913 -3.6913 -3.6913 1.6114 1.6114 1.8723 1.8723 2.9590 2.9590 3.0592 3.0592 3.1940 3.1940 3.4443 3.4443 5.0542 5.0542 5.1942 5.1942 5.3481 5.3481 5.6343 5.6343 8.8617 8.8617 9.5117 9.5117 9.5436 9.5436 9.6492 9.6492 k = 0.4845 0.1448-0.3647 ( 5006 PWs) bands (ev): -20.5339 -20.5339 -20.5338 -20.5338 -8.2713 -8.2713 -8.1089 -8.1089 -7.1237 -7.1237 -6.9478 -6.9478 -5.3443 -5.3443 -5.2661 -5.2661 -5.1379 -5.1379 -4.9310 -4.9310 -3.7658 -3.7658 -3.6907 -3.6907 1.5438 1.5438 1.7983 1.7983 2.9491 2.9491 3.0467 3.0467 3.1804 3.1804 3.4361 3.4361 5.0802 5.0802 5.2056 5.2056 5.3490 5.3490 5.6446 5.6446 8.8585 8.8585 9.4550 9.4550 9.6338 9.6338 9.7462 9.7462 k = 0.4857 0.1452-0.3385 ( 5003 PWs) bands (ev): -20.5341 -20.5341 -20.5340 -20.5340 -8.2706 -8.2706 -8.1231 -8.1231 -7.1135 -7.1135 -6.9529 -6.9529 -5.3200 -5.3200 -5.2604 -5.2604 -5.1282 -5.1282 -4.9364 -4.9364 -3.7426 -3.7426 -3.6885 -3.6885 1.4804 1.4804 1.7264 1.7264 2.9394 2.9394 3.0333 3.0333 3.1700 3.1700 3.4266 3.4266 5.1058 5.1058 5.2190 5.2190 5.3508 5.3508 5.6520 5.6520 8.8496 8.8496 9.3974 9.3974 9.7142 9.7142 9.8490 9.8490 k = 0.4869 0.1455-0.3124 ( 4999 PWs) bands (ev): -20.5344 -20.5344 -20.5342 -20.5342 -8.2698 -8.2698 -8.1366 -8.1366 -7.1037 -7.1037 -6.9580 -6.9580 -5.2980 -5.2980 -5.2546 -5.2546 -5.1176 -5.1176 -4.9417 -4.9417 -3.7224 -3.7224 -3.6844 -3.6844 1.4217 1.4217 1.6571 1.6571 2.9301 2.9301 3.0192 3.0192 3.1631 3.1631 3.4158 3.4158 5.1310 5.1310 5.2346 5.2346 5.3530 5.3530 5.6564 5.6564 8.8380 8.8380 9.3404 9.3404 9.7840 9.7840 9.9524 9.9524 k = 0.4881 0.1459-0.2862 ( 4995 PWs) bands (ev): -20.5346 -20.5346 -20.5344 -20.5344 -8.2687 -8.2687 -8.1494 -8.1494 -7.0944 -7.0944 -6.9631 -6.9631 -5.2786 -5.2786 -5.2487 -5.2487 -5.1061 -5.1061 -4.9470 -4.9470 -3.7060 -3.7060 -3.6775 -3.6775 1.3681 1.3681 1.5908 1.5908 2.9215 2.9215 3.0047 3.0047 3.1594 3.1594 3.4036 3.4036 5.1554 5.1554 5.2522 5.2522 5.3554 5.3554 5.6576 5.6576 8.8258 8.8258 9.2844 9.2844 9.8432 9.8432 10.0506 10.0506 k = 0.4893 0.1463-0.2601 ( 4997 PWs) bands (ev): -20.5348 -20.5348 -20.5346 -20.5346 -8.2673 -8.2673 -8.1614 -8.1614 -7.0854 -7.0854 -6.9681 -6.9681 -5.2618 -5.2618 -5.2429 -5.2429 -5.0942 -5.0942 -4.9522 -4.9522 -3.6940 -3.6940 -3.6675 -3.6675 1.3200 1.3200 1.5278 1.5278 2.9137 2.9137 2.9902 2.9902 3.1585 3.1585 3.3902 3.3902 5.1789 5.1789 5.2717 5.2717 5.3580 5.3580 5.6557 5.6557 8.8145 8.8145 9.2297 9.2297 9.8925 9.8925 10.1309 10.1309 k = 0.4905 0.1466-0.2340 ( 4991 PWs) bands (ev): -20.5349 -20.5349 -20.5348 -20.5348 -8.2657 -8.2657 -8.1728 -8.1728 -7.0768 -7.0768 -6.9733 -6.9733 -5.2477 -5.2477 -5.2371 -5.2371 -5.0819 -5.0819 -4.9574 -4.9574 -3.6850 -3.6850 -3.6560 -3.6560 1.2778 1.2778 1.4686 1.4686 2.9069 2.9069 2.9759 2.9759 3.1604 3.1604 3.3757 3.3757 5.2015 5.2015 5.2927 5.2927 5.3606 5.3606 5.6506 5.6506 8.8050 8.8050 9.1768 9.1768 9.9330 9.9330 10.1661 10.1661 k = 0.4917 0.1470-0.2078 ( 4989 PWs) bands (ev): -20.5351 -20.5351 -20.5350 -20.5350 -8.2638 -8.2638 -8.1834 -8.1834 -7.0685 -7.0685 -6.9784 -6.9784 -5.2363 -5.2363 -5.2310 -5.2310 -5.0697 -5.0697 -4.9625 -4.9625 -3.6770 -3.6770 -3.6453 -3.6453 1.2416 1.2416 1.4135 1.4135 2.9011 2.9011 2.9622 2.9622 3.1646 3.1646 3.3603 3.3603 5.2229 5.2229 5.3141 5.3141 5.3637 5.3637 5.6423 5.6423 8.7982 8.7982 9.1260 9.1260 9.9660 9.9660 10.1636 10.1636 k = 0.4929 0.1473-0.1817 ( 4983 PWs) bands (ev): -20.5352 -20.5352 -20.5351 -20.5351 -8.2615 -8.2615 -8.1932 -8.1932 -7.0605 -7.0605 -6.9837 -6.9837 -5.2283 -5.2283 -5.2242 -5.2242 -5.0578 -5.0578 -4.9676 -4.9676 -3.6692 -3.6692 -3.6362 -3.6362 1.2118 1.2118 1.3630 1.3630 2.8965 2.8965 2.9493 2.9493 3.1710 3.1710 3.3441 3.3441 5.2430 5.2430 5.3334 5.3334 5.3696 5.3696 5.6310 5.6310 8.7946 8.7946 9.0777 9.0777 9.9926 9.9926 10.1506 10.1506 k = 0.4940 0.1477-0.1555 ( 4987 PWs) bands (ev): -20.5353 -20.5353 -20.5353 -20.5353 -8.2587 -8.2587 -8.2024 -8.2024 -7.0528 -7.0528 -6.9891 -6.9891 -5.2225 -5.2225 -5.2175 -5.2175 -5.0464 -5.0464 -4.9727 -4.9727 -3.6614 -3.6614 -3.6294 -3.6294 1.1885 1.1885 1.3173 1.3173 2.8932 2.8932 2.9375 2.9375 3.1793 3.1793 3.3273 3.3273 5.2616 5.2616 5.3447 5.3447 5.3834 5.3834 5.6168 5.6168 8.7947 8.7947 9.0323 9.0323 10.0141 10.0141 10.1361 10.1361 k = 0.4952 0.1480-0.1294 ( 4999 PWs) bands (ev): -20.5354 -20.5354 -20.5354 -20.5354 -8.2556 -8.2556 -8.2108 -8.2108 -7.0454 -7.0454 -6.9946 -6.9946 -5.2178 -5.2178 -5.2122 -5.2122 -5.0358 -5.0358 -4.9779 -4.9779 -3.6536 -3.6536 -3.6248 -3.6248 1.1719 1.1719 1.2768 1.2768 2.8912 2.8912 2.9268 2.9268 3.1893 3.1893 3.3102 3.3102 5.2785 5.2785 5.3476 5.3476 5.4055 5.4055 5.5998 5.5998 8.7988 8.7988 8.9901 8.9901 10.0316 10.0316 10.1223 10.1223 k = 0.4964 0.1484-0.1032 ( 5000 PWs) bands (ev): -20.5355 -20.5355 -20.5355 -20.5355 -8.2520 -8.2520 -8.2186 -8.2186 -7.0383 -7.0383 -7.0002 -7.0002 -5.2137 -5.2137 -5.2085 -5.2085 -5.0261 -5.0261 -4.9833 -4.9833 -3.6461 -3.6461 -3.6226 -3.6226 1.1620 1.1620 1.2418 1.2418 2.8906 2.8906 2.9174 2.9174 3.2010 3.2010 3.2931 3.2931 5.2937 5.2937 5.3461 5.3461 5.4310 5.4310 5.5804 5.5804 8.8073 8.8073 8.9515 8.9515 10.0460 10.0460 10.1099 10.1099 k = 0.4976 0.1487-0.0771 ( 5000 PWs) bands (ev): -20.5356 -20.5356 -20.5355 -20.5355 -8.2479 -8.2479 -8.2257 -8.2257 -7.0314 -7.0314 -7.0061 -7.0061 -5.2103 -5.2103 -5.2063 -5.2063 -5.0172 -5.0172 -4.9891 -4.9891 -3.6391 -3.6391 -3.6225 -3.6225 1.1589 1.1589 1.2127 1.2127 2.8914 2.8914 2.9094 2.9094 3.2140 3.2140 3.2761 3.2761 5.3071 5.3071 5.3421 5.3421 5.4576 5.4576 5.5588 5.5588 8.8201 8.8201 8.9166 8.9166 10.0581 10.0581 10.0987 10.0987 k = 0.4988 0.1491-0.0510 ( 5001 PWs) bands (ev): -20.5356 -20.5356 -20.5356 -20.5356 -8.2432 -8.2432 -8.2322 -8.2322 -7.0247 -7.0247 -7.0121 -7.0121 -5.2077 -5.2077 -5.2056 -5.2056 -5.0091 -5.0091 -4.9952 -4.9952 -3.6329 -3.6329 -3.6243 -3.6243 1.1626 1.1626 1.1896 1.1896 2.8937 2.8937 2.9027 2.9027 3.2282 3.2282 3.2594 3.2594 5.3187 5.3187 5.3362 5.3362 5.4842 5.4842 5.5353 5.5353 8.8376 8.8376 8.8859 8.8859 10.0688 10.0688 10.0884 10.0884 k = 0.5000 0.1495-0.0248 ( 5006 PWs) bands (ev): -20.5356 -20.5356 -20.5356 -20.5356 -8.2380 -8.2380 -8.2380 -8.2380 -7.0183 -7.0183 -7.0183 -7.0183 -5.2061 -5.2061 -5.2061 -5.2061 -5.0018 -5.0018 -5.0018 -5.0018 -3.6279 -3.6279 -3.6279 -3.6279 1.1728 1.1728 1.1728 1.1728 2.8975 2.8975 2.8975 2.8975 3.2434 3.2434 3.2434 3.2434 5.3284 5.3284 5.3284 5.3284 5.5102 5.5102 5.5102 5.5102 8.8595 8.8595 8.8595 8.8595 10.0787 10.0787 10.0787 10.0787 k = 0.5000 0.1495-0.0248 ( 5006 PWs) bands (ev): -20.5356 -20.5356 -20.5356 -20.5356 -8.2380 -8.2380 -8.2380 -8.2380 -7.0183 -7.0183 -7.0183 -7.0183 -5.2061 -5.2061 -5.2061 -5.2061 -5.0018 -5.0018 -5.0018 -5.0018 -3.6279 -3.6279 -3.6279 -3.6279 1.1728 1.1728 1.1728 1.1728 2.8975 2.8975 2.8975 2.8975 3.2434 3.2434 3.2434 3.2434 5.3284 5.3284 5.3284 5.3284 5.5102 5.5102 5.5102 5.5102 8.8595 8.8595 8.8595 8.8595 10.0787 10.0787 10.0787 10.0787 k = 0.5075 0.1244-0.0248 ( 5008 PWs) bands (ev): -20.5356 -20.5356 -20.5356 -20.5356 -8.2398 -8.2398 -8.2359 -8.2359 -7.0228 -7.0228 -7.0141 -7.0141 -5.2074 -5.2074 -5.2060 -5.2060 -5.0040 -5.0040 -4.9996 -4.9996 -3.6281 -3.6281 -3.6279 -3.6279 1.1731 1.1731 1.1743 1.1743 2.8921 2.8921 2.8987 2.8987 3.2417 3.2417 3.2496 3.2496 5.3265 5.3265 5.3282 5.3282 5.5109 5.5109 5.5116 5.5116 8.8616 8.8616 8.8617 8.8617 10.0773 10.0773 10.0783 10.0783 k = 0.5150 0.0993-0.0248 ( 5012 PWs) bands (ev): -20.5355 -20.5355 -20.5355 -20.5355 -8.2414 -8.2414 -8.2336 -8.2336 -7.0276 -7.0276 -7.0102 -7.0102 -5.2098 -5.2098 -5.2070 -5.2070 -5.0060 -5.0060 -4.9973 -4.9973 -3.6287 -3.6287 -3.6283 -3.6283 1.1750 1.1750 1.1775 1.1775 2.8831 2.8831 2.8957 2.8957 3.2444 3.2444 3.2598 3.2598 5.3229 5.3229 5.3262 5.3262 5.5133 5.5133 5.5147 5.5147 8.8678 8.8678 8.8681 8.8681 10.0744 10.0744 10.0763 10.0763 k = 0.5225 0.0742-0.0248 ( 5006 PWs) bands (ev): -20.5354 -20.5354 -20.5354 -20.5354 -8.2427 -8.2427 -8.2311 -8.2311 -7.0326 -7.0326 -7.0067 -7.0067 -5.2133 -5.2133 -5.2091 -5.2091 -5.0079 -5.0079 -4.9950 -4.9950 -3.6296 -3.6296 -3.6289 -3.6289 1.1786 1.1786 1.1823 1.1823 2.8711 2.8711 2.8888 2.8888 3.2514 3.2514 3.2732 3.2732 5.3176 5.3176 5.3225 5.3225 5.5176 5.5176 5.5194 5.5194 8.8781 8.8781 8.8786 8.8786 10.0703 10.0703 10.0732 10.0732 k = 0.5300 0.0491-0.0248 ( 5000 PWs) bands (ev): -20.5352 -20.5352 -20.5352 -20.5352 -8.2438 -8.2438 -8.2283 -8.2283 -7.0379 -7.0379 -7.0035 -7.0035 -5.2178 -5.2178 -5.2122 -5.2122 -5.0099 -5.0099 -4.9930 -4.9930 -3.6308 -3.6308 -3.6296 -3.6296 1.1840 1.1840 1.1889 1.1889 2.8570 2.8570 2.8786 2.8786 3.2618 3.2618 3.2891 3.2891 5.3110 5.3110 5.3173 5.3173 5.5233 5.5233 5.5255 5.5255 8.8923 8.8923 8.8929 8.8929 10.0657 10.0657 10.0693 10.0693 k = 0.5375 0.0240-0.0248 ( 5002 PWs) bands (ev): -20.5350 -20.5350 -20.5350 -20.5350 -8.2446 -8.2446 -8.2254 -8.2254 -7.0433 -7.0433 -7.0007 -7.0007 -5.2231 -5.2231 -5.2161 -5.2161 -5.0119 -5.0119 -4.9913 -4.9913 -3.6323 -3.6323 -3.6306 -3.6306 1.1910 1.1910 1.1970 1.1970 2.8415 2.8415 2.8659 2.8659 3.2749 3.2749 3.3065 3.3065 5.3034 5.3034 5.3111 5.3111 5.5302 5.5302 5.5327 5.5327 8.9101 8.9101 8.9109 8.9109 10.0613 10.0613 10.0656 10.0656 k = 0.5450-0.0011-0.0248 ( 5006 PWs) bands (ev): -20.5348 -20.5348 -20.5348 -20.5348 -8.2452 -8.2452 -8.2223 -8.2223 -7.0489 -7.0489 -6.9982 -6.9982 -5.2290 -5.2290 -5.2207 -5.2207 -5.0142 -5.0142 -4.9903 -4.9903 -3.6341 -3.6341 -3.6316 -3.6316 1.1997 1.1997 1.2068 1.2068 2.8252 2.8252 2.8516 2.8516 3.2897 3.2897 3.3248 3.3248 5.2951 5.2951 5.3041 5.3041 5.5381 5.5381 5.5408 5.5408 8.9311 8.9311 8.9322 8.9322 10.0578 10.0578 10.0628 10.0628 k = 0.5525-0.0262-0.0248 ( 5008 PWs) bands (ev): -20.5345 -20.5345 -20.5345 -20.5345 -8.2455 -8.2455 -8.2189 -8.2189 -7.0546 -7.0546 -6.9961 -6.9961 -5.2354 -5.2354 -5.2258 -5.2258 -5.0169 -5.0169 -4.9899 -4.9899 -3.6362 -3.6362 -3.6327 -3.6327 1.2100 1.2100 1.2181 1.2181 2.8088 2.8088 2.8362 2.8362 3.3054 3.3054 3.3434 3.3434 5.2864 5.2864 5.2967 5.2967 5.5467 5.5467 5.5496 5.5496 8.9551 8.9551 8.9565 8.9565 10.0562 10.0562 10.0618 10.0618 k = 0.5600-0.0513-0.0248 ( 5002 PWs) bands (ev): -20.5342 -20.5342 -20.5342 -20.5342 -8.2456 -8.2456 -8.2155 -8.2155 -7.0603 -7.0603 -6.9942 -6.9942 -5.2422 -5.2422 -5.2313 -5.2313 -5.0202 -5.0202 -4.9906 -4.9906 -3.6385 -3.6385 -3.6338 -3.6338 1.2220 1.2220 1.2310 1.2310 2.7925 2.7925 2.8204 2.8204 3.3215 3.3215 3.3617 3.3617 5.2776 5.2776 5.2892 5.2892 5.5558 5.5558 5.5587 5.5587 8.9816 8.9816 8.9834 8.9834 10.0571 10.0571 10.0632 10.0632 k = 0.5675-0.0764-0.0248 ( 5002 PWs) bands (ev): -20.5338 -20.5338 -20.5338 -20.5338 -8.2455 -8.2455 -8.2119 -8.2119 -7.0660 -7.0660 -6.9927 -6.9927 -5.2491 -5.2491 -5.2371 -5.2371 -5.0241 -5.0241 -4.9923 -4.9923 -3.6411 -3.6411 -3.6348 -3.6348 1.2356 1.2356 1.2453 1.2453 2.7769 2.7769 2.8047 2.8047 3.3374 3.3374 3.3794 3.3794 5.2690 5.2690 5.2819 5.2819 5.5651 5.5651 5.5682 5.5682 9.0102 9.0102 9.0124 9.0124 10.0612 10.0612 10.0678 10.0678 k = 0.5750-0.1015-0.0248 ( 5012 PWs) bands (ev): -20.5334 -20.5334 -20.5334 -20.5334 -8.2452 -8.2452 -8.2082 -8.2082 -7.0716 -7.0716 -6.9915 -6.9915 -5.2560 -5.2560 -5.2430 -5.2430 -5.0289 -5.0289 -4.9953 -4.9953 -3.6438 -3.6438 -3.6356 -3.6356 1.2507 1.2507 1.2612 1.2612 2.7621 2.7621 2.7894 2.7894 3.3525 3.3525 3.3960 3.3960 5.2608 5.2608 5.2749 5.2749 5.5746 5.5746 5.5777 5.5777 9.0407 9.0407 9.0434 9.0434 10.0687 10.0687 10.0759 10.0759 k = 0.5825-0.1266-0.0248 ( 5014 PWs) bands (ev): -20.5330 -20.5330 -20.5330 -20.5330 -8.2447 -8.2447 -8.2045 -8.2045 -7.0771 -7.0771 -6.9906 -6.9906 -5.2629 -5.2629 -5.2489 -5.2489 -5.0344 -5.0344 -4.9996 -4.9996 -3.6467 -3.6467 -3.6363 -3.6363 1.2674 1.2674 1.2785 1.2785 2.7484 2.7484 2.7748 2.7748 3.3666 3.3666 3.4113 3.4113 5.2531 5.2531 5.2685 5.2685 5.5840 5.5840 5.5872 5.5872 9.0727 9.0727 9.0758 9.0758 10.0797 10.0797 10.0877 10.0877 k = 0.5900-0.1517-0.0248 ( 5008 PWs) bands (ev): -20.5325 -20.5325 -20.5325 -20.5325 -8.2439 -8.2439 -8.2006 -8.2006 -7.0825 -7.0825 -6.9900 -6.9900 -5.2695 -5.2695 -5.2546 -5.2546 -5.0409 -5.0409 -5.0054 -5.0054 -3.6497 -3.6497 -3.6368 -3.6368 1.2855 1.2855 1.2971 1.2971 2.7360 2.7360 2.7611 2.7611 3.3793 3.3793 3.4249 3.4249 5.2461 5.2461 5.2629 5.2629 5.5932 5.5932 5.5965 5.5965 9.1059 9.1059 9.1097 9.1097 10.0940 10.0940 10.1030 10.1030 k = 0.5975-0.1768-0.0248 ( 5020 PWs) bands (ev): -20.5321 -20.5321 -20.5321 -20.5321 -8.2430 -8.2430 -8.1968 -8.1968 -7.0877 -7.0877 -6.9896 -6.9896 -5.2758 -5.2758 -5.2602 -5.2602 -5.0484 -5.0484 -5.0127 -5.0127 -3.6529 -3.6529 -3.6371 -3.6371 1.3051 1.3051 1.3171 1.3171 2.7251 2.7251 2.7486 2.7486 3.3904 3.3904 3.4367 3.4367 5.2400 5.2400 5.2581 5.2581 5.6021 5.6021 5.6055 5.6055 9.1403 9.1403 9.1446 9.1446 10.1107 10.1107 10.1210 10.1210 k = 0.6050-0.2019-0.0248 ( 5018 PWs) bands (ev): -20.5316 -20.5316 -20.5316 -20.5316 -8.2419 -8.2419 -8.1929 -8.1929 -7.0926 -7.0926 -6.9894 -6.9894 -5.2817 -5.2817 -5.2655 -5.2655 -5.0568 -5.0568 -5.0215 -5.0215 -3.6562 -3.6562 -3.6371 -3.6371 1.3261 1.3261 1.3384 1.3384 2.7158 2.7158 2.7374 2.7374 3.3998 3.3998 3.4465 3.4465 5.2349 5.2349 5.2543 5.2543 5.6105 5.6105 5.6140 5.6140 9.1757 9.1757 9.1806 9.1806 10.1280 10.1280 10.1403 10.1403 k = 0.6125-0.2270-0.0248 ( 5022 PWs) bands (ev): -20.5311 -20.5311 -20.5311 -20.5311 -8.2406 -8.2406 -8.1890 -8.1890 -7.0972 -7.0972 -6.9895 -6.9895 -5.2872 -5.2872 -5.2705 -5.2705 -5.0662 -5.0662 -5.0319 -5.0319 -3.6596 -3.6596 -3.6368 -3.6368 1.3485 1.3485 1.3609 1.3609 2.7081 2.7081 2.7276 2.7276 3.4072 3.4072 3.4542 3.4542 5.2308 5.2308 5.2515 5.2515 5.6183 5.6183 5.6220 5.6220 9.2119 9.2119 9.2174 9.2174 10.1429 10.1429 10.1577 10.1577 k = 0.6200-0.2521-0.0248 ( 5024 PWs) bands (ev): -20.5305 -20.5305 -20.5305 -20.5305 -8.2391 -8.2391 -8.1851 -8.1851 -7.1014 -7.1014 -6.9897 -6.9897 -5.2922 -5.2922 -5.2750 -5.2750 -5.0765 -5.0765 -5.0438 -5.0438 -3.6631 -3.6631 -3.6363 -3.6363 1.3722 1.3722 1.3846 1.3846 2.7024 2.7024 2.7193 2.7193 3.4126 3.4126 3.4596 3.4596 5.2278 5.2278 5.2497 5.2497 5.6255 5.6255 5.6294 5.6294 9.2489 9.2489 9.2550 9.2550 10.1507 10.1507 10.1683 10.1683 k = 0.6275-0.2772-0.0248 ( 5024 PWs) bands (ev): -20.5300 -20.5300 -20.5300 -20.5300 -8.2375 -8.2375 -8.1813 -8.1813 -7.1054 -7.1054 -6.9902 -6.9902 -5.2966 -5.2966 -5.2791 -5.2791 -5.0877 -5.0877 -5.0572 -5.0572 -3.6668 -3.6668 -3.6357 -3.6357 1.3971 1.3971 1.4095 1.4095 2.6984 2.6984 2.7127 2.7127 3.4160 3.4160 3.4628 3.4628 5.2258 5.2258 5.2489 5.2489 5.6319 5.6319 5.6359 5.6359 9.2865 9.2865 9.2931 9.2931 10.1472 10.1472 10.1664 10.1664 k = 0.6350-0.3023-0.0248 ( 5026 PWs) bands (ev): -20.5295 -20.5295 -20.5295 -20.5295 -8.2357 -8.2357 -8.1775 -8.1775 -7.1089 -7.1089 -6.9908 -6.9908 -5.3004 -5.3004 -5.2826 -5.2826 -5.0997 -5.0997 -5.0721 -5.0721 -3.6706 -3.6706 -3.6348 -3.6348 1.4233 1.4233 1.4356 1.4356 2.6964 2.6964 2.7078 2.7078 3.4175 3.4175 3.4637 3.4637 5.2250 5.2250 5.2491 5.2491 5.6375 5.6375 5.6416 5.6416 9.3242 9.3242 9.3314 9.3314 10.1316 10.1316 10.1505 10.1505 k = 0.6426-0.3274-0.0248 ( 5032 PWs) bands (ev): -20.5290 -20.5290 -20.5290 -20.5290 -8.2337 -8.2337 -8.1738 -8.1738 -7.1120 -7.1120 -6.9917 -6.9917 -5.3036 -5.3036 -5.2856 -5.2856 -5.1124 -5.1124 -5.0882 -5.0882 -3.6746 -3.6746 -3.6339 -3.6339 1.4507 1.4507 1.4627 1.4627 2.6964 2.6964 2.7046 2.7046 3.4169 3.4169 3.4625 3.4625 5.2251 5.2251 5.2501 5.2501 5.6423 5.6423 5.6464 5.6464 9.3615 9.3615 9.3691 9.3691 10.1074 10.1074 10.1252 10.1252 k = 0.6501-0.3525-0.0248 ( 5036 PWs) bands (ev): -20.5284 -20.5284 -20.5284 -20.5284 -8.2316 -8.2316 -8.1702 -8.1702 -7.1147 -7.1147 -6.9927 -6.9927 -5.3062 -5.3062 -5.2879 -5.2879 -5.1257 -5.1257 -5.1056 -5.1056 -3.6788 -3.6788 -3.6328 -3.6328 1.4792 1.4792 1.4909 1.4909 2.6984 2.6984 2.7032 2.7032 3.4145 3.4145 3.4591 3.4591 5.2262 5.2262 5.2518 5.2518 5.6462 5.6462 5.6501 5.6501 9.3974 9.3974 9.4053 9.4053 10.0795 10.0795 10.0958 10.0958 k = 0.6576-0.3776-0.0248 ( 5036 PWs) bands (ev): -20.5279 -20.5279 -20.5279 -20.5279 -8.2293 -8.2293 -8.1666 -8.1666 -7.1170 -7.1170 -6.9940 -6.9940 -5.3081 -5.3081 -5.2896 -5.2896 -5.1395 -5.1395 -5.1241 -5.1241 -3.6832 -3.6832 -3.6318 -3.6318 1.5089 1.5089 1.5202 1.5202 2.7023 2.7023 2.7035 2.7035 3.4104 3.4104 3.4537 3.4537 5.2282 5.2282 5.2543 5.2543 5.6491 5.6491 5.6528 5.6528 9.4302 9.4302 9.4382 9.4382 10.0521 10.0521 10.0669 10.0669 k = 0.6651-0.4027-0.0248 ( 5040 PWs) bands (ev): -20.5274 -20.5274 -20.5274 -20.5274 -8.2268 -8.2268 -8.1631 -8.1631 -7.1188 -7.1188 -6.9954 -6.9954 -5.3095 -5.3095 -5.2907 -5.2907 -5.1536 -5.1536 -5.1436 -5.1436 -3.6879 -3.6879 -3.6309 -3.6309 1.5395 1.5395 1.5504 1.5504 2.7056 2.7056 2.7082 2.7082 3.4046 3.4046 3.4465 3.4465 5.2309 5.2309 5.2572 5.2572 5.6510 5.6510 5.6543 5.6543 9.4576 9.4576 9.4654 9.4654 10.0291 10.0291 10.0421 10.0421 k = 0.6726-0.4278-0.0248 ( 5044 PWs) bands (ev): -20.5270 -20.5270 -20.5270 -20.5270 -8.2242 -8.2242 -8.1597 -8.1597 -7.1203 -7.1203 -6.9971 -6.9971 -5.3103 -5.3103 -5.2913 -5.2913 -5.1679 -5.1679 -5.1638 -5.1638 -3.6929 -3.6929 -3.6301 -3.6301 1.5713 1.5713 1.5817 1.5817 2.7094 2.7094 2.7160 2.7160 3.3975 3.3975 3.4376 3.4376 5.2344 5.2344 5.2606 5.2606 5.6520 5.6520 5.6548 5.6548 9.4766 9.4766 9.4836 9.4836 10.0142 10.0142 10.0252 10.0252 k = 0.6801-0.4529-0.0248 ( 5048 PWs) bands (ev): -20.5265 -20.5265 -20.5265 -20.5265 -8.2214 -8.2214 -8.1563 -8.1563 -7.1214 -7.1214 -6.9990 -6.9990 -5.3106 -5.3106 -5.2913 -5.2913 -5.1845 -5.1845 -5.1821 -5.1821 -3.6981 -3.6981 -3.6295 -3.6295 1.6040 1.6040 1.6139 1.6139 2.7150 2.7150 2.7256 2.7256 3.3890 3.3890 3.4271 3.4271 5.2384 5.2384 5.2643 5.2643 5.6521 5.6521 5.6541 5.6541 9.4842 9.4842 9.4899 9.4899 10.0109 10.0109 10.0195 10.0195 k = 0.6876-0.4780-0.0248 ( 5042 PWs) bands (ev): -20.5260 -20.5260 -20.5260 -20.5260 -8.2184 -8.2184 -8.1530 -8.1530 -7.1221 -7.1221 -7.0012 -7.0012 -5.3105 -5.3105 -5.2910 -5.2910 -5.2053 -5.2053 -5.1962 -5.1962 -3.7037 -3.7037 -3.6292 -3.6292 1.6376 1.6376 1.6470 1.6470 2.7222 2.7222 2.7371 2.7371 3.3795 3.3795 3.4153 3.4153 5.2428 5.2428 5.2682 5.2682 5.6512 5.6512 5.6522 5.6522 9.4782 9.4782 9.4821 9.4821 10.0212 10.0212 10.0270 10.0270 k = 0.6951-0.5031-0.0248 ( 5044 PWs) bands (ev): -20.5256 -20.5256 -20.5256 -20.5256 -8.2152 -8.2152 -8.1498 -8.1498 -7.1224 -7.1224 -7.0036 -7.0036 -5.3103 -5.3103 -5.2911 -5.2911 -5.2255 -5.2255 -5.2097 -5.2097 -3.7097 -3.7097 -3.6292 -3.6292 1.6722 1.6722 1.6811 1.6811 2.7309 2.7309 2.7502 2.7502 3.3691 3.3691 3.4024 3.4024 5.2477 5.2477 5.2722 5.2722 5.6493 5.6493 5.6495 5.6495 9.4584 9.4584 9.4607 9.4607 10.0445 10.0445 10.0476 10.0476 k = 0.7026-0.5282-0.0248 ( 5044 PWs) bands (ev): -20.5253 -20.5253 -20.5252 -20.5252 -8.2118 -8.2118 -8.1466 -8.1466 -7.1224 -7.1224 -7.0063 -7.0063 -5.3101 -5.3101 -5.2930 -5.2930 -5.2433 -5.2433 -5.2222 -5.2222 -3.7160 -3.7160 -3.6296 -3.6296 1.7077 1.7077 1.7160 1.7160 2.7411 2.7411 2.7649 2.7649 3.3581 3.3581 3.3886 3.3886 5.2527 5.2527 5.2762 5.2762 5.6453 5.6453 5.6469 5.6469 9.4268 9.4268 9.4276 9.4276 10.0786 10.0786 10.0792 10.0792 k = 0.7101-0.5533-0.0248 ( 5032 PWs) bands (ev): -20.5249 -20.5249 -20.5249 -20.5249 -8.2082 -8.2082 -8.1435 -8.1435 -7.1222 -7.1222 -7.0093 -7.0093 -5.3106 -5.3106 -5.3005 -5.3005 -5.2550 -5.2550 -5.2332 -5.2332 -3.7227 -3.7227 -3.6305 -3.6305 1.7440 1.7440 1.7519 1.7519 2.7527 2.7527 2.7810 2.7810 3.3466 3.3466 3.3742 3.3742 5.2579 5.2579 5.2800 5.2800 5.6403 5.6403 5.6436 5.6436 9.3855 9.3855 9.3858 9.3858 10.1190 10.1190 10.1204 10.1204 k = 0.7176-0.5784-0.0248 ( 5034 PWs) bands (ev): -20.5246 -20.5246 -20.5246 -20.5246 -8.2044 -8.2044 -8.1404 -8.1404 -7.1217 -7.1217 -7.0127 -7.0127 -5.3155 -5.3155 -5.3124 -5.3124 -5.2585 -5.2585 -5.2419 -5.2419 -3.7297 -3.7297 -3.6319 -3.6319 1.7811 1.7811 1.7886 1.7886 2.7654 2.7654 2.7983 2.7983 3.3349 3.3349 3.3593 3.3593 5.2631 5.2631 5.2835 5.2835 5.6345 5.6345 5.6396 5.6396 9.3366 9.3366 9.3377 9.3377 10.1639 10.1639 10.1670 10.1670 k = 0.7251-0.6035-0.0248 ( 5036 PWs) bands (ev): -20.5243 -20.5243 -20.5243 -20.5243 -8.2004 -8.2004 -8.1373 -8.1373 -7.1209 -7.1209 -7.0163 -7.0163 -5.3350 -5.3350 -5.3162 -5.3162 -5.2566 -5.2566 -5.2476 -5.2476 -3.7371 -3.7371 -3.6338 -3.6338 1.8191 1.8191 1.8261 1.8261 2.7791 2.7791 2.8167 2.8167 3.3232 3.3232 3.3442 3.3442 5.2681 5.2681 5.2867 5.2867 5.6279 5.6279 5.6350 5.6350 9.2829 9.2829 9.2845 9.2845 10.2117 10.2117 10.2162 10.2162 k = 0.7326-0.6286-0.0248 ( 5034 PWs) bands (ev): -20.5241 -20.5241 -20.5241 -20.5241 -8.1962 -8.1962 -8.1343 -8.1343 -7.1200 -7.1200 -7.0203 -7.0203 -5.3564 -5.3564 -5.3223 -5.3223 -5.2518 -5.2518 -5.2498 -5.2498 -3.7449 -3.7449 -3.6362 -3.6362 1.8577 1.8577 1.8644 1.8644 2.7937 2.7937 2.8359 2.8359 3.3118 3.3118 3.3292 3.3292 5.2729 5.2729 5.2894 5.2894 5.6207 5.6207 5.6300 5.6300 9.2256 9.2256 9.2274 9.2274 10.2604 10.2604 10.2661 10.2661 k = 0.7401-0.6537-0.0248 ( 5034 PWs) bands (ev): -20.5238 -20.5238 -20.5238 -20.5238 -8.1919 -8.1919 -8.1312 -8.1312 -7.1189 -7.1189 -7.0246 -7.0246 -5.3784 -5.3784 -5.3303 -5.3303 -5.2490 -5.2490 -5.2455 -5.2455 -3.7530 -3.7530 -3.6393 -3.6393 1.8971 1.8971 1.9035 1.9035 2.8088 2.8088 2.8557 2.8557 3.3009 3.3009 3.3146 3.3146 5.2773 5.2773 5.2916 5.2916 5.6131 5.6131 5.6247 5.6247 9.1657 9.1657 9.1676 9.1676 10.3083 10.3083 10.3152 10.3152 k = 0.7476-0.6788-0.0248 ( 5032 PWs) bands (ev): -20.5237 -20.5237 -20.5237 -20.5237 -8.1873 -8.1873 -8.1282 -8.1282 -7.1177 -7.1177 -7.0291 -7.0291 -5.4005 -5.4005 -5.3396 -5.3396 -5.2458 -5.2458 -5.2379 -5.2379 -3.7613 -3.7613 -3.6430 -3.6430 1.9371 1.9371 1.9433 1.9433 2.8243 2.8243 2.8757 2.8757 3.2907 3.2907 3.3006 3.3006 5.2811 5.2811 5.2932 5.2932 5.6051 5.6051 5.6192 5.6192 9.1038 9.1038 9.1056 9.1056 10.3541 10.3541 10.3621 10.3621 k = 0.7551-0.7039-0.0248 ( 5030 PWs) bands (ev): -20.5236 -20.5236 -20.5236 -20.5236 -8.1826 -8.1826 -8.1252 -8.1252 -7.1163 -7.1163 -7.0340 -7.0340 -5.4224 -5.4224 -5.3495 -5.3495 -5.2409 -5.2409 -5.2294 -5.2294 -3.7700 -3.7700 -3.6473 -3.6473 1.9777 1.9777 1.9838 1.9838 2.8399 2.8399 2.8956 2.8956 3.2816 3.2816 3.2875 3.2875 5.2843 5.2843 5.2940 5.2940 5.5972 5.5972 5.6136 5.6136 9.0405 9.0405 9.0422 9.0422 10.3964 10.3964 10.4058 10.4058 k = 0.7626-0.7290-0.0248 ( 5030 PWs) bands (ev): -20.5235 -20.5235 -20.5235 -20.5235 -8.1778 -8.1778 -8.1222 -8.1222 -7.1149 -7.1149 -7.0391 -7.0391 -5.4438 -5.4438 -5.3595 -5.3595 -5.2347 -5.2347 -5.2201 -5.2201 -3.7788 -3.7788 -3.6521 -3.6521 2.0189 2.0189 2.0249 2.0249 2.8552 2.8552 2.9150 2.9150 3.2736 3.2736 3.2759 3.2759 5.2867 5.2867 5.2940 5.2940 5.5893 5.5893 5.6080 5.6080 8.9761 8.9761 8.9776 8.9776 10.4340 10.4340 10.4450 10.4450 k = 0.7701-0.7541-0.0248 ( 5028 PWs) bands (ev): -20.5234 -20.5234 -20.5234 -20.5234 -8.1728 -8.1728 -8.1193 -8.1193 -7.1134 -7.1134 -7.0444 -7.0444 -5.4647 -5.4647 -5.3693 -5.3693 -5.2276 -5.2276 -5.2100 -5.2100 -3.7879 -3.7879 -3.6576 -3.6576 2.0606 2.0606 2.0666 2.0666 2.8700 2.8700 2.9334 2.9334 3.2659 3.2659 3.2672 3.2672 5.2882 5.2882 5.2933 5.2933 5.5817 5.5817 5.6027 5.6027 8.9112 8.9112 8.9124 8.9124 10.4653 10.4653 10.4786 10.4786 k = 0.7776-0.7792-0.0248 ( 5026 PWs) bands (ev): -20.5234 -20.5234 -20.5234 -20.5234 -8.1676 -8.1676 -8.1163 -8.1163 -7.1118 -7.1118 -7.0498 -7.0498 -5.4850 -5.4850 -5.3788 -5.3788 -5.2199 -5.2199 -5.1993 -5.1993 -3.7970 -3.7970 -3.6637 -3.6637 2.1028 2.1028 2.1089 2.1089 2.8841 2.8841 2.9504 2.9504 3.2581 3.2581 3.2625 3.2625 5.2887 5.2887 5.2917 5.2917 5.5745 5.5745 5.5975 5.5975 8.8459 8.8459 8.8469 8.8469 10.4890 10.4890 10.5050 10.5050 k = 0.7851-0.8043-0.0248 ( 5032 PWs) bands (ev): -20.5235 -20.5235 -20.5235 -20.5235 -8.1624 -8.1624 -8.1134 -8.1134 -7.1101 -7.1101 -7.0554 -7.0554 -5.5045 -5.5045 -5.3878 -5.3878 -5.2117 -5.2117 -5.1881 -5.1881 -3.8062 -3.8062 -3.6703 -3.6703 2.1453 2.1453 2.1515 2.1515 2.8971 2.8971 2.9655 2.9655 3.2528 3.2528 3.2597 3.2597 5.2881 5.2881 5.2893 5.2893 5.5679 5.5679 5.5926 5.5926 8.7805 8.7805 8.7812 8.7812 10.5030 10.5030 10.5227 10.5227 k = 0.7926-0.8294-0.0248 ( 5034 PWs) bands (ev): -20.5236 -20.5236 -20.5235 -20.5235 -8.1572 -8.1572 -8.1106 -8.1106 -7.1084 -7.1084 -7.0610 -7.0610 -5.5232 -5.5232 -5.3963 -5.3963 -5.2032 -5.2032 -5.1764 -5.1764 -3.8154 -3.8154 -3.6775 -3.6775 2.1881 2.1881 2.1945 2.1945 2.9088 2.9088 2.9782 2.9782 3.2504 3.2504 3.2588 3.2588 5.2862 5.2862 5.2866 5.2866 5.5619 5.5619 5.5880 5.5880 8.7153 8.7153 8.7158 8.7158 10.5058 10.5058 10.5300 10.5300 k = 0.2074-0.6938 0.8902 ( 5034 PWs) bands (ev): -20.5236 -20.5236 -20.5235 -20.5235 -8.1572 -8.1572 -8.1106 -8.1106 -7.1084 -7.1084 -7.0610 -7.0610 -5.5232 -5.5232 -5.3963 -5.3963 -5.2032 -5.2032 -5.1764 -5.1764 -3.8154 -3.8154 -3.6775 -3.6775 2.1881 2.1881 2.1945 2.1945 2.9088 2.9088 2.9782 2.9782 3.2504 3.2504 3.2588 3.2588 5.2862 5.2862 5.2866 5.2866 5.5619 5.5619 5.5880 5.5880 8.7153 8.7153 8.7158 8.7158 10.5058 10.5058 10.5300 10.5300 k = 0.2000-0.6690 0.8902 ( 5028 PWs) bands (ev): -20.5237 -20.5237 -20.5237 -20.5237 -8.1520 -8.1520 -8.1079 -8.1079 -7.1067 -7.1067 -7.0666 -7.0666 -5.5407 -5.5407 -5.4041 -5.4041 -5.1946 -5.1946 -5.1645 -5.1645 -3.8243 -3.8243 -3.6850 -3.6850 2.2305 2.2305 2.2373 2.2373 2.9191 2.9191 2.9881 2.9881 3.2511 3.2511 3.2599 3.2599 5.2825 5.2825 5.2841 5.2841 5.5566 5.5566 5.5836 5.5836 8.6514 8.6514 8.6516 8.6516 10.4961 10.4961 10.5256 10.5256 k = 0.1926-0.6443 0.8902 ( 5030 PWs) bands (ev): -20.5238 -20.5238 -20.5238 -20.5238 -8.1467 -8.1467 -8.1052 -8.1052 -7.1049 -7.1049 -7.0721 -7.0721 -5.5572 -5.5572 -5.4114 -5.4114 -5.1859 -5.1859 -5.1524 -5.1524 -3.8331 -3.8331 -3.6930 -3.6930 2.2731 2.2731 2.2802 2.2802 2.9280 2.9280 2.9954 2.9954 3.2546 3.2546 3.2628 3.2628 5.2783 5.2783 5.2809 5.2809 5.5519 5.5519 5.5795 5.5795 8.5881 8.5881 8.5882 8.5882 10.4744 10.4744 10.5090 10.5090 k = 0.1852-0.6195 0.8902 ( 5028 PWs) bands (ev): -20.5240 -20.5240 -20.5240 -20.5240 -8.1416 -8.1416 -8.1027 -8.1027 -7.1030 -7.1030 -7.0774 -7.0774 -5.5728 -5.5728 -5.4181 -5.4181 -5.1773 -5.1773 -5.1402 -5.1402 -3.8417 -3.8417 -3.7013 -3.7013 2.3157 2.3157 2.3231 2.3231 2.9356 2.9356 3.0002 3.0002 3.2607 3.2607 3.2674 3.2674 5.2737 5.2737 5.2769 5.2769 5.5477 5.5477 5.5754 5.5754 8.5255 8.5255 8.5258 8.5258 10.4422 10.4422 10.4812 10.4812 k = 0.1778-0.5947 0.8902 ( 5032 PWs) bands (ev): -20.5242 -20.5242 -20.5242 -20.5242 -8.1364 -8.1364 -8.1002 -8.1002 -7.1012 -7.1012 -7.0826 -7.0826 -5.5872 -5.5872 -5.4243 -5.4243 -5.1688 -5.1688 -5.1280 -5.1280 -3.8499 -3.8499 -3.7100 -3.7100 2.3583 2.3583 2.3660 2.3660 2.9420 2.9420 3.0030 3.0030 3.2688 3.2688 3.2733 3.2733 5.2689 5.2689 5.2725 5.2725 5.5438 5.5438 5.5713 5.5713 8.4640 8.4640 8.4645 8.4645 10.4027 10.4027 10.4448 10.4448 k = 0.1704-0.5699 0.8902 ( 5032 PWs) bands (ev): -20.5244 -20.5244 -20.5244 -20.5244 -8.1314 -8.1314 -8.0979 -8.0979 -7.0992 -7.0992 -7.0875 -7.0875 -5.6006 -5.6006 -5.4300 -5.4300 -5.1606 -5.1606 -5.1159 -5.1159 -3.8577 -3.8577 -3.7189 -3.7189 2.4006 2.4006 2.4088 2.4088 2.9475 2.9475 3.0042 3.0042 3.2783 3.2783 3.2803 3.2803 5.2639 5.2639 5.2677 5.2677 5.5403 5.5403 5.5673 5.5673 8.4038 8.4038 8.4045 8.4045 10.3590 10.3590 10.4031 10.4031 k = 0.1630-0.5451 0.8902 ( 5036 PWs) bands (ev): -20.5247 -20.5247 -20.5247 -20.5247 -8.1266 -8.1266 -8.0958 -8.0958 -7.0973 -7.0973 -7.0921 -7.0921 -5.6127 -5.6127 -5.4352 -5.4352 -5.1526 -5.1526 -5.1039 -5.1039 -3.8651 -3.8651 -3.7279 -3.7279 2.4427 2.4427 2.4513 2.4513 2.9523 2.9523 3.0044 3.0044 3.2879 3.2879 3.2887 3.2887 5.2589 5.2589 5.2627 5.2627 5.5369 5.5369 5.5631 5.5631 8.3452 8.3452 8.3460 8.3460 10.3139 10.3139 10.3590 10.3590 k = 0.1555-0.5204 0.8902 ( 5044 PWs) bands (ev): -20.5250 -20.5250 -20.5250 -20.5250 -8.1219 -8.1219 -8.0937 -8.0937 -7.0964 -7.0964 -7.0953 -7.0953 -5.6237 -5.6237 -5.4400 -5.4400 -5.1451 -5.1451 -5.0924 -5.0924 -3.8720 -3.8720 -3.7372 -3.7372 2.4843 2.4843 2.4934 2.4934 2.9566 2.9566 3.0040 3.0040 3.2958 3.2958 3.2991 3.2991 5.2540 5.2540 5.2576 5.2576 5.5337 5.5337 5.5589 5.5589 8.2882 8.2882 8.2891 8.2891 10.2694 10.2694 10.3148 10.3148 k = 0.1481-0.4956 0.8902 ( 5040 PWs) bands (ev): -20.5253 -20.5253 -20.5253 -20.5253 -8.1174 -8.1174 -8.0919 -8.0919 -7.1002 -7.1002 -7.0933 -7.0933 -5.6333 -5.6333 -5.4444 -5.4444 -5.1381 -5.1381 -5.0812 -5.0812 -3.8783 -3.8783 -3.7464 -3.7464 2.5255 2.5255 2.5349 2.5349 2.9607 2.9607 3.0034 3.0034 3.3036 3.3036 3.3093 3.3093 5.2491 5.2491 5.2526 5.2526 5.5306 5.5306 5.5546 5.5546 8.2331 8.2331 8.2340 8.2340 10.2269 10.2269 10.2725 10.2725 k = 0.1407-0.4708 0.8902 ( 5036 PWs) bands (ev): -20.5256 -20.5256 -20.5256 -20.5256 -8.1132 -8.1132 -8.0902 -8.0902 -7.1035 -7.1035 -7.0913 -7.0913 -5.6417 -5.6417 -5.4486 -5.4486 -5.1315 -5.1315 -5.0707 -5.0707 -3.8839 -3.8839 -3.7557 -3.7557 2.5659 2.5659 2.5758 2.5758 2.9649 2.9649 3.0030 3.0030 3.3109 3.3109 3.3188 3.3188 5.2442 5.2442 5.2475 5.2475 5.5277 5.5277 5.5502 5.5502 8.1800 8.1800 8.1809 8.1809 10.1874 10.1874 10.2329 10.2329 k = 0.1333-0.4460 0.8902 ( 5040 PWs) bands (ev): -20.5259 -20.5259 -20.5259 -20.5259 -8.1092 -8.1092 -8.0887 -8.0887 -7.1064 -7.1064 -7.0893 -7.0893 -5.6488 -5.6488 -5.4525 -5.4525 -5.1254 -5.1254 -5.0608 -5.0608 -3.8889 -3.8889 -3.7649 -3.7649 2.6056 2.6056 2.6160 2.6160 2.9692 2.9692 3.0029 3.0029 3.3176 3.3176 3.3272 3.3272 5.2394 5.2394 5.2423 5.2423 5.5251 5.5251 5.5461 5.5461 8.1290 8.1290 8.1298 8.1298 10.1518 10.1518 10.1971 10.1971 k = 0.1259-0.4212 0.8902 ( 5038 PWs) bands (ev): -20.5262 -20.5262 -20.5262 -20.5262 -8.1055 -8.1055 -8.0873 -8.0873 -7.1087 -7.1087 -7.0874 -7.0874 -5.6545 -5.6545 -5.4563 -5.4563 -5.1199 -5.1199 -5.0517 -5.0517 -3.8931 -3.8931 -3.7739 -3.7739 2.6443 2.6443 2.6551 2.6551 2.9738 2.9738 3.0034 3.0034 3.3234 3.3234 3.3343 3.3343 5.2343 5.2343 5.2370 5.2370 5.5228 5.5228 5.5422 5.5422 8.0803 8.0803 8.0810 8.0810 10.1204 10.1204 10.1655 10.1655 k = 0.1185-0.3965 0.8902 ( 5036 PWs) bands (ev): -20.5266 -20.5266 -20.5266 -20.5266 -8.1021 -8.1021 -8.0861 -8.0861 -7.1105 -7.1105 -7.0855 -7.0855 -5.6589 -5.6589 -5.4600 -5.4600 -5.1149 -5.1149 -5.0435 -5.0435 -3.8966 -3.8966 -3.7828 -3.7828 2.6820 2.6820 2.6933 2.6933 2.9789 2.9789 3.0044 3.0044 3.3281 3.3281 3.3400 3.3400 5.2290 5.2290 5.2314 5.2314 5.5212 5.5212 5.5388 5.5388 8.0339 8.0339 8.0345 8.0345 10.0936 10.0936 10.1384 10.1384 k = 0.1111-0.3717 0.8902 ( 5032 PWs) bands (ev): -20.5269 -20.5269 -20.5269 -20.5269 -8.0990 -8.0990 -8.0851 -8.0851 -7.1118 -7.1118 -7.0838 -7.0838 -5.6619 -5.6619 -5.4638 -5.4638 -5.1103 -5.1103 -5.0362 -5.0362 -3.8994 -3.8994 -3.7913 -3.7913 2.7185 2.7185 2.7302 2.7302 2.9845 2.9845 3.0062 3.0062 3.3316 3.3316 3.3441 3.3441 5.2233 5.2233 5.2253 5.2253 5.5202 5.5202 5.5362 5.5362 7.9899 7.9899 7.9903 7.9903 10.0716 10.0716 10.1161 10.1161 k = 0.1037-0.3469 0.8902 ( 5032 PWs) bands (ev): -20.5273 -20.5273 -20.5273 -20.5273 -8.0962 -8.0962 -8.0842 -8.0842 -7.1125 -7.1125 -7.0822 -7.0822 -5.6636 -5.6636 -5.4678 -5.4678 -5.1061 -5.1061 -5.0299 -5.0299 -3.9015 -3.9015 -3.7996 -3.7996 2.7536 2.7536 2.7658 2.7658 2.9907 2.9907 3.0088 3.0088 3.3337 3.3337 3.3467 3.3467 5.2169 5.2169 5.2186 5.2186 5.5202 5.5202 5.5344 5.5344 7.9484 7.9484 7.9486 7.9486 10.0545 10.0545 10.0986 10.0986 k = 0.0963-0.3221 0.8902 ( 5028 PWs) bands (ev): -20.5276 -20.5276 -20.5276 -20.5276 -8.0937 -8.0937 -8.0835 -8.0835 -7.1127 -7.1127 -7.0807 -7.0807 -5.6640 -5.6640 -5.4720 -5.4720 -5.1022 -5.1022 -5.0247 -5.0247 -3.9029 -3.9029 -3.8076 -3.8076 2.7872 2.7872 2.7998 2.7998 2.9976 2.9976 3.0121 3.0121 3.3345 3.3345 3.3476 3.3476 5.2098 5.2098 5.2113 5.2113 5.5213 5.5213 5.5338 5.5338 7.9094 7.9094 7.9095 7.9095 10.0422 10.0422 10.0857 10.0857 k = 0.0889-0.2973 0.8902 ( 5032 PWs) bands (ev): -20.5279 -20.5279 -20.5279 -20.5279 -8.0915 -8.0915 -8.0829 -8.0829 -7.1124 -7.1124 -7.0795 -7.0795 -5.6630 -5.6630 -5.4765 -5.4765 -5.0985 -5.0985 -5.0206 -5.0206 -3.9036 -3.9036 -3.8151 -3.8151 2.8190 2.8190 2.8321 2.8321 3.0052 3.0052 3.0163 3.0163 3.3339 3.3339 3.3469 3.3469 5.2019 5.2019 5.2032 5.2032 5.5235 5.5235 5.5344 5.5344 7.8729 7.8729 7.8730 7.8730 10.0346 10.0346 10.0774 10.0774 k = 0.0815-0.2726 0.8902 ( 5028 PWs) bands (ev): -20.5282 -20.5282 -20.5282 -20.5282 -8.0896 -8.0896 -8.0824 -8.0824 -7.1117 -7.1117 -7.0785 -7.0785 -5.6608 -5.6608 -5.4816 -5.4816 -5.0949 -5.0949 -5.0176 -5.0176 -3.9037 -3.9037 -3.8223 -3.8223 2.8489 2.8489 2.8625 2.8625 3.0137 3.0137 3.0215 3.0215 3.3319 3.3319 3.3446 3.3446 5.1934 5.1934 5.1944 5.1944 5.5268 5.5268 5.5361 5.5361 7.8389 7.8389 7.8392 7.8392 10.0314 10.0314 10.0733 10.0733 k = 0.0741-0.2478 0.8902 ( 5034 PWs) bands (ev): -20.5285 -20.5285 -20.5285 -20.5285 -8.0879 -8.0879 -8.0820 -8.0820 -7.1105 -7.1105 -7.0778 -7.0778 -5.6574 -5.6574 -5.4871 -5.4871 -5.0913 -5.0913 -5.0158 -5.0158 -3.9033 -3.9033 -3.8291 -3.8291 2.8765 2.8765 2.8907 2.8907 3.0232 3.0232 3.0277 3.0277 3.3286 3.3286 3.3409 3.3409 5.1842 5.1842 5.1851 5.1851 5.5311 5.5311 5.5390 5.5390 7.8076 7.8076 7.8080 7.8080 10.0322 10.0322 10.0727 10.0727 k = 0.0667-0.2230 0.8902 ( 5034 PWs) bands (ev): -20.5288 -20.5288 -20.5288 -20.5288 -8.0865 -8.0865 -8.0817 -8.0817 -7.1089 -7.1089 -7.0773 -7.0773 -5.6528 -5.6528 -5.4932 -5.4932 -5.0877 -5.0877 -5.0150 -5.0150 -3.9023 -3.9023 -3.8354 -3.8354 2.9015 2.9015 2.9161 2.9161 3.0338 3.0338 3.0352 3.0352 3.3240 3.3240 3.3358 3.3358 5.1747 5.1747 5.1754 5.1754 5.5363 5.5363 5.5429 5.5429 7.7790 7.7790 7.7795 7.7795 10.0366 10.0366 10.0750 10.0750 k = 0.0593-0.1982 0.8902 ( 5038 PWs) bands (ev): -20.5290 -20.5290 -20.5290 -20.5290 -8.0854 -8.0854 -8.0815 -8.0815 -7.1070 -7.1070 -7.0771 -7.0771 -5.6471 -5.6471 -5.5000 -5.5000 -5.0839 -5.0839 -5.0152 -5.0152 -3.9008 -3.9008 -3.8414 -3.8414 2.9236 2.9236 2.9384 2.9384 3.0443 3.0443 3.0456 3.0456 3.3182 3.3182 3.3294 3.3294 5.1650 5.1650 5.1656 5.1656 5.5420 5.5420 5.5474 5.5474 7.7531 7.7531 7.7538 7.7538 10.0436 10.0436 10.0793 10.0793 k = 0.0518-0.1735 0.8902 ( 5038 PWs) bands (ev): -20.5293 -20.5293 -20.5293 -20.5293 -8.0844 -8.0844 -8.0814 -8.0814 -7.1049 -7.1049 -7.0773 -7.0773 -5.6404 -5.6404 -5.5074 -5.5074 -5.0798 -5.0798 -5.0165 -5.0165 -3.8989 -3.8989 -3.8470 -3.8470 2.9426 2.9426 2.9571 2.9571 3.0553 3.0553 3.0587 3.0587 3.3114 3.3114 3.3219 3.3219 5.1555 5.1555 5.1561 5.1561 5.5480 5.5480 5.5524 5.5524 7.7301 7.7301 7.7308 7.7308 10.0524 10.0524 10.0846 10.0846 k = 0.0444-0.1487 0.8902 ( 5038 PWs) bands (ev): -20.5295 -20.5295 -20.5295 -20.5295 -8.0836 -8.0836 -8.0813 -8.0813 -7.1025 -7.1025 -7.0778 -7.0778 -5.6327 -5.6327 -5.5155 -5.5155 -5.0755 -5.0755 -5.0187 -5.0187 -3.8967 -3.8967 -3.8523 -3.8523 2.9584 2.9584 2.9720 2.9720 3.0680 3.0680 3.0727 3.0727 3.3037 3.3037 3.3135 3.3135 5.1465 5.1465 5.1470 5.1470 5.5540 5.5540 5.5575 5.5575 7.7100 7.7100 7.7107 7.7107 10.0620 10.0620 10.0897 10.0897 k = 0.0370-0.1239 0.8902 ( 5034 PWs) bands (ev): -20.5296 -20.5296 -20.5296 -20.5296 -8.0830 -8.0830 -8.0813 -8.0813 -7.1000 -7.1000 -7.0786 -7.0786 -5.6243 -5.6243 -5.5242 -5.5242 -5.0709 -5.0709 -5.0216 -5.0216 -3.8941 -3.8941 -3.8572 -3.8572 2.9712 2.9712 2.9831 2.9831 3.0820 3.0820 3.0874 3.0874 3.2955 3.2955 3.3043 3.3043 5.1383 5.1383 5.1387 5.1387 5.5596 5.5596 5.5624 5.5624 7.6929 7.6929 7.6935 7.6935 10.0713 10.0713 10.0939 10.0939 k = 0.0296-0.0991 0.8902 ( 5032 PWs) bands (ev): -20.5298 -20.5298 -20.5298 -20.5298 -8.0825 -8.0825 -8.0813 -8.0813 -7.0974 -7.0974 -7.0798 -7.0798 -5.6152 -5.6152 -5.5335 -5.5335 -5.0660 -5.0660 -5.0253 -5.0253 -3.8913 -3.8913 -3.8618 -3.8618 2.9813 2.9813 2.9911 2.9911 3.0965 3.0965 3.1017 3.1017 3.2872 3.2872 3.2949 3.2949 5.1312 5.1312 5.1315 5.1315 5.5648 5.5648 5.5668 5.5668 7.6787 7.6787 7.6793 7.6793 10.0793 10.0793 10.0968 10.0968 k = 0.0222-0.0743 0.8902 ( 5030 PWs) bands (ev): -20.5299 -20.5299 -20.5299 -20.5299 -8.0822 -8.0822 -8.0813 -8.0813 -7.0947 -7.0947 -7.0812 -7.0812 -5.6055 -5.6055 -5.5433 -5.5433 -5.0609 -5.0609 -5.0296 -5.0296 -3.8883 -3.8883 -3.8662 -3.8662 2.9890 2.9890 2.9964 2.9964 3.1101 3.1101 3.1148 3.1148 3.2793 3.2793 3.2857 3.2857 5.1254 5.1254 5.1257 5.1257 5.5690 5.5690 5.5705 5.5705 7.6677 7.6677 7.6682 7.6682 10.0857 10.0857 10.0982 10.0982 k = 0.0148-0.0496 0.8902 ( 5032 PWs) bands (ev): -20.5300 -20.5300 -20.5300 -20.5300 -8.0819 -8.0819 -8.0813 -8.0813 -7.0921 -7.0921 -7.0830 -7.0830 -5.5954 -5.5954 -5.5534 -5.5534 -5.0556 -5.0556 -5.0343 -5.0343 -3.8851 -3.8851 -3.8704 -3.8704 2.9946 2.9946 2.9996 2.9996 3.1218 3.1218 3.1253 3.1253 3.2727 3.2727 3.2774 3.2774 5.1211 5.1211 5.1213 5.1213 5.5723 5.5723 5.5733 5.5733 7.6598 7.6598 7.6601 7.6601 10.0905 10.0905 10.0984 10.0984 k = 0.0074-0.0248 0.8902 ( 5028 PWs) bands (ev): -20.5300 -20.5300 -20.5300 -20.5300 -8.0817 -8.0817 -8.0814 -8.0814 -7.0896 -7.0896 -7.0849 -7.0849 -5.5850 -5.5850 -5.5639 -5.5639 -5.0502 -5.0502 -5.0394 -5.0394 -3.8817 -3.8817 -3.8743 -3.8743 2.9984 2.9984 3.0009 3.0009 3.1301 3.1301 3.1320 3.1320 3.2687 3.2687 3.2712 3.2712 5.1185 5.1185 5.1186 5.1186 5.5744 5.5744 5.5749 5.5749 7.6551 7.6551 7.6553 7.6553 10.0939 10.0939 10.0977 10.0977 k = 0.0000 0.0000 0.8902 ( 5028 PWs) bands (ev): -20.5301 -20.5301 -20.5301 -20.5301 -8.0815 -8.0815 -8.0815 -8.0815 -7.0872 -7.0872 -7.0872 -7.0872 -5.5744 -5.5744 -5.5744 -5.5744 -5.0448 -5.0448 -5.0448 -5.0448 -3.8781 -3.8781 -3.8781 -3.8781 3.0005 3.0005 3.0005 3.0005 3.1337 3.1337 3.1337 3.1337 3.2681 3.2681 3.2681 3.2681 5.1177 5.1177 5.1177 5.1177 5.5753 5.5753 5.5753 5.5753 7.6536 7.6536 7.6536 7.6536 10.0962 10.0962 10.0962 10.0962 k = 0.0000 0.0000 0.8902 ( 5028 PWs) bands (ev): -20.5301 -20.5301 -20.5301 -20.5301 -8.0815 -8.0815 -8.0815 -8.0815 -7.0872 -7.0872 -7.0872 -7.0872 -5.5744 -5.5744 -5.5744 -5.5744 -5.0448 -5.0448 -5.0448 -5.0448 -3.8781 -3.8781 -3.8781 -3.8781 3.0005 3.0005 3.0005 3.0005 3.1337 3.1337 3.1337 3.1337 3.2681 3.2681 3.2681 3.2681 5.1177 5.1177 5.1177 5.1177 5.5753 5.5753 5.5753 5.5753 7.6536 7.6536 7.6536 7.6536 10.0962 10.0962 10.0962 10.0962 k = 0.0246 0.0074 0.8902 ( 5031 PWs) bands (ev): -20.5301 -20.5301 -20.5300 -20.5300 -8.0982 -8.0982 -8.0644 -8.0644 -7.1054 -7.1054 -7.0691 -7.0691 -5.5941 -5.5941 -5.5545 -5.5545 -5.0601 -5.0601 -5.0293 -5.0293 -3.9017 -3.9017 -3.8552 -3.8552 3.0002 3.0002 3.0011 3.0011 3.1138 3.1138 3.1540 3.1540 3.2627 3.2627 3.2743 3.2743 5.1007 5.1007 5.1331 5.1331 5.5667 5.5667 5.5820 5.5820 7.6445 7.6445 7.6625 7.6625 10.0763 10.0763 10.1163 10.1163 k = 0.0492 0.0147 0.8902 ( 5036 PWs) bands (ev): -20.5301 -20.5301 -20.5300 -20.5300 -8.1144 -8.1144 -8.0469 -8.0469 -7.1237 -7.1237 -7.0513 -7.0513 -5.6133 -5.6133 -5.5343 -5.5343 -5.0752 -5.0752 -5.0139 -5.0139 -3.9260 -3.9260 -3.8331 -3.8331 3.0001 3.0001 3.0019 3.0019 3.0948 3.0948 3.1743 3.1743 3.2584 3.2584 3.2816 3.2816 5.0822 5.0822 5.1467 5.1467 5.5562 5.5562 5.5869 5.5869 7.6353 7.6353 7.6711 7.6711 10.0558 10.0558 10.1375 10.1375 k = 0.0739 0.0221 0.8902 ( 5033 PWs) bands (ev): -20.5301 -20.5301 -20.5300 -20.5300 -8.1301 -8.1301 -8.0292 -8.0292 -7.1421 -7.1421 -7.0338 -7.0338 -5.6320 -5.6320 -5.5140 -5.5140 -5.0899 -5.0899 -4.9985 -4.9985 -3.9508 -3.9508 -3.8118 -3.8118 3.0001 3.0001 3.0028 3.0028 3.0771 3.0771 3.1935 3.1935 3.2553 3.2553 3.2903 3.2903 5.0625 5.0625 5.1586 5.1586 5.5439 5.5439 5.5900 5.5900 7.6261 7.6261 7.6794 7.6794 10.0341 10.0341 10.1607 10.1607 k = 0.0985 0.0294 0.8902 ( 5039 PWs) bands (ev): -20.5302 -20.5302 -20.5300 -20.5300 -8.1452 -8.1452 -8.0112 -8.0112 -7.1604 -7.1604 -7.0167 -7.0167 -5.6501 -5.6501 -5.4938 -5.4938 -5.1041 -5.1041 -4.9834 -4.9834 -3.9761 -3.9761 -3.7915 -3.7915 2.9998 2.9998 3.0039 3.0039 3.0611 3.0611 3.2100 3.2100 3.2546 3.2546 3.3008 3.3008 5.0416 5.0416 5.1687 5.1687 5.5299 5.5299 5.5914 5.5914 7.6169 7.6169 7.6872 7.6872 10.0110 10.0110 10.1864 10.1864 k = 0.1231 0.0368 0.8902 ( 5034 PWs) bands (ev): -20.5302 -20.5302 -20.5299 -20.5299 -8.1596 -8.1596 -7.9932 -7.9932 -7.1787 -7.1787 -7.0001 -7.0001 -5.6676 -5.6676 -5.4738 -5.4738 -5.1176 -5.1176 -4.9685 -4.9685 -4.0017 -4.0017 -3.7721 -3.7721 2.9985 2.9985 3.0051 3.0051 3.0475 3.0475 3.2211 3.2211 3.2580 3.2580 3.3138 3.3138 5.0198 5.0198 5.1770 5.1770 5.5142 5.5142 5.5914 5.5914 7.6080 7.6080 7.6946 7.6946 9.9867 9.9867 10.2148 10.2148 k = 0.1477 0.0442 0.8902 ( 5029 PWs) bands (ev): -20.5302 -20.5302 -20.5299 -20.5299 -8.1733 -8.1733 -7.9751 -7.9751 -7.1968 -7.1968 -6.9839 -6.9839 -5.6844 -5.6844 -5.4543 -5.4543 -5.1303 -5.1303 -4.9541 -4.9541 -4.0275 -4.0275 -3.7538 -3.7538 2.9949 2.9949 3.0066 3.0066 3.0376 3.0376 3.2254 3.2254 3.2662 3.2662 3.3296 3.3296 4.9973 4.9973 5.1835 5.1835 5.4972 5.4972 5.5901 5.5901 7.5992 7.5992 7.7015 7.7015 9.9615 9.9615 10.2459 10.2459 k = 0.1724 0.0515 0.8902 ( 5027 PWs) bands (ev): -20.5302 -20.5302 -20.5299 -20.5299 -8.1862 -8.1862 -7.9572 -7.9572 -7.2147 -7.2147 -6.9683 -6.9683 -5.7004 -5.7004 -5.4354 -5.4354 -5.1418 -5.1418 -4.9400 -4.9400 -4.0534 -4.0534 -3.7365 -3.7365 2.9883 2.9883 3.0084 3.0084 3.0319 3.0319 3.2258 3.2258 3.2762 3.2762 3.3483 3.3483 4.9745 4.9745 5.1884 5.1884 5.4791 5.4791 5.5876 5.5876 7.5908 7.5908 7.7079 7.7079 9.9360 9.9360 10.2784 10.2784 k = 0.1970 0.0589 0.8902 ( 5037 PWs) bands (ev): -20.5303 -20.5303 -20.5299 -20.5299 -8.1983 -8.1983 -7.9394 -7.9394 -7.2322 -7.2322 -6.9534 -6.9534 -5.7156 -5.7156 -5.4176 -5.4176 -5.1519 -5.1519 -4.9265 -4.9265 -4.0792 -4.0792 -3.7203 -3.7203 2.9794 2.9794 3.0105 3.0105 3.0297 3.0297 3.2247 3.2247 3.2859 3.2859 3.3691 3.3691 4.9515 4.9515 5.1917 5.1917 5.4600 5.4600 5.5843 5.5843 7.5828 7.5828 7.7137 7.7137 9.9107 9.9107 10.3099 10.3099 k = 0.2216 0.0662 0.8902 ( 5033 PWs) bands (ev): -20.5303 -20.5303 -20.5298 -20.5298 -8.2096 -8.2096 -7.9220 -7.9220 -7.2493 -7.2493 -6.9393 -6.9393 -5.7299 -5.7299 -5.4011 -5.4011 -5.1603 -5.1603 -4.9135 -4.9135 -4.1047 -4.1047 -3.7052 -3.7052 2.9696 2.9696 3.0127 3.0127 3.0296 3.0296 3.2232 3.2232 3.2947 3.2947 3.3911 3.3911 4.9287 4.9287 5.1936 5.1936 5.4405 5.4405 5.5802 5.5802 7.5753 7.5753 7.7189 7.7189 9.8860 9.8860 10.3351 10.3351 k = 0.2462 0.0736 0.8902 ( 5023 PWs) bands (ev): -20.5303 -20.5303 -20.5298 -20.5298 -8.2201 -8.2201 -7.9051 -7.9051 -7.2659 -7.2659 -6.9259 -6.9259 -5.7433 -5.7433 -5.3863 -5.3863 -5.1668 -5.1668 -4.9012 -4.9012 -4.1297 -4.1297 -3.6912 -3.6912 2.9599 2.9599 3.0150 3.0150 3.0304 3.0304 3.2217 3.2217 3.3028 3.3028 3.4136 3.4136 4.9064 4.9064 5.1943 5.1943 5.4208 5.4208 5.5756 5.5756 7.5683 7.5683 7.7236 7.7236 9.8623 9.8623 10.3491 10.3491 k = 0.2708 0.0810 0.8902 ( 5024 PWs) bands (ev): -20.5304 -20.5304 -20.5298 -20.5298 -8.2296 -8.2296 -7.8888 -7.8888 -7.2818 -7.2818 -6.9135 -6.9135 -5.7557 -5.7557 -5.3735 -5.3735 -5.1711 -5.1711 -4.8896 -4.8896 -4.1540 -4.1540 -3.6784 -3.6784 2.9509 2.9509 3.0173 3.0173 3.0317 3.0317 3.2204 3.2204 3.3103 3.3103 3.4359 3.4359 4.8848 4.8848 5.1940 5.1940 5.4012 5.4012 5.5708 5.5708 7.5618 7.5618 7.7277 7.7277 9.8400 9.8400 10.3541 10.3541 k = 0.2955 0.0883 0.8902 ( 5021 PWs) bands (ev): -20.5304 -20.5304 -20.5297 -20.5297 -8.2382 -8.2382 -7.8733 -7.8733 -7.2969 -7.2969 -6.9020 -6.9020 -5.7670 -5.7670 -5.3631 -5.3631 -5.1730 -5.1730 -4.8787 -4.8787 -4.1774 -4.1774 -3.6668 -3.6668 2.9426 2.9426 3.0195 3.0195 3.0331 3.0331 3.2194 3.2194 3.3171 3.3171 3.4574 3.4574 4.8643 4.8643 5.1928 5.1928 5.3823 5.3823 5.5658 5.5658 7.5559 7.5559 7.7313 7.7313 9.8193 9.8193 10.3548 10.3548 k = 0.3201 0.0957 0.8902 ( 5026 PWs) bands (ev): -20.5304 -20.5304 -20.5297 -20.5297 -8.2458 -8.2458 -7.8588 -7.8588 -7.3111 -7.3111 -6.8916 -6.8916 -5.7773 -5.7773 -5.3551 -5.3551 -5.1726 -5.1726 -4.8688 -4.8688 -4.1995 -4.1995 -3.6564 -3.6564 2.9354 2.9354 3.0215 3.0215 3.0345 3.0345 3.2188 3.2188 3.3233 3.3233 3.4775 3.4775 4.8453 4.8453 5.1911 5.1911 5.3643 5.3643 5.5609 5.5609 7.5507 7.5507 7.7345 7.7345 9.8005 9.8005 10.3539 10.3539 k = 0.3447 0.1030 0.8902 ( 5029 PWs) bands (ev): -20.5305 -20.5305 -20.5297 -20.5297 -8.2525 -8.2525 -7.8456 -7.8456 -7.3240 -7.3240 -6.8823 -6.8823 -5.7865 -5.7865 -5.3494 -5.3494 -5.1702 -5.1702 -4.8597 -4.8597 -4.2201 -4.2201 -3.6472 -3.6472 2.9292 2.9292 3.0231 3.0231 3.0358 3.0358 3.2185 3.2185 3.3289 3.3289 3.4958 3.4958 4.8279 4.8279 5.1891 5.1891 5.3478 5.3478 5.5563 5.5563 7.5461 7.5461 7.7372 7.7372 9.7836 9.7836 10.3527 10.3527 k = 0.3693 0.1104 0.8902 ( 5025 PWs) bands (ev): -20.5305 -20.5305 -20.5296 -20.5296 -8.2581 -8.2581 -7.8338 -7.8338 -7.3356 -7.3356 -6.8742 -6.8742 -5.7944 -5.7944 -5.3457 -5.3457 -5.1663 -5.1663 -4.8517 -4.8517 -4.2388 -4.2388 -3.6392 -3.6392 2.9241 2.9241 3.0243 3.0243 3.0369 3.0369 3.2187 3.2187 3.3338 3.3338 3.5119 3.5119 4.8127 4.8127 5.1869 5.1869 5.3330 5.3330 5.5521 5.5521 7.5422 7.5422 7.7395 7.7395 9.7689 9.7689 10.3516 10.3516 k = 0.3940 0.1178 0.8902 ( 5028 PWs) bands (ev): -20.5305 -20.5305 -20.5296 -20.5296 -8.2628 -8.2628 -7.8237 -7.8237 -7.3455 -7.3455 -6.8674 -6.8674 -5.8011 -5.8011 -5.3434 -5.3434 -5.1615 -5.1615 -4.8449 -4.8449 -4.2553 -4.2553 -3.6324 -3.6324 2.9201 2.9201 3.0251 3.0251 3.0377 3.0377 3.2193 3.2193 3.3379 3.3379 3.5253 3.5253 4.7997 4.7997 5.1848 5.1848 5.3203 5.3203 5.5484 5.5484 7.5390 7.5390 7.7414 7.7414 9.7566 9.7566 10.3509 10.3509 k = 0.4186 0.1251 0.8902 ( 5031 PWs) bands (ev): -20.5306 -20.5306 -20.5296 -20.5296 -8.2664 -8.2664 -7.8157 -7.8157 -7.3536 -7.3536 -6.8619 -6.8619 -5.8066 -5.8066 -5.3421 -5.3421 -5.1566 -5.1566 -4.8393 -4.8393 -4.2692 -4.2692 -3.6269 -3.6269 2.9172 2.9172 3.0254 3.0254 3.0382 3.0382 3.2203 3.2203 3.3412 3.3412 3.5357 3.5357 4.7894 4.7894 5.1829 5.1829 5.3100 5.3100 5.5453 5.5453 7.5366 7.5366 7.7430 7.7430 9.7465 9.7465 10.3506 10.3506 k = 0.4432 0.1325 0.8902 ( 5032 PWs) bands (ev): -20.5306 -20.5306 -20.5295 -20.5295 -8.2689 -8.2689 -7.8098 -7.8098 -7.3596 -7.3596 -6.8578 -6.8578 -5.8108 -5.8108 -5.3414 -5.3414 -5.1521 -5.1521 -4.8351 -4.8351 -4.2802 -4.2802 -3.6226 -3.6226 2.9154 2.9154 3.0250 3.0250 3.0385 3.0385 3.2217 3.2217 3.3436 3.3436 3.5428 3.5428 4.7819 4.7819 5.1814 5.1814 5.3024 5.3024 5.5430 5.5430 7.5349 7.5349 7.7443 7.7443 9.7390 9.7390 10.3508 10.3508 k = 0.4678 0.1398 0.8902 ( 5028 PWs) bands (ev): -20.5306 -20.5306 -20.5295 -20.5295 -8.2704 -8.2704 -7.8062 -7.8062 -7.3634 -7.3634 -6.8551 -6.8551 -5.8137 -5.8137 -5.3409 -5.3409 -5.1485 -5.1485 -4.8325 -4.8325 -4.2880 -4.2880 -3.6196 -3.6196 2.9146 2.9146 3.0242 3.0242 3.0384 3.0384 3.2234 3.2234 3.3451 3.3451 3.5464 3.5464 4.7774 4.7774 5.1804 5.1804 5.2976 5.2976 5.5415 5.5415 7.5339 7.5339 7.7453 7.7453 9.7339 9.7339 10.3514 10.3514 k = 0.4925 0.1472 0.8902 ( 5029 PWs) bands (ev): -20.5307 -20.5307 -20.5295 -20.5295 -8.2708 -8.2708 -7.8052 -7.8052 -7.3649 -7.3649 -6.8538 -6.8538 -5.8152 -5.8152 -5.3404 -5.3404 -5.1462 -5.1462 -4.8315 -4.8315 -4.2924 -4.2924 -3.6178 -3.6178 2.9150 2.9150 3.0228 3.0228 3.0380 3.0380 3.2254 3.2254 3.3456 3.3456 3.5464 3.5464 4.7760 4.7760 5.1800 5.1800 5.2956 5.2956 5.5408 5.5408 7.5337 7.5337 7.7460 7.7460 9.7314 9.7314 10.3525 10.3525 k = 0.5171 0.1546 0.8902 ( 5025 PWs) bands (ev): -20.5307 -20.5307 -20.5294 -20.5294 -8.2702 -8.2702 -7.8068 -7.8068 -7.3640 -7.3640 -6.8540 -6.8540 -5.8154 -5.8154 -5.3398 -5.3398 -5.1452 -5.1452 -4.8322 -4.8322 -4.2932 -4.2932 -3.6172 -3.6172 2.9164 2.9164 3.0209 3.0209 3.0373 3.0373 3.2276 3.2276 3.3452 3.3452 3.5427 3.5427 4.7777 4.7777 5.1801 5.1801 5.2967 5.2967 5.5410 5.5410 7.5343 7.5343 7.7465 7.7465 9.7314 9.7314 10.3539 10.3539 k = 0.5417 0.1619 0.8902 ( 5027 PWs) bands (ev): -20.5308 -20.5308 -20.5294 -20.5294 -8.2685 -8.2685 -7.8108 -7.8108 -7.3607 -7.3607 -6.8556 -6.8556 -5.8142 -5.8142 -5.3391 -5.3391 -5.1457 -5.1457 -4.8345 -4.8345 -4.2905 -4.2905 -3.6180 -3.6180 2.9189 2.9189 3.0186 3.0186 3.0362 3.0362 3.2299 3.2299 3.3438 3.3438 3.5355 3.5355 4.7826 4.7826 5.1808 5.1808 5.3006 5.3006 5.5422 5.5422 7.5356 7.5356 7.7467 7.7467 9.7340 9.7340 10.3557 10.3557 k = 0.5000 0.1495-0.9150 ( 5024 PWs) bands (ev): -20.5307 -20.5307 -20.5294 -20.5294 -8.2708 -8.2708 -7.8039 -7.8039 -7.3662 -7.3662 -6.8533 -6.8533 -5.8168 -5.8168 -5.3404 -5.3404 -5.1455 -5.1455 -4.8309 -4.8309 -4.2950 -4.2950 -3.6172 -3.6172 2.9218 2.9218 3.0270 3.0270 3.0379 3.0379 3.2261 3.2261 3.3435 3.3435 3.5463 3.5463 4.7757 4.7757 5.1806 5.1806 5.2946 5.2946 5.5420 5.5420 7.5274 7.5274 7.7393 7.7393 9.7334 9.7334 10.3559 10.3559 k = 0.5072 0.1253-0.9150 ( 5027 PWs) bands (ev): -20.5307 -20.5307 -20.5294 -20.5294 -8.2704 -8.2704 -7.8051 -7.8051 -7.3654 -7.3654 -6.8537 -6.8537 -5.8162 -5.8162 -5.3400 -5.3400 -5.1462 -5.1462 -4.8325 -4.8325 -4.2937 -4.2937 -3.6170 -3.6170 2.9188 2.9188 3.0294 3.0294 3.0368 3.0368 3.2263 3.2263 3.3408 3.3408 3.5450 3.5450 4.7773 4.7773 5.1816 5.1816 5.2964 5.2964 5.5418 5.5418 7.5301 7.5301 7.7403 7.7403 9.7303 9.7303 10.3588 10.3588 k = 0.5145 0.1011-0.9150 ( 5025 PWs) bands (ev): -20.5306 -20.5306 -20.5293 -20.5293 -8.2691 -8.2691 -7.8086 -7.8086 -7.3631 -7.3631 -6.8549 -6.8549 -5.8143 -5.8143 -5.3386 -5.3386 -5.1485 -5.1485 -4.8370 -4.8370 -4.2898 -4.2898 -3.6164 -3.6164 2.9103 2.9103 3.0323 3.0323 3.0369 3.0369 3.2270 3.2270 3.3329 3.3329 3.5413 3.5413 4.7820 4.7820 5.1846 5.1846 5.3018 5.3018 5.5411 5.5411 7.5380 7.5380 7.7434 7.7434 9.7214 9.7214 10.3670 10.3670 k = 0.5217 0.0769-0.9150 ( 5027 PWs) bands (ev): -20.5306 -20.5306 -20.5292 -20.5292 -8.2670 -8.2670 -7.8143 -7.8143 -7.3594 -7.3594 -6.8567 -6.8567 -5.8113 -5.8113 -5.3362 -5.3362 -5.1523 -5.1523 -4.8444 -4.8444 -4.2834 -4.2834 -3.6154 -3.6154 2.8976 2.8976 3.0265 3.0265 3.0464 3.0464 3.2279 3.2279 3.3201 3.3201 3.5351 3.5351 4.7896 4.7896 5.1895 5.1895 5.3106 5.3106 5.5401 5.5401 7.5510 7.5510 7.7487 7.7487 9.7077 9.7077 10.3789 10.3789 k = 0.5289 0.0528-0.9150 ( 5027 PWs) bands (ev): -20.5305 -20.5305 -20.5291 -20.5291 -8.2641 -8.2641 -7.8221 -7.8221 -7.3544 -7.3544 -6.8594 -6.8594 -5.8070 -5.8070 -5.3330 -5.3330 -5.1575 -5.1575 -4.8543 -4.8543 -4.2747 -4.2747 -3.6142 -3.6142 2.8818 2.8818 3.0181 3.0181 3.0581 3.0581 3.2286 3.2286 3.3031 3.3031 3.5269 3.5269 4.7999 4.7999 5.1961 5.1961 5.3224 5.3224 5.5388 5.5388 7.5691 7.5691 7.7561 7.7561 9.6907 9.6907 10.3928 10.3928 k = 0.5361 0.0286-0.9150 ( 5035 PWs) bands (ev): -20.5304 -20.5304 -20.5289 -20.5289 -8.2604 -8.2604 -7.8317 -7.8317 -7.3483 -7.3483 -6.8627 -6.8627 -5.8016 -5.8016 -5.3289 -5.3289 -5.1641 -5.1641 -4.8664 -4.8664 -4.2641 -4.2641 -3.6126 -3.6126 2.8634 2.8634 3.0075 3.0075 3.0712 3.0712 3.2281 3.2281 3.2833 3.2833 3.5166 3.5166 4.8128 4.8128 5.2042 5.2042 5.3368 5.3368 5.5377 5.5377 7.5919 7.5919 7.7658 7.7658 9.6718 9.6718 10.4069 10.4069 k = 0.5434 0.0044-0.9150 ( 5031 PWs) bands (ev): -20.5303 -20.5303 -20.5287 -20.5287 -8.2559 -8.2559 -7.8428 -7.8428 -7.3414 -7.3414 -6.8666 -6.8666 -5.7952 -5.7952 -5.3240 -5.3240 -5.1721 -5.1721 -4.8804 -4.8804 -4.2519 -4.2519 -3.6108 -3.6108 2.8429 2.8429 2.9948 2.9948 3.0848 3.0848 3.2228 3.2228 3.2648 3.2648 3.5048 3.5048 4.8278 4.8278 5.2135 5.2135 5.3533 5.3533 5.5369 5.5369 7.6192 7.6192 7.7778 7.7778 9.6523 9.6523 10.4199 10.4199 k = 0.5506-0.0198-0.9150 ( 5029 PWs) bands (ev): -20.5302 -20.5302 -20.5284 -20.5284 -8.2508 -8.2508 -7.8553 -7.8553 -7.3339 -7.3339 -6.8711 -6.8711 -5.7876 -5.7876 -5.3183 -5.3183 -5.1814 -5.1814 -4.8957 -4.8957 -4.2383 -4.2383 -3.6089 -3.6089 2.8204 2.8204 2.9801 2.9801 3.0983 3.0983 3.2069 3.2069 3.2548 3.2548 3.4915 3.4915 4.8448 4.8448 5.2236 5.2236 5.3711 5.3711 5.5367 5.5367 7.6507 7.6507 7.7923 7.7923 9.6333 9.6333 10.4313 10.4313 k = 0.5578-0.0440-0.9150 ( 5019 PWs) bands (ev): -20.5300 -20.5300 -20.5282 -20.5282 -8.2450 -8.2450 -7.8688 -7.8688 -7.3260 -7.3260 -6.8761 -6.8761 -5.7791 -5.7791 -5.3120 -5.3120 -5.1918 -5.1918 -4.9121 -4.9121 -4.2236 -4.2236 -3.6070 -3.6070 2.7962 2.7962 2.9635 2.9635 3.1089 3.1089 3.1837 3.1837 3.2527 3.2527 3.4770 3.4770 4.8634 4.8634 5.2342 5.2342 5.3897 5.3897 5.5377 5.5377 7.6862 7.6862 7.8094 7.8094 9.6158 9.6158 10.4406 10.4406 k = 0.5650-0.0681-0.9150 ( 5025 PWs) bands (ev): -20.5298 -20.5298 -20.5278 -20.5278 -8.2386 -8.2386 -7.8830 -7.8830 -7.3179 -7.3179 -6.8815 -6.8815 -5.7697 -5.7697 -5.3051 -5.3051 -5.2034 -5.2034 -4.9290 -4.9290 -4.2080 -4.2080 -3.6050 -3.6050 2.7704 2.7704 2.9451 2.9451 3.1076 3.1076 3.1676 3.1676 3.2535 3.2535 3.4617 3.4617 4.8834 4.8834 5.2449 5.2449 5.4086 5.4086 5.5400 5.5400 7.7251 7.7251 7.8291 7.8291 9.6006 9.6006 10.4480 10.4480 k = 0.5723-0.0923-0.9150 ( 5025 PWs) bands (ev): -20.5296 -20.5296 -20.5275 -20.5275 -8.2317 -8.2317 -7.8979 -7.8979 -7.3099 -7.3099 -6.8871 -6.8871 -5.7595 -5.7595 -5.2978 -5.2978 -5.2159 -5.2159 -4.9461 -4.9461 -4.1919 -4.1919 -3.6031 -3.6031 2.7430 2.7430 2.9251 2.9251 3.0844 3.0844 3.1709 3.1709 3.2551 3.2551 3.4459 3.4459 4.9045 4.9045 5.2552 5.2552 5.4271 5.4271 5.5441 5.5441 7.7673 7.7673 7.8516 7.8516 9.5880 9.5880 10.4536 10.4536 k = 0.5795-0.1165-0.9150 ( 5029 PWs) bands (ev): -20.5294 -20.5294 -20.5271 -20.5271 -8.2245 -8.2245 -7.9129 -7.9129 -7.3022 -7.3022 -6.8930 -6.8930 -5.7486 -5.7486 -5.2907 -5.2907 -5.2289 -5.2289 -4.9630 -4.9630 -4.1753 -4.1753 -3.6014 -3.6014 2.7144 2.7144 2.9035 2.9035 3.0495 3.0495 3.1842 3.1842 3.2568 3.2568 3.4299 3.4299 4.9264 4.9264 5.2646 5.2646 5.4450 5.4450 5.5501 5.5501 7.8123 7.8123 7.8769 7.8769 9.5787 9.5787 10.4575 10.4575 k = 0.5867-0.1407-0.9150 ( 5023 PWs) bands (ev): -20.5292 -20.5292 -20.5267 -20.5267 -8.2170 -8.2170 -7.9280 -7.9280 -7.2949 -7.2949 -6.8990 -6.8990 -5.7370 -5.7370 -5.2846 -5.2846 -5.2415 -5.2415 -4.9793 -4.9793 -4.1586 -4.1586 -3.5999 -3.5999 2.6845 2.6845 2.8804 2.8804 3.0104 3.0104 3.2005 3.2005 3.2583 3.2583 3.4143 3.4143 4.9490 4.9490 5.2728 5.2728 5.4620 5.4620 5.5580 5.5580 7.8597 7.8597 7.9051 7.9051 9.5728 9.5728 10.4599 10.4599 k = 0.5940-0.1648-0.9150 ( 5023 PWs) bands (ev): -20.5290 -20.5290 -20.5263 -20.5263 -8.2095 -8.2095 -7.9429 -7.9429 -7.2882 -7.2882 -6.9048 -6.9048 -5.7249 -5.7249 -5.2829 -5.2829 -5.2504 -5.2504 -4.9946 -4.9946 -4.1417 -4.1417 -3.5986 -3.5986 2.6537 2.6537 2.8558 2.8558 2.9694 2.9694 3.2173 3.2173 3.2593 3.2593 3.3996 3.3996 4.9719 4.9719 5.2797 5.2797 5.4780 5.4780 5.5676 5.5676 7.9092 7.9092 7.9361 7.9361 9.5708 9.5708 10.4608 10.4608 k = 0.6012-0.1890-0.9150 ( 5025 PWs) bands (ev): -20.5288 -20.5288 -20.5259 -20.5259 -8.2021 -8.2021 -7.9571 -7.9571 -7.2823 -7.2823 -6.9105 -6.9105 -5.7123 -5.7123 -5.2904 -5.2904 -5.2510 -5.2510 -5.0086 -5.0086 -4.1248 -4.1248 -3.5977 -3.5977 2.6221 2.6221 2.8298 2.8298 2.9275 2.9275 3.2323 3.2323 3.2608 3.2608 3.3867 3.3867 4.9949 4.9949 5.2850 5.2850 5.4929 5.4929 5.5786 5.5786 7.9604 7.9604 7.9701 7.9701 9.5727 9.5727 10.4603 10.4603 k = 0.6084-0.2132-0.9150 ( 5023 PWs) bands (ev): -20.5286 -20.5286 -20.5255 -20.5255 -8.1952 -8.1952 -7.9705 -7.9705 -7.2774 -7.2774 -6.9158 -6.9158 -5.6995 -5.6995 -5.3045 -5.3045 -5.2460 -5.2460 -5.0208 -5.0208 -4.1081 -4.1081 -3.5972 -3.5972 2.5899 2.5899 2.8025 2.8025 2.8852 2.8852 3.2400 3.2400 3.2673 3.2673 3.3763 3.3763 5.0178 5.0178 5.2889 5.2889 5.5067 5.5067 5.5908 5.5908 8.0059 8.0059 8.0140 8.0140 9.5788 9.5788 10.4585 10.4585 k = 0.6156-0.2374-0.9150 ( 5033 PWs) bands (ev): -20.5284 -20.5284 -20.5250 -20.5250 -8.1890 -8.1890 -7.9826 -7.9826 -7.2734 -7.2734 -6.9205 -6.9205 -5.6865 -5.6865 -5.3210 -5.3210 -5.2394 -5.2394 -5.0310 -5.0310 -4.0916 -4.0916 -3.5971 -3.5971 2.5572 2.5572 2.7739 2.7739 2.8429 2.8429 3.2376 3.2376 3.2806 3.2806 3.3693 3.3693 5.0401 5.0401 5.2915 5.2915 5.5191 5.5191 5.6042 5.6042 8.0454 8.0454 8.0678 8.0678 9.5890 9.5890 10.4556 10.4556 k = 0.6229-0.2615-0.9150 ( 5037 PWs) bands (ev): -20.5282 -20.5282 -20.5246 -20.5246 -8.1840 -8.1840 -7.9930 -7.9930 -7.2707 -7.2707 -6.9247 -6.9247 -5.6734 -5.6734 -5.3383 -5.3383 -5.2331 -5.2331 -5.0389 -5.0389 -4.0754 -4.0754 -3.5974 -3.5974 2.5242 2.5242 2.7441 2.7441 2.8009 2.8009 3.2295 3.2295 3.2955 3.2955 3.3663 3.3663 5.0618 5.0618 5.2929 5.2929 5.5296 5.5296 5.6186 5.6186 8.0871 8.0871 8.1227 8.1227 9.6036 9.6036 10.4514 10.4514 k = 0.6301-0.2857-0.9150 ( 5037 PWs) bands (ev): -20.5280 -20.5280 -20.5241 -20.5241 -8.1806 -8.1806 -8.0013 -8.0013 -7.2691 -7.2691 -6.9281 -6.9281 -5.6606 -5.6606 -5.3558 -5.3558 -5.2276 -5.2276 -5.0440 -5.0440 -4.0596 -4.0596 -3.5981 -3.5981 2.4910 2.4910 2.7131 2.7131 2.7596 2.7596 3.2181 3.2181 3.3094 3.3094 3.3673 3.3673 5.0823 5.0823 5.2935 5.2935 5.5381 5.5381 5.6341 5.6341 8.1310 8.1310 8.1784 8.1784 9.6224 9.6224 10.4463 10.4463 k = 0.6373-0.3099-0.9150 ( 5035 PWs) bands (ev): -20.5278 -20.5278 -20.5237 -20.5237 -8.1790 -8.1790 -8.0072 -8.0072 -7.2688 -7.2688 -6.9307 -6.9307 -5.6481 -5.6481 -5.3729 -5.3729 -5.2233 -5.2233 -5.0464 -5.0464 -4.0442 -4.0442 -3.5993 -3.5993 2.4575 2.4575 2.6811 2.6811 2.7194 2.7194 3.2048 3.2048 3.3210 3.3210 3.3725 3.3725 5.1016 5.1016 5.2935 5.2935 5.5443 5.5443 5.6506 5.6506 8.1771 8.1771 8.2345 8.2345 9.6456 9.6456 10.4403 10.4403 k = 0.6445-0.3341-0.9150 ( 5029 PWs) bands (ev): -20.5276 -20.5276 -20.5232 -20.5232 -8.1797 -8.1797 -8.0105 -8.0105 -7.2697 -7.2697 -6.9325 -6.9325 -5.6363 -5.6363 -5.3891 -5.3891 -5.2205 -5.2205 -5.0460 -5.0460 -4.0292 -4.0292 -3.6009 -3.6009 2.4239 2.4239 2.6481 2.6481 2.6804 2.6804 3.1904 3.1904 3.3298 3.3298 3.3811 3.3811 5.1192 5.1192 5.2930 5.2930 5.5484 5.5484 5.6678 5.6678 8.2251 8.2251 8.2909 8.2909 9.6731 9.6731 10.4336 10.4336 k = 0.6518-0.3583-0.9150 ( 5033 PWs) bands (ev): -20.5275 -20.5275 -20.5228 -20.5228 -8.1824 -8.1824 -8.0112 -8.0112 -7.2717 -7.2717 -6.9334 -6.9334 -5.6255 -5.6255 -5.4038 -5.4038 -5.2191 -5.2191 -5.0430 -5.0430 -4.0146 -4.0146 -3.6029 -3.6029 2.3899 2.3899 2.6143 2.6143 2.6430 2.6430 3.1755 3.1755 3.3365 3.3365 3.3918 3.3918 5.1349 5.1349 5.2922 5.2922 5.5506 5.5506 5.6856 5.6856 8.2748 8.2748 8.3474 8.3474 9.7048 9.7048 10.4262 10.4262 k = 0.6590-0.3824-0.9150 ( 5035 PWs) bands (ev): -20.5273 -20.5273 -20.5223 -20.5223 -8.1870 -8.1870 -8.0098 -8.0098 -7.2747 -7.2747 -6.9335 -6.9335 -5.6161 -5.6161 -5.4166 -5.4166 -5.2189 -5.2189 -5.0377 -5.0377 -4.0004 -4.0004 -3.6052 -3.6052 2.3555 2.3555 2.5798 2.5798 2.6076 2.6076 3.1608 3.1608 3.3418 3.3418 3.4032 3.4032 5.1485 5.1485 5.2914 5.2914 5.5511 5.5511 5.7034 5.7034 8.3259 8.3259 8.4040 8.4040 9.7406 9.7406 10.4185 10.4185 k = 0.3410-1.1408-0.0000 ( 5035 PWs) bands (ev): -20.5273 -20.5273 -20.5223 -20.5223 -8.1870 -8.1870 -8.0098 -8.0098 -7.2747 -7.2747 -6.9335 -6.9335 -5.6161 -5.6161 -5.4166 -5.4166 -5.2189 -5.2189 -5.0377 -5.0377 -4.0004 -4.0004 -3.6052 -3.6052 2.3555 2.3555 2.5798 2.5798 2.6076 2.6076 3.1608 3.1608 3.3418 3.3418 3.4032 3.4032 5.1485 5.1485 5.2914 5.2914 5.5511 5.5511 5.7034 5.7034 8.3259 8.3259 8.4040 8.4040 9.7406 9.7406 10.4185 10.4185 k = 0.3336-1.1160-0.0000 ( 5041 PWs) bands (ev): -20.5272 -20.5272 -20.5219 -20.5219 -8.1931 -8.1931 -8.0066 -8.0066 -7.2786 -7.2786 -6.9329 -6.9329 -5.6085 -5.6085 -5.4268 -5.4268 -5.2196 -5.2196 -5.0304 -5.0304 -3.9864 -3.9864 -3.6080 -3.6080 2.3197 2.3197 2.5437 2.5437 2.5738 2.5738 3.1462 3.1462 3.3463 3.3463 3.4145 3.4145 5.1600 5.1600 5.2905 5.2905 5.5503 5.5503 5.7217 5.7217 8.3798 8.3798 8.4619 8.4619 9.7815 9.7815 10.4103 10.4103 k = 0.3262-1.0912-0.0000 ( 5049 PWs) bands (ev): -20.5272 -20.5272 -20.5215 -20.5215 -8.2003 -8.2003 -8.0022 -8.0022 -7.2831 -7.2831 -6.9316 -6.9316 -5.6033 -5.6033 -5.4336 -5.4336 -5.2209 -5.2209 -5.0218 -5.0218 -3.9728 -3.9728 -3.6111 -3.6111 2.2830 2.2830 2.5067 2.5067 2.5432 2.5432 3.1325 3.1325 3.3500 3.3500 3.4246 3.4246 5.1688 5.1688 5.2898 5.2898 5.5485 5.5485 5.7397 5.7397 8.4348 8.4348 8.5198 8.5198 9.8264 9.8264 10.4021 10.4021 k = 0.3188-1.0664-0.0000 ( 5049 PWs) bands (ev): -20.5271 -20.5271 -20.5210 -20.5210 -8.2080 -8.2080 -7.9974 -7.9974 -7.2879 -7.2879 -6.9298 -6.9298 -5.6009 -5.6009 -5.4366 -5.4366 -5.2224 -5.2224 -5.0122 -5.0122 -3.9596 -3.9596 -3.6144 -3.6144 2.2455 2.2455 2.4688 2.4688 2.5163 2.5163 3.1198 3.1198 3.3532 3.3532 3.4332 3.4332 5.1749 5.1749 5.2893 5.2893 5.5458 5.5458 5.7571 5.7571 8.4908 8.4908 8.5775 8.5775 9.8751 9.8751 10.3940 10.3940 k = 0.3114-1.0416-0.0000 ( 5045 PWs) bands (ev): -20.5271 -20.5271 -20.5207 -20.5207 -8.2159 -8.2159 -7.9925 -7.9925 -7.2928 -7.2928 -6.9276 -6.9276 -5.6010 -5.6010 -5.4359 -5.4359 -5.2240 -5.2240 -5.0022 -5.0022 -3.9468 -3.9468 -3.6179 -3.6179 2.2070 2.2070 2.4299 2.4299 2.4932 2.4932 3.1084 3.1084 3.3556 3.3556 3.4399 3.4399 5.1783 5.1783 5.2891 5.2891 5.5425 5.5425 5.7738 5.7738 8.5478 8.5478 8.6351 8.6351 9.9272 9.9272 10.3864 10.3864 k = 0.3039-1.0168-0.0000 ( 5053 PWs) bands (ev): -20.5272 -20.5272 -20.5203 -20.5203 -8.2237 -8.2237 -7.9880 -7.9880 -7.2975 -7.2975 -6.9252 -6.9252 -5.6029 -5.6029 -5.4319 -5.4319 -5.2253 -5.2253 -4.9921 -4.9921 -3.9344 -3.9344 -3.6215 -3.6215 2.1677 2.1677 2.3904 2.3904 2.4742 2.4742 3.0985 3.0985 3.3571 3.3571 3.4445 3.4445 5.1791 5.1791 5.2894 5.2894 5.5387 5.5387 5.7896 5.7896 8.6055 8.6055 8.6926 8.6926 9.9825 9.9825 10.3793 10.3793 k = 0.2965-0.9920-0.0000 ( 5043 PWs) bands (ev): -20.5272 -20.5272 -20.5200 -20.5200 -8.2310 -8.2310 -7.9844 -7.9844 -7.3016 -7.3016 -6.9226 -6.9226 -5.6061 -5.6061 -5.4254 -5.4254 -5.2262 -5.2262 -4.9821 -4.9821 -3.9223 -3.9223 -3.6252 -3.6252 2.1277 2.1277 2.3501 2.3501 2.4592 2.4592 3.0901 3.0901 3.3575 3.3575 3.4470 3.4470 5.1775 5.1775 5.2902 5.2902 5.5345 5.5345 5.8046 5.8046 8.6638 8.6638 8.7500 8.7500 10.0404 10.0404 10.3729 10.3729 k = 0.2891-0.9672-0.0000 ( 5039 PWs) bands (ev): -20.5273 -20.5273 -20.5197 -20.5197 -8.2378 -8.2378 -7.9820 -7.9820 -7.3049 -7.3049 -6.9201 -6.9201 -5.6095 -5.6095 -5.4171 -5.4171 -5.2266 -5.2266 -4.9726 -4.9726 -3.9105 -3.9105 -3.6288 -3.6288 2.0871 2.0871 2.3094 2.3094 2.4480 2.4480 3.0834 3.0834 3.3567 3.3567 3.4473 3.4473 5.1737 5.1737 5.2916 5.2916 5.5298 5.5298 5.8186 5.8186 8.7227 8.7227 8.8075 8.8075 10.1002 10.1002 10.3675 10.3675 k = 0.2817-0.9424-0.0000 ( 5033 PWs) bands (ev): -20.5275 -20.5275 -20.5194 -20.5194 -8.2439 -8.2439 -7.9810 -7.9810 -7.3072 -7.3072 -6.9177 -6.9177 -5.6126 -5.6126 -5.4078 -5.4078 -5.2264 -5.2264 -4.9637 -4.9637 -3.8989 -3.8989 -3.6323 -3.6323 2.0462 2.0462 2.2682 2.2682 2.4407 2.4407 3.0784 3.0784 3.3541 3.3541 3.4455 3.4455 5.1681 5.1681 5.2937 5.2937 5.5246 5.5246 5.8315 5.8315 8.7821 8.7821 8.8651 8.8651 10.1613 10.1613 10.3633 10.3633 k = 0.2743-0.9176-0.0000 ( 5023 PWs) bands (ev): -20.5277 -20.5277 -20.5191 -20.5191 -8.2491 -8.2491 -7.9816 -7.9816 -7.3082 -7.3082 -6.9156 -6.9156 -5.6148 -5.6148 -5.3977 -5.3977 -5.2255 -5.2255 -4.9557 -4.9557 -3.8876 -3.8876 -3.6356 -3.6356 2.0052 2.0052 2.2268 2.2268 2.4371 2.4371 3.0752 3.0752 3.3496 3.3496 3.4419 3.4419 5.1611 5.1611 5.2965 5.2965 5.5188 5.5188 5.8433 5.8433 8.8419 8.8419 8.9229 8.9229 10.2223 10.2223 10.3607 10.3607 k = 0.2669-0.8928-0.0000 ( 5023 PWs) bands (ev): -20.5279 -20.5279 -20.5189 -20.5189 -8.2536 -8.2536 -7.9840 -7.9840 -7.3079 -7.3079 -6.9137 -6.9137 -5.6158 -5.6158 -5.3875 -5.3875 -5.2239 -5.2239 -4.9486 -4.9486 -3.8764 -3.8764 -3.6387 -3.6387 1.9642 1.9642 2.1851 2.1851 2.4370 2.4370 3.0738 3.0738 3.3425 3.3425 3.4369 3.4369 5.1530 5.1530 5.3003 5.3003 5.5122 5.5122 5.8540 5.8540 8.9020 8.9020 8.9809 8.9809 10.2800 10.2800 10.3615 10.3615 k = 0.2595-0.8680-0.0000 ( 5021 PWs) bands (ev): -20.5282 -20.5282 -20.5188 -20.5188 -8.2571 -8.2571 -7.9882 -7.9882 -7.3062 -7.3062 -6.9122 -6.9122 -5.6153 -5.6153 -5.3772 -5.3772 -5.2215 -5.2215 -4.9425 -4.9425 -3.8655 -3.8655 -3.6414 -3.6414 1.9234 1.9234 2.1432 2.1432 2.4404 2.4404 3.0742 3.0742 3.3324 3.3324 3.4308 3.4308 5.1441 5.1441 5.3050 5.3050 5.5048 5.5048 5.8636 5.8636 8.9624 8.9624 9.0393 9.0393 10.3230 10.3230 10.3750 10.3750 k = 0.2520-0.8432-0.0000 ( 5023 PWs) bands (ev): -20.5286 -20.5286 -20.5186 -20.5186 -8.2596 -8.2596 -7.9943 -7.9943 -7.3030 -7.3030 -6.9112 -6.9112 -5.6132 -5.6132 -5.3672 -5.3672 -5.2183 -5.2183 -4.9376 -4.9376 -3.8546 -3.8546 -3.6437 -3.6437 1.8830 1.8830 2.1014 2.1014 2.4471 2.4471 3.0765 3.0765 3.3188 3.3188 3.4239 3.4239 5.1349 5.1349 5.3109 5.3109 5.4964 5.4964 5.8721 5.8721 9.0230 9.0230 9.0980 9.0980 10.3361 10.3361 10.4083 10.4083 k = 0.2446-0.8184-0.0000 ( 5023 PWs) bands (ev): -20.5289 -20.5289 -20.5185 -20.5185 -8.2612 -8.2612 -8.0021 -8.0021 -7.2983 -7.2983 -6.9107 -6.9107 -5.6092 -5.6092 -5.3574 -5.3574 -5.2144 -5.2144 -4.9339 -4.9339 -3.8440 -3.8440 -3.6455 -3.6455 1.8432 1.8432 2.0596 2.0596 2.4570 2.4570 3.0805 3.0805 3.3016 3.3016 3.4167 3.4167 5.1256 5.1256 5.3178 5.3178 5.4872 5.4872 5.8795 5.8795 9.0836 9.0836 9.1571 9.1571 10.3374 10.3374 10.4186 10.4186 k = 0.2372-0.7936-0.0000 ( 5021 PWs) bands (ev): -20.5294 -20.5294 -20.5185 -20.5185 -8.2618 -8.2618 -8.0116 -8.0116 -7.2922 -7.2922 -6.9107 -6.9107 -5.6035 -5.6035 -5.3480 -5.3480 -5.2098 -5.2098 -4.9314 -4.9314 -3.8334 -3.8334 -3.6468 -3.6468 1.8039 1.8039 2.0180 2.0180 2.4701 2.4701 3.0864 3.0864 3.2806 3.2806 3.4091 3.4091 5.1166 5.1166 5.3260 5.3260 5.4769 5.4769 5.8857 5.8857 9.1441 9.1441 9.2167 9.2167 10.3356 10.3356 10.4122 10.4122 k = 0.2298-0.7688-0.0000 ( 5019 PWs) bands (ev): -20.5298 -20.5298 -20.5184 -20.5184 -8.2615 -8.2615 -8.0227 -8.0227 -7.2849 -7.2849 -6.9112 -6.9112 -5.5960 -5.5960 -5.3390 -5.3390 -5.2046 -5.2046 -4.9302 -4.9302 -3.8230 -3.8230 -3.6475 -3.6475 1.7655 1.7655 1.9767 1.9767 2.4861 2.4861 3.0939 3.0939 3.2559 3.2559 3.4013 3.4013 5.1081 5.1081 5.3353 5.3353 5.4657 5.4657 5.8908 5.8908 9.2045 9.2045 9.2766 9.2766 10.3318 10.3318 10.4027 10.4027 k = 0.2224-0.7440-0.0000 ( 5027 PWs) bands (ev): -20.5303 -20.5303 -20.5184 -20.5184 -8.2602 -8.2602 -8.0351 -8.0351 -7.2764 -7.2764 -6.9123 -6.9123 -5.5867 -5.5867 -5.3304 -5.3304 -5.1988 -5.1988 -4.9302 -4.9302 -3.8128 -3.8128 -3.6477 -3.6477 1.7278 1.7278 1.9357 1.9357 2.5049 2.5049 3.1032 3.1032 3.2278 3.2278 3.3931 3.3931 5.1003 5.1003 5.3457 5.3457 5.4536 5.4536 5.8947 5.8947 9.2645 9.2645 9.3369 9.3369 10.3259 10.3259 10.3917 10.3917 k = 0.2150-0.7192-0.0000 ( 5031 PWs) bands (ev): -20.5309 -20.5309 -20.5185 -20.5185 -8.2581 -8.2581 -8.0485 -8.0485 -7.2670 -7.2670 -6.9140 -6.9140 -5.5758 -5.5758 -5.3220 -5.3220 -5.1926 -5.1926 -4.9314 -4.9314 -3.8028 -3.8028 -3.6473 -3.6473 1.6911 1.6911 1.8952 1.8952 2.5266 2.5266 3.1138 3.1138 3.1968 3.1968 3.3845 3.3845 5.0934 5.0934 5.3570 5.3570 5.4410 5.4410 5.8976 5.8976 9.3240 9.3240 9.3975 9.3975 10.3173 10.3173 10.3789 10.3789 k = 0.2076-0.6944-0.0000 ( 5027 PWs) bands (ev): -20.5314 -20.5314 -20.5186 -20.5186 -8.2553 -8.2553 -8.0628 -8.0628 -7.2567 -7.2567 -6.9162 -6.9162 -5.5632 -5.5632 -5.3138 -5.3138 -5.1861 -5.1861 -4.9337 -4.9337 -3.7929 -3.7929 -3.6463 -3.6463 1.6554 1.6554 1.8552 1.8552 2.5508 2.5508 3.1247 3.1247 3.1644 3.1644 3.3754 3.3754 5.0875 5.0875 5.3686 5.3686 5.4284 5.4284 5.8993 5.8993 9.3828 9.3828 9.4583 9.4583 10.3051 10.3051 10.3642 10.3642 k = 0.2002-0.6696-0.0000 ( 5029 PWs) bands (ev): -20.5320 -20.5320 -20.5187 -20.5187 -8.2519 -8.2519 -8.0775 -8.0775 -7.2459 -7.2459 -6.9189 -6.9189 -5.5492 -5.5492 -5.3058 -5.3058 -5.1793 -5.1793 -4.9370 -4.9370 -3.7833 -3.7833 -3.6447 -3.6447 1.6207 1.6207 1.8158 1.8158 2.5775 2.5775 3.1186 3.1186 3.1478 3.1478 3.3657 3.3657 5.0827 5.0827 5.3782 5.3782 5.4184 5.4184 5.8999 5.8999 9.4405 9.4405 9.5190 9.5190 10.2880 10.2880 10.3469 10.3469 k = 0.1927-0.6448-0.0000 ( 5019 PWs) bands (ev): -20.5327 -20.5327 -20.5188 -20.5188 -8.2481 -8.2481 -8.0924 -8.0924 -7.2346 -7.2346 -6.9220 -6.9220 -5.5339 -5.5339 -5.2979 -5.2979 -5.1725 -5.1725 -4.9412 -4.9412 -3.7740 -3.7740 -3.6426 -3.6426 1.5871 1.5871 1.7771 1.7771 2.6066 2.6066 3.0830 3.0830 3.1601 3.1601 3.3554 3.3554 5.0790 5.0790 5.3785 5.3785 5.4180 5.4180 5.8995 5.8995 9.4970 9.4970 9.5795 9.5795 10.2628 10.2628 10.3264 10.3264 k = 0.1853-0.6200-0.0000 ( 5017 PWs) bands (ev): -20.5333 -20.5333 -20.5190 -20.5190 -8.2443 -8.2443 -8.1068 -8.1068 -7.2231 -7.2231 -6.9256 -6.9256 -5.5174 -5.5174 -5.2900 -5.2900 -5.1656 -5.1656 -4.9462 -4.9462 -3.7649 -3.7649 -3.6400 -3.6400 1.5547 1.5547 1.7392 1.7392 2.6379 2.6379 3.0426 3.0426 3.1767 3.1767 3.3445 3.3445 5.0764 5.0764 5.3679 5.3679 5.4292 5.4292 5.8979 5.8979 9.5518 9.5518 9.6396 9.6396 10.2224 10.2224 10.2997 10.2997 k = 0.1779-0.5952-0.0000 ( 5015 PWs) bands (ev): -20.5340 -20.5340 -20.5192 -20.5192 -8.2412 -8.2412 -8.1201 -8.1201 -7.2115 -7.2115 -6.9295 -6.9295 -5.5001 -5.5001 -5.2821 -5.2821 -5.1588 -5.1588 -4.9518 -4.9518 -3.7562 -3.7562 -3.6370 -3.6370 1.5234 1.5234 1.7022 1.7022 2.6712 2.6712 3.0002 3.0002 3.1950 3.1950 3.3332 3.3332 5.0748 5.0748 5.3529 5.3529 5.4453 5.4453 5.8953 5.8953 9.6045 9.6045 9.6988 9.6988 10.1581 10.1581 10.2603 10.2603 k = 0.1705-0.5704-0.0000 ( 5009 PWs) bands (ev): -20.5347 -20.5347 -20.5194 -20.5194 -8.2395 -8.2395 -8.1313 -8.1313 -7.2001 -7.2001 -6.9337 -6.9337 -5.4820 -5.4820 -5.2742 -5.2742 -5.1521 -5.1521 -4.9577 -4.9577 -3.7478 -3.7478 -3.6336 -3.6336 1.4933 1.4933 1.6661 1.6661 2.7064 2.7064 2.9565 2.9565 3.2145 3.2145 3.3215 3.3215 5.0741 5.0741 5.3366 5.3366 5.4636 5.4636 5.8916 5.8916 9.6541 9.6541 9.7567 9.7567 10.0760 10.0760 10.2179 10.2179 k = 0.1631-0.5456-0.0000 ( 5013 PWs) bands (ev): -20.5355 -20.5355 -20.5196 -20.5196 -8.2405 -8.2405 -8.1391 -8.1391 -7.1890 -7.1890 -6.9380 -6.9380 -5.4634 -5.4634 -5.2662 -5.2662 -5.1456 -5.1456 -4.9638 -4.9638 -3.7398 -3.7398 -3.6299 -3.6299 1.4645 1.4645 1.6310 1.6310 2.7431 2.7431 2.9120 2.9120 3.2348 3.2348 3.3099 3.3099 5.0741 5.0741 5.3197 5.3197 5.4831 5.4831 5.8868 5.8868 9.6993 9.6993 9.8128 9.8128 9.9882 9.9882 10.1751 10.1751 k = 0.1557-0.5208-0.0000 ( 5019 PWs) bands (ev): -20.5362 -20.5362 -20.5199 -20.5199 -8.2450 -8.2450 -8.1426 -8.1426 -7.1784 -7.1784 -6.9423 -6.9423 -5.4445 -5.4445 -5.2582 -5.2582 -5.1394 -5.1394 -4.9696 -4.9696 -3.7323 -3.7323 -3.6260 -3.6260 1.4369 1.4369 1.5971 1.5971 2.7808 2.7808 2.8676 2.8676 3.2545 3.2545 3.2994 3.2994 5.0745 5.0745 5.3029 5.3029 5.5035 5.5035 5.8811 5.8811 9.7358 9.7358 9.8653 9.8653 9.9040 9.9040 10.1316 10.1316 k = 0.1483-0.4960-0.0000 ( 5023 PWs) bands (ev): -20.5369 -20.5369 -20.5202 -20.5202 -8.2532 -8.2532 -8.1415 -8.1415 -7.1687 -7.1687 -6.9465 -6.9465 -5.4257 -5.4257 -5.2503 -5.2503 -5.1338 -5.1338 -4.9748 -4.9748 -3.7252 -3.7252 -3.6219 -3.6219 1.4106 1.4106 1.5642 1.5642 2.8077 2.8077 2.8350 2.8350 3.2670 3.2670 3.2969 3.2969 5.0750 5.0750 5.2865 5.2865 5.5245 5.5245 5.8745 5.8745 9.7442 9.7442 9.8379 9.8379 9.9185 9.9185 10.0898 10.0898 k = 0.1409-0.4712-0.0000 ( 5023 PWs) bands (ev): -20.5377 -20.5377 -20.5205 -20.5205 -8.2643 -8.2643 -8.1366 -8.1366 -7.1599 -7.1599 -6.9503 -6.9503 -5.4070 -5.4070 -5.2425 -5.2425 -5.1289 -5.1289 -4.9790 -4.9790 -3.7186 -3.7186 -3.6178 -3.6178 1.3855 1.3855 1.5327 1.5327 2.7718 2.7718 2.8663 2.8663 3.2620 3.2620 3.3124 3.3124 5.0752 5.0752 5.2710 5.2710 5.5457 5.5457 5.8670 5.8670 9.6892 9.6892 9.8282 9.8282 9.9643 9.9643 10.0555 10.0555 k = 0.1334-0.4464-0.0000 ( 5023 PWs) bands (ev): -20.5384 -20.5384 -20.5208 -20.5208 -8.2772 -8.2772 -8.1289 -8.1289 -7.1523 -7.1523 -6.9536 -6.9536 -5.3888 -5.3888 -5.2350 -5.2350 -5.1250 -5.1250 -4.9817 -4.9817 -3.7125 -3.7125 -3.6136 -3.6136 1.3617 1.3617 1.5024 1.5024 2.7272 2.7272 2.9077 2.9077 3.2505 3.2505 3.3351 3.3351 5.0747 5.0747 5.2569 5.2569 5.5670 5.5670 5.8589 5.8589 9.6106 9.6106 9.8250 9.8250 10.0028 10.0028 10.0389 10.0389 k = 0.1260-0.4216-0.0000 ( 5015 PWs) bands (ev): -20.5391 -20.5391 -20.5211 -20.5211 -8.2911 -8.2911 -8.1194 -8.1194 -7.1461 -7.1461 -6.9562 -6.9562 -5.3711 -5.3711 -5.2278 -5.2278 -5.1225 -5.1225 -4.9822 -4.9822 -3.7071 -3.7071 -3.6094 -3.6094 1.3393 1.3393 1.4734 1.4734 2.6827 2.6827 2.9503 2.9503 3.2378 3.2378 3.3595 3.3595 5.0728 5.0728 5.2445 5.2445 5.5880 5.5880 5.8502 5.8502 9.5307 9.5307 9.8029 9.8029 10.0260 10.0260 10.0501 10.0501 k = 0.1186-0.3968-0.0000 ( 5013 PWs) bands (ev): -20.5399 -20.5399 -20.5214 -20.5214 -8.3054 -8.3054 -8.1085 -8.1085 -7.1416 -7.1416 -6.9580 -6.9580 -5.3542 -5.3542 -5.2211 -5.2211 -5.1215 -5.1215 -4.9801 -4.9801 -3.7022 -3.7022 -3.6052 -3.6052 1.3181 1.3181 1.4459 1.4459 2.6389 2.6389 2.9935 2.9935 3.2248 3.2248 3.3847 3.3847 5.0693 5.0693 5.2342 5.2342 5.6083 5.6083 5.8414 5.8414 9.4532 9.4532 9.7653 9.7653 10.0436 10.0436 10.0696 10.0696 k = 0.1112-0.3720-0.0000 ( 5013 PWs) bands (ev): -20.5406 -20.5406 -20.5217 -20.5217 -8.3196 -8.3196 -8.0968 -8.0968 -7.1387 -7.1387 -6.9587 -6.9587 -5.3382 -5.3382 -5.2150 -5.2150 -5.1223 -5.1223 -4.9753 -4.9753 -3.6981 -3.6981 -3.6011 -3.6011 1.2982 1.2982 1.4199 1.4199 2.5963 2.5963 3.0369 3.0369 3.2121 3.2121 3.4103 3.4103 5.0638 5.0638 5.2262 5.2262 5.6274 5.6274 5.8327 5.8327 9.3794 9.3794 9.7207 9.7207 10.0602 10.0602 10.0826 10.0826 k = 0.1038-0.3472-0.0000 ( 5019 PWs) bands (ev): -20.5412 -20.5412 -20.5220 -20.5220 -8.3336 -8.3336 -8.0845 -8.0845 -7.1377 -7.1377 -6.9583 -6.9583 -5.3231 -5.3231 -5.2095 -5.2095 -5.1246 -5.1246 -4.9679 -4.9679 -3.6946 -3.6946 -3.5971 -3.5971 1.2796 1.2796 1.3953 1.3953 2.5551 2.5551 3.0796 3.0796 3.2002 3.2002 3.4360 3.4360 5.0564 5.0564 5.2204 5.2204 5.6447 5.6447 5.8247 5.8247 9.3097 9.3097 9.6742 9.6742 10.0652 10.0652 10.0989 10.0989 k = 0.0964-0.3224-0.0000 ( 5023 PWs) bands (ev): -20.5419 -20.5419 -20.5223 -20.5223 -8.3470 -8.3470 -8.0719 -8.0719 -7.1382 -7.1382 -6.9570 -6.9570 -5.3090 -5.3090 -5.2049 -5.2049 -5.1281 -5.1281 -4.9581 -4.9581 -3.6917 -3.6917 -3.5933 -3.5933 1.2623 1.2623 1.3724 1.3724 2.5155 2.5155 3.1201 3.1201 3.1904 3.1904 3.4615 3.4615 5.0473 5.0473 5.2165 5.2165 5.6594 5.6594 5.8182 5.8182 9.2445 9.2445 9.6291 9.6291 10.0624 10.0624 10.1188 10.1188 k = 0.0890-0.2976-0.0000 ( 5021 PWs) bands (ev): -20.5425 -20.5425 -20.5226 -20.5226 -8.3599 -8.3599 -8.0591 -8.0591 -7.1403 -7.1403 -6.9547 -6.9547 -5.2959 -5.2959 -5.2011 -5.2011 -5.1325 -5.1325 -4.9466 -4.9466 -3.6895 -3.6895 -3.5896 -3.5896 1.2463 1.2463 1.3510 1.3510 2.4779 2.4779 3.1499 3.1499 3.1912 3.1912 3.4867 3.4867 5.0370 5.0370 5.2140 5.2140 5.6705 5.6705 5.8142 5.8142 9.1840 9.1840 9.5871 9.5871 10.0587 10.0587 10.1372 10.1372 k = 0.0815-0.2728-0.0000 ( 5013 PWs) bands (ev): -20.5431 -20.5431 -20.5229 -20.5229 -8.3720 -8.3720 -8.0465 -8.0465 -7.1436 -7.1436 -6.9518 -6.9518 -5.2838 -5.2838 -5.1981 -5.1981 -5.1373 -5.1373 -4.9338 -4.9338 -3.6879 -3.6879 -3.5861 -3.5861 1.2315 1.2315 1.3312 1.3312 2.4425 2.4425 3.1524 3.1524 3.2187 3.2187 3.5112 3.5112 5.0259 5.0259 5.2125 5.2125 5.6771 5.6771 5.8135 5.8135 9.1282 9.1282 9.5495 9.5495 10.0564 10.0564 10.1521 10.1521 k = 0.0741-0.2480-0.0000 ( 5011 PWs) bands (ev): -20.5437 -20.5437 -20.5232 -20.5232 -8.3833 -8.3833 -8.0342 -8.0342 -7.1478 -7.1478 -6.9484 -6.9484 -5.2727 -5.2727 -5.1960 -5.1960 -5.1420 -5.1420 -4.9202 -4.9202 -3.6869 -3.6869 -3.5827 -3.5827 1.2181 1.2181 1.3131 1.3131 2.4094 2.4094 3.1446 3.1446 3.2558 3.2558 3.5349 3.5349 5.0145 5.0145 5.2114 5.2114 5.6791 5.6791 5.8164 5.8164 9.0773 9.0773 9.5174 9.5174 10.0563 10.0563 10.1608 10.1608 k = 0.0667-0.2232-0.0000 ( 5009 PWs) bands (ev): -20.5442 -20.5442 -20.5234 -20.5234 -8.3936 -8.3936 -8.0223 -8.0223 -7.1527 -7.1527 -6.9447 -6.9447 -5.2625 -5.2625 -5.1948 -5.1948 -5.1465 -5.1465 -4.9064 -4.9064 -3.6864 -3.6864 -3.5797 -3.5797 1.2059 1.2059 1.2967 1.2967 2.3788 2.3788 3.1354 3.1354 3.2930 3.2930 3.5575 3.5575 5.0032 5.0032 5.2105 5.2105 5.6769 5.6769 5.8224 5.8224 9.0313 9.0313 9.4913 9.4913 10.0588 10.0588 10.1572 10.1572 k = 0.0593-0.1984-0.0000 ( 4999 PWs) bands (ev): -20.5447 -20.5447 -20.5237 -20.5237 -8.4030 -8.4030 -8.0111 -8.0111 -7.1580 -7.1580 -6.9409 -6.9409 -5.2533 -5.2533 -5.1945 -5.1945 -5.1504 -5.1504 -4.8929 -4.8929 -3.6863 -3.6863 -3.5769 -3.5769 1.1950 1.1950 1.2820 1.2820 2.3511 2.3511 3.1265 3.1265 3.3283 3.3283 3.5788 3.5788 4.9924 4.9924 5.2094 5.2094 5.6719 5.6719 5.8304 5.8304 8.9902 8.9902 9.4720 9.4720 10.0635 10.0635 10.1287 10.1287 k = 0.0519-0.1736-0.0000 ( 4997 PWs) bands (ev): -20.5451 -20.5451 -20.5239 -20.5239 -8.4115 -8.4115 -8.0007 -8.0007 -7.1633 -7.1633 -6.9372 -6.9372 -5.2451 -5.2451 -5.1950 -5.1950 -5.1537 -5.1537 -4.8799 -4.8799 -3.6865 -3.6865 -3.5744 -3.5744 1.1854 1.1854 1.2691 1.2691 2.3261 2.3261 3.1183 3.1183 3.3611 3.3611 3.5985 3.5985 4.9823 4.9823 5.2082 5.2082 5.6651 5.6651 5.8393 5.8393 8.9540 8.9540 9.4596 9.4596 10.0610 10.0610 10.0821 10.0821 k = 0.0445-0.1488-0.0000 ( 4995 PWs) bands (ev): -20.5455 -20.5455 -20.5241 -20.5241 -8.4188 -8.4188 -7.9912 -7.9912 -7.1685 -7.1685 -6.9338 -6.9338 -5.2379 -5.2379 -5.1962 -5.1962 -5.1561 -5.1561 -4.8680 -4.8680 -3.6869 -3.6869 -3.5721 -3.5721 1.1770 1.1770 1.2578 1.2578 2.3043 2.3043 3.1110 3.1110 3.3907 3.3907 3.6163 3.6163 4.9732 4.9732 5.2067 5.2067 5.6576 5.6576 5.8482 5.8482 8.9227 8.9227 9.4546 9.4546 9.9991 9.9991 10.0848 10.0848 k = 0.0371-0.1240-0.0000 ( 4993 PWs) bands (ev): -20.5458 -20.5458 -20.5242 -20.5242 -8.4251 -8.4251 -7.9829 -7.9829 -7.1733 -7.1733 -6.9307 -6.9307 -5.2316 -5.2316 -5.1978 -5.1978 -5.1579 -5.1579 -4.8574 -4.8574 -3.6874 -3.6874 -3.5703 -3.5703 1.1699 1.1699 1.2483 1.2483 2.2855 2.2855 3.1046 3.1046 3.4167 3.4167 3.6319 3.6319 4.9652 4.9652 5.2051 5.2051 5.6502 5.6502 5.8565 5.8565 8.8963 8.8963 9.4568 9.4568 9.9287 9.9287 10.0963 10.0963 k = 0.0297-0.0992-0.0000 ( 4991 PWs) bands (ev): -20.5460 -20.5460 -20.5244 -20.5244 -8.4303 -8.4303 -7.9759 -7.9759 -7.1774 -7.1774 -6.9281 -6.9281 -5.2262 -5.2262 -5.1997 -5.1997 -5.1592 -5.1592 -4.8483 -4.8483 -3.6880 -3.6880 -3.5687 -3.5687 1.1641 1.1641 1.2405 1.2405 2.2701 2.2701 3.0993 3.0993 3.4385 3.4385 3.6452 3.6452 4.9584 4.9584 5.2035 5.2035 5.6436 5.6436 5.8637 5.8637 8.8748 8.8748 9.4659 9.4659 9.8611 9.8611 10.1091 10.1091 k = 0.0222-0.0744-0.0000 ( 4993 PWs) bands (ev): -20.5462 -20.5462 -20.5245 -20.5245 -8.4343 -8.4343 -7.9703 -7.9703 -7.1809 -7.1809 -6.9260 -6.9260 -5.2218 -5.2218 -5.2016 -5.2016 -5.1600 -5.1600 -4.8410 -4.8410 -3.6886 -3.6886 -3.5675 -3.5675 1.1596 1.1596 1.2345 1.2345 2.2580 2.2580 3.0951 3.0951 3.4559 3.4559 3.6558 3.6558 4.9531 4.9531 5.2021 5.2021 5.6379 5.6379 5.8696 5.8696 8.8581 8.8581 9.4813 9.4813 9.7990 9.7990 10.1217 10.1217 k = 0.0148-0.0496-0.0000 ( 4989 PWs) bands (ev): -20.5464 -20.5464 -20.5246 -20.5246 -8.4372 -8.4372 -7.9662 -7.9662 -7.1834 -7.1834 -6.9245 -6.9245 -5.2184 -5.2184 -5.2034 -5.2034 -5.1606 -5.1606 -4.8357 -4.8357 -3.6890 -3.6890 -3.5666 -3.5666 1.1564 1.1564 1.2302 1.2302 2.2493 2.2493 3.0921 3.0921 3.4686 3.4686 3.6636 3.6636 4.9492 4.9492 5.2009 5.2009 5.6337 5.6337 5.8739 5.8739 8.8461 8.8461 9.5008 9.5008 9.7455 9.7455 10.1327 10.1327 k = 0.0074-0.0248-0.0000 ( 4991 PWs) bands (ev): -20.5465 -20.5465 -20.5246 -20.5246 -8.4390 -8.4390 -7.9637 -7.9637 -7.1850 -7.1850 -6.9235 -6.9235 -5.2161 -5.2161 -5.2047 -5.2047 -5.1608 -5.1608 -4.8324 -4.8324 -3.6893 -3.6893 -3.5661 -3.5661 1.1544 1.1544 1.2276 1.2276 2.2440 2.2440 3.0903 3.0903 3.4762 3.4762 3.6683 3.6683 4.9468 4.9468 5.2001 5.2001 5.6311 5.6311 5.8765 5.8765 8.8390 8.8390 9.5200 9.5200 9.7058 9.7058 10.1402 10.1402 k = 0.0000 0.0000 0.0000 ( 4987 PWs) bands (ev): -20.5465 -20.5465 -20.5246 -20.5246 -8.4395 -8.4395 -7.9628 -7.9628 -7.1856 -7.1856 -6.9232 -6.9232 -5.2153 -5.2153 -5.2052 -5.2052 -5.1609 -5.1609 -4.8313 -4.8313 -3.6894 -3.6894 -3.5659 -3.5659 1.1538 1.1538 1.2267 1.2267 2.2423 2.2423 3.0897 3.0897 3.4788 3.4788 3.6699 3.6699 4.9461 4.9461 5.1999 5.1999 5.6302 5.6302 5.8774 5.8774 8.8366 8.8366 9.5288 9.5288 9.6901 9.6901 10.1429 10.1429 k = 0.0000 0.0000 0.0000 ( 4987 PWs) bands (ev): -20.5465 -20.5465 -20.5246 -20.5246 -8.4395 -8.4395 -7.9628 -7.9628 -7.1856 -7.1856 -6.9232 -6.9232 -5.2153 -5.2153 -5.2052 -5.2052 -5.1609 -5.1609 -4.8313 -4.8313 -3.6894 -3.6894 -3.5659 -3.5659 1.1538 1.1538 1.2267 1.2267 2.2423 2.2423 3.0897 3.0897 3.4788 3.4788 3.6699 3.6699 4.9461 4.9461 5.1999 5.1999 5.6302 5.6302 5.8774 5.8774 8.8366 8.8366 9.5288 9.5288 9.6901 9.6901 10.1429 10.1429 k = 0.0128-0.0195-0.0117 ( 4991 PWs) bands (ev): -20.5465 -20.5465 -20.5246 -20.5246 -8.4390 -8.4390 -7.9635 -7.9635 -7.1851 -7.1851 -6.9235 -6.9235 -5.2161 -5.2161 -5.2049 -5.2049 -5.1609 -5.1609 -4.8323 -4.8323 -3.6892 -3.6892 -3.5664 -3.5664 1.1551 1.1551 1.2277 1.2277 2.2441 2.2441 3.0900 3.0900 3.4770 3.4770 3.6685 3.6685 4.9467 4.9467 5.2006 5.2006 5.6303 5.6303 5.8765 5.8765 8.8383 8.8383 9.5219 9.5219 9.7020 9.7020 10.1323 10.1323 k = 0.0256-0.0391-0.0235 ( 4989 PWs) bands (ev): -20.5464 -20.5464 -20.5246 -20.5246 -8.4373 -8.4373 -7.9655 -7.9655 -7.1838 -7.1838 -6.9243 -6.9243 -5.2184 -5.2184 -5.2040 -5.2040 -5.1606 -5.1606 -4.8351 -4.8351 -3.6887 -3.6887 -3.5679 -3.5679 1.1586 1.1586 1.2310 1.2310 2.2495 2.2495 3.0911 3.0911 3.4716 3.4716 3.6642 3.6642 4.9486 4.9486 5.2026 5.2026 5.6305 5.6305 5.8737 5.8737 8.8435 8.8435 9.5059 9.5059 9.7326 9.7326 10.1070 10.1070 k = 0.0385-0.0586-0.0352 ( 4990 PWs) bands (ev): -20.5463 -20.5463 -20.5245 -20.5245 -8.4346 -8.4346 -7.9689 -7.9689 -7.1816 -7.1816 -6.9257 -6.9257 -5.2219 -5.2219 -5.2029 -5.2029 -5.1601 -5.1601 -4.8397 -4.8397 -3.6879 -3.6879 -3.5704 -3.5704 1.1637 1.1637 1.2373 1.2373 2.2584 2.2584 3.0928 3.0928 3.4627 3.4627 3.6572 3.6572 4.9516 4.9516 5.2060 5.2060 5.6308 5.6308 5.8691 5.8691 8.8520 8.8520 9.4884 9.4884 9.7738 9.7738 10.0760 10.0760 k = 0.0513-0.0781-0.0469 ( 4988 PWs) bands (ev): -20.5460 -20.5460 -20.5245 -20.5245 -8.4308 -8.4308 -7.9735 -7.9735 -7.1787 -7.1787 -6.9276 -6.9276 -5.2265 -5.2265 -5.2017 -5.2017 -5.1594 -5.1594 -4.8460 -4.8460 -3.6872 -3.6872 -3.5734 -3.5734 1.1692 1.1692 1.2476 1.2476 2.2708 2.2708 3.0952 3.0952 3.4503 3.4503 3.6475 3.6475 4.9557 4.9557 5.2106 5.2106 5.6313 5.6313 5.8628 5.8628 8.8639 8.8639 9.4735 9.4735 9.8193 9.8193 10.0452 10.0452 k = 0.0641-0.0976-0.0587 ( 4992 PWs) bands (ev): -20.5458 -20.5458 -20.5244 -20.5244 -8.4259 -8.4259 -7.9792 -7.9792 -7.1751 -7.1751 -6.9300 -6.9300 -5.2321 -5.2321 -5.2007 -5.2007 -5.1583 -5.1583 -4.8539 -4.8539 -3.6868 -3.6868 -3.5768 -3.5768 1.1741 1.1741 1.2629 1.2629 2.2866 2.2866 3.0982 3.0982 3.4347 3.4347 3.6354 3.6354 4.9606 4.9606 5.2163 5.2163 5.6320 5.6320 5.8550 5.8550 8.8791 8.8791 9.4631 9.4631 9.8613 9.8613 10.0221 10.0221 k = 0.0769-0.1172-0.0704 ( 4993 PWs) bands (ev): -20.5455 -20.5455 -20.5243 -20.5243 -8.4199 -8.4199 -7.9861 -7.9861 -7.1710 -7.1710 -6.9327 -6.9327 -5.2387 -5.2387 -5.1998 -5.1998 -5.1568 -5.1568 -4.8634 -4.8634 -3.6871 -3.6871 -3.5800 -3.5800 1.1777 1.1777 1.2838 1.2838 2.3056 2.3056 3.1019 3.1019 3.4161 3.4161 3.6210 3.6210 4.9662 4.9662 5.2231 5.2231 5.6329 5.6329 5.8458 5.8458 8.8975 8.8975 9.4581 9.4581 9.8832 9.8832 10.0228 10.0228 k = 0.0897-0.1367-0.0821 ( 5000 PWs) bands (ev): -20.5451 -20.5451 -20.5242 -20.5242 -8.4130 -8.4130 -7.9939 -7.9939 -7.1665 -7.1665 -6.9358 -6.9358 -5.2464 -5.2464 -5.1994 -5.1994 -5.1548 -5.1548 -4.8742 -4.8742 -3.6888 -3.6888 -3.5825 -3.5825 1.1801 1.1801 1.3101 1.3101 2.3278 2.3278 3.1062 3.1062 3.3946 3.3946 3.6047 3.6047 4.9722 4.9722 5.2309 5.2309 5.6341 5.6341 5.8354 5.8354 8.9190 8.9190 9.4589 9.4589 9.8736 9.8736 10.0576 10.0576 k = 0.1026-0.1562-0.0938 ( 4997 PWs) bands (ev): -20.5447 -20.5447 -20.5241 -20.5241 -8.4051 -8.4051 -8.0025 -8.0025 -7.1618 -7.1618 -6.9392 -6.9392 -5.2550 -5.2550 -5.1995 -5.1995 -5.1523 -5.1523 -4.8860 -4.8860 -3.6922 -3.6922 -3.5837 -3.5837 1.1816 1.1816 1.3413 1.3413 2.3528 2.3528 3.1110 3.1110 3.3707 3.3707 3.5866 3.5866 4.9782 4.9782 5.2397 5.2397 5.6356 5.6356 5.8241 5.8241 8.9433 8.9433 9.4653 9.4653 9.8472 9.8472 10.1100 10.1100 k = 0.1154-0.1758-0.1056 ( 5002 PWs) bands (ev): -20.5442 -20.5442 -20.5239 -20.5239 -8.3963 -8.3963 -8.0118 -8.0118 -7.1571 -7.1571 -6.9426 -6.9426 -5.2645 -5.2645 -5.2002 -5.2002 -5.1492 -5.1492 -4.8988 -4.8988 -3.6979 -3.6979 -3.5832 -3.5832 1.1824 1.1824 1.3771 1.3771 2.3807 2.3807 3.1162 3.1162 3.3447 3.3447 3.5670 3.5670 4.9838 4.9838 5.2492 5.2492 5.6376 5.6376 5.8122 5.8122 8.9704 8.9704 9.4769 9.4769 9.8153 9.8153 10.1610 10.1610 k = 0.1282-0.1953-0.1173 ( 5005 PWs) bands (ev): -20.5437 -20.5437 -20.5238 -20.5238 -8.3866 -8.3866 -8.0216 -8.0216 -7.1526 -7.1526 -6.9460 -6.9460 -5.2750 -5.2750 -5.2016 -5.2016 -5.1456 -5.1456 -4.9122 -4.9122 -3.7060 -3.7060 -3.5809 -3.5809 1.1828 1.1828 1.4170 1.4170 2.4110 2.4110 3.1217 3.1217 3.3171 3.3171 3.5461 3.5461 4.9888 4.9888 5.2596 5.2596 5.6402 5.6402 5.7998 5.7998 9.0000 9.0000 9.4925 9.4925 9.7822 9.7822 10.1792 10.1792 k = 0.1410-0.2148-0.1290 ( 5006 PWs) bands (ev): -20.5432 -20.5432 -20.5236 -20.5236 -8.3761 -8.3761 -8.0319 -8.0319 -7.1486 -7.1486 -6.9493 -6.9493 -5.2864 -5.2864 -5.2039 -5.2039 -5.1416 -5.1416 -4.9258 -4.9258 -3.7162 -3.7162 -3.5769 -3.5769 1.1829 1.1829 1.4607 1.4607 2.4436 2.4436 3.1271 3.1271 3.2884 3.2884 3.5241 3.5241 4.9927 4.9927 5.2708 5.2708 5.6434 5.6434 5.7872 5.7872 9.0318 9.0318 9.5093 9.5093 9.7510 9.7510 10.1583 10.1583 k = 0.1538-0.2343-0.1408 ( 5013 PWs) bands (ev): -20.5426 -20.5426 -20.5234 -20.5234 -8.3649 -8.3649 -8.0423 -8.0423 -7.1452 -7.1452 -6.9521 -6.9521 -5.2987 -5.2987 -5.2071 -5.2071 -5.1373 -5.1373 -4.9393 -4.9393 -3.7283 -3.7283 -3.5715 -3.5715 1.1827 1.1827 1.5078 1.5078 2.4781 2.4781 3.1317 3.1317 3.2598 3.2598 3.5015 3.5015 4.9952 4.9952 5.2829 5.2829 5.6476 5.6476 5.7748 5.7748 9.0655 9.0655 9.5215 9.5215 9.7267 9.7267 10.1250 10.1250 k = 0.1667-0.2539-0.1525 ( 5014 PWs) bands (ev): -20.5419 -20.5419 -20.5233 -20.5233 -8.3532 -8.3532 -8.0528 -8.0528 -7.1429 -7.1429 -6.9543 -6.9543 -5.3118 -5.3118 -5.2112 -5.2112 -5.1330 -5.1330 -4.9522 -4.9522 -3.7421 -3.7421 -3.5648 -3.5648 1.1825 1.1825 1.5581 1.5581 2.5144 2.5144 3.1340 3.1340 3.2331 3.2331 3.4782 3.4782 4.9959 4.9959 5.2956 5.2956 5.6526 5.6526 5.7626 5.7626 9.1003 9.1003 9.5186 9.5186 9.7184 9.7184 10.0892 10.0892 k = 0.1795-0.2734-0.1642 ( 5014 PWs) bands (ev): -20.5413 -20.5413 -20.5231 -20.5231 -8.3410 -8.3410 -8.0631 -8.0631 -7.1417 -7.1417 -6.9558 -6.9558 -5.3258 -5.3258 -5.2164 -5.2164 -5.1288 -5.1288 -4.9642 -4.9642 -3.7570 -3.7570 -3.5572 -3.5572 1.1822 1.1822 1.6112 1.6112 2.5519 2.5519 3.1303 3.1303 3.2122 3.2122 3.4548 3.4548 4.9947 4.9947 5.3091 5.3091 5.6586 5.6586 5.7512 5.7512 9.1351 9.1351 9.4933 9.4933 9.7330 9.7330 10.0553 10.0553 k = 0.1923-0.2929-0.1760 ( 5013 PWs) bands (ev): -20.5406 -20.5406 -20.5229 -20.5229 -8.3286 -8.3286 -8.0729 -8.0729 -7.1420 -7.1420 -6.9563 -6.9563 -5.3405 -5.3405 -5.2226 -5.2226 -5.1250 -5.1250 -4.9746 -4.9746 -3.7730 -3.7730 -3.5490 -3.5490 1.1819 1.1819 1.6669 1.6669 2.5903 2.5903 3.1164 3.1164 3.2018 3.2018 3.4313 3.4313 4.9916 4.9916 5.3231 5.3231 5.6655 5.6655 5.7408 5.7408 9.1672 9.1672 9.4509 9.4509 9.7659 9.7659 10.0261 10.0261 k = 0.2051-0.3125-0.1877 ( 5014 PWs) bands (ev): -20.5399 -20.5399 -20.5227 -20.5227 -8.3162 -8.3162 -8.0820 -8.0820 -7.1439 -7.1439 -6.9558 -6.9558 -5.3561 -5.3561 -5.2299 -5.2299 -5.1220 -5.1220 -4.9831 -4.9831 -3.7897 -3.7897 -3.5403 -3.5403 1.1816 1.1816 1.7248 1.7248 2.6291 2.6291 3.0932 3.0932 3.2014 3.2014 3.4083 3.4083 4.9866 4.9866 5.3373 5.3373 5.6728 5.6728 5.7322 5.7322 9.1890 9.1890 9.4047 9.4047 9.8093 9.8093 10.0042 10.0042 k = 0.2179-0.3320-0.1994 ( 5020 PWs) bands (ev): -20.5391 -20.5391 -20.5225 -20.5225 -8.3041 -8.3041 -8.0900 -8.0900 -7.1473 -7.1473 -6.9542 -6.9542 -5.3725 -5.3725 -5.2384 -5.2384 -5.1198 -5.1198 -4.9892 -4.9892 -3.8069 -3.8069 -3.5314 -3.5314 1.1812 1.1812 1.7848 1.7848 2.6674 2.6674 3.0657 3.0657 3.2061 3.2061 3.3860 3.3860 4.9798 4.9798 5.3515 5.3515 5.6797 5.6797 5.7265 5.7265 9.1822 9.1822 9.3771 9.3771 9.8564 9.8564 9.9928 9.9928 k = 0.2308-0.3515-0.2111 ( 5019 PWs) bands (ev): -20.5384 -20.5384 -20.5223 -20.5223 -8.2928 -8.2928 -8.0965 -8.0965 -7.1524 -7.1524 -6.9516 -6.9516 -5.3897 -5.3897 -5.2478 -5.2478 -5.1187 -5.1187 -4.9927 -4.9927 -3.8244 -3.8244 -3.5222 -3.5222 1.1809 1.1809 1.8464 1.8464 2.7044 2.7044 3.0376 3.0376 3.2127 3.2127 3.3653 3.3653 4.9715 4.9715 5.3651 5.3651 5.6844 5.6844 5.7256 5.7256 9.1328 9.1328 9.3845 9.3845 9.8975 9.8975 9.9993 9.9993 k = 0.2436-0.3710-0.2229 ( 5021 PWs) bands (ev): -20.5376 -20.5376 -20.5221 -20.5221 -8.2828 -8.2828 -8.1009 -8.1009 -7.1591 -7.1591 -6.9480 -6.9480 -5.4075 -5.4075 -5.2582 -5.2582 -5.1186 -5.1186 -4.9937 -4.9937 -3.8421 -3.8421 -3.5131 -3.5131 1.1805 1.1805 1.9093 1.9093 2.7385 2.7385 3.0116 3.0116 3.2190 3.2190 3.3471 3.3471 4.9621 4.9621 5.3777 5.3777 5.6860 5.6860 5.7310 5.7310 9.0553 9.0553 9.4140 9.4140 9.9208 9.9208 10.0337 10.0337 k = 0.2564-0.3906-0.2346 ( 5024 PWs) bands (ev): -20.5369 -20.5369 -20.5219 -20.5219 -8.2746 -8.2746 -8.1027 -8.1027 -7.1671 -7.1671 -6.9436 -6.9436 -5.4261 -5.4261 -5.2692 -5.2692 -5.1194 -5.1194 -4.9923 -4.9923 -3.8599 -3.8599 -3.5039 -3.5039 1.1801 1.1801 1.9734 1.9734 2.7670 2.7670 2.9905 2.9905 3.2230 3.2230 3.3334 3.3334 4.9518 4.9518 5.3887 5.3887 5.6860 5.6860 5.7412 5.7412 8.9645 8.9645 9.4520 9.4520 9.9322 9.9322 10.0889 10.0889 k = 0.2692-0.4101-0.2463 ( 5027 PWs) bands (ev): -20.5361 -20.5361 -20.5217 -20.5217 -8.2688 -8.2688 -8.1013 -8.1013 -7.1764 -7.1764 -6.9386 -6.9386 -5.4451 -5.4451 -5.2807 -5.2807 -5.1208 -5.1208 -4.9889 -4.9889 -3.8776 -3.8776 -3.4949 -3.4949 1.1797 1.1797 2.0381 2.0381 2.7862 2.7862 2.9782 2.9782 3.2222 3.2222 3.3263 3.3263 4.9411 4.9411 5.3978 5.3978 5.6865 5.6865 5.7543 5.7543 8.8668 8.8668 9.4925 9.4925 9.9423 9.9423 10.1526 10.1526 k = 0.2821-0.4296-0.2581 ( 5024 PWs) bands (ev): -20.5353 -20.5353 -20.5215 -20.5215 -8.2657 -8.2657 -8.0965 -8.0965 -7.1867 -7.1867 -6.9331 -6.9331 -5.4647 -5.4647 -5.2924 -5.2924 -5.1225 -5.1225 -4.9841 -4.9841 -3.8951 -3.8951 -3.4862 -3.4862 1.1793 1.1793 2.1033 2.1033 2.7922 2.7922 2.9784 2.9784 3.2154 3.2154 3.3272 3.3272 4.9304 4.9304 5.4045 5.4045 5.6888 5.6888 5.7693 5.7693 8.7654 8.7654 9.5331 9.5331 9.9551 9.9551 10.2197 10.2197 k = 0.2949-0.4492-0.2698 ( 5025 PWs) bands (ev): -20.5345 -20.5345 -20.5214 -20.5214 -8.2651 -8.2651 -8.0884 -8.0884 -7.1979 -7.1979 -6.9272 -6.9272 -5.4846 -5.4846 -5.3042 -5.3042 -5.1244 -5.1244 -4.9781 -4.9781 -3.9123 -3.9123 -3.4777 -3.4777 1.1788 1.1788 2.1684 2.1684 2.7853 2.7853 2.9907 2.9907 3.2036 3.2036 3.3350 3.3350 4.9199 4.9199 5.4086 5.4086 5.6933 5.6933 5.7853 5.7853 8.6622 8.6622 9.5719 9.5719 9.9717 9.9717 10.2876 10.2876 k = 0.3077-0.4687-0.2815 ( 5027 PWs) bands (ev): -20.5338 -20.5338 -20.5212 -20.5212 -8.2667 -8.2667 -8.0775 -8.0775 -7.2099 -7.2099 -6.9212 -6.9212 -5.5046 -5.5046 -5.3157 -5.3157 -5.1264 -5.1264 -4.9713 -4.9713 -3.9290 -3.9290 -3.4695 -3.4695 1.1783 1.1783 2.2331 2.2331 2.7699 2.7699 3.0105 3.0105 3.1891 3.1891 3.3474 3.3474 4.9099 4.9099 5.4104 5.4104 5.7002 5.7002 5.8020 5.8020 8.5585 8.5585 9.6077 9.6077 9.9921 9.9921 10.3549 10.3549 k = 0.3205-0.4882-0.2933 ( 5030 PWs) bands (ev): -20.5330 -20.5330 -20.5211 -20.5211 -8.2700 -8.2700 -8.0643 -8.0643 -7.2225 -7.2225 -6.9151 -6.9151 -5.5246 -5.5246 -5.3269 -5.3269 -5.1282 -5.1282 -4.9641 -4.9641 -3.9452 -3.9452 -3.4616 -3.4616 1.1778 1.1778 2.2969 2.2969 2.7505 2.7505 3.0332 3.0332 3.1737 3.1737 3.3626 3.3626 4.9007 4.9007 5.4101 5.4101 5.7091 5.7091 5.8191 5.8191 8.4556 8.4556 9.6397 9.6397 10.0158 10.0158 10.4201 10.4201 k = 0.3333-0.5077-0.3050 ( 5028 PWs) bands (ev): -20.5323 -20.5323 -20.5209 -20.5209 -8.2744 -8.2744 -8.0495 -8.0495 -7.2355 -7.2355 -6.9090 -6.9090 -5.5443 -5.5443 -5.3376 -5.3376 -5.1300 -5.1300 -4.9565 -4.9565 -3.9608 -3.9608 -3.4542 -3.4542 1.1773 1.1773 2.3591 2.3591 2.7300 2.7300 3.0558 3.0558 3.1587 3.1587 3.3795 3.3795 4.8925 4.8925 5.4081 5.4081 5.7197 5.7197 5.8364 5.8364 8.3542 8.3542 9.6673 9.6673 10.0421 10.0421 10.4817 10.4817 k = 0.3462-0.5273-0.3167 ( 5029 PWs) bands (ev): -20.5316 -20.5316 -20.5208 -20.5208 -8.2795 -8.2795 -8.0336 -8.0336 -7.2487 -7.2487 -6.9031 -6.9031 -5.5637 -5.5637 -5.3477 -5.3477 -5.1316 -5.1316 -4.9489 -4.9489 -3.9757 -3.9757 -3.4473 -3.4473 1.1767 1.1767 2.4188 2.4188 2.7107 2.7107 3.0757 3.0757 3.1455 3.1455 3.3971 3.3971 4.8855 4.8855 5.4050 5.4050 5.7315 5.7315 5.8535 5.8535 8.2554 8.2554 9.6903 9.6903 10.0696 10.0696 10.5382 10.5382 k = 0.3590-0.5468-0.3285 ( 5032 PWs) bands (ev): -20.5310 -20.5310 -20.5207 -20.5207 -8.2849 -8.2849 -8.0171 -8.0171 -7.2621 -7.2621 -6.8973 -6.8973 -5.5823 -5.5823 -5.3572 -5.3572 -5.1330 -5.1330 -4.9413 -4.9413 -3.9897 -3.9897 -3.4408 -3.4408 1.1761 1.1761 2.4743 2.4743 2.6944 2.6944 3.0894 3.0894 3.1375 3.1375 3.4147 3.4147 4.8797 4.8797 5.4013 5.4013 5.7439 5.7439 5.8702 5.8702 8.1600 8.1600 9.7088 9.7088 10.0971 10.0971 10.5876 10.5876 k = 0.3718-0.5663-0.3402 ( 5033 PWs) bands (ev): -20.5303 -20.5303 -20.5206 -20.5206 -8.2903 -8.2903 -8.0004 -8.0004 -7.2754 -7.2754 -6.8918 -6.8918 -5.6002 -5.6002 -5.3659 -5.3659 -5.1343 -5.1343 -4.9340 -4.9340 -4.0029 -4.0029 -3.4348 -3.4348 1.1755 1.1755 2.5222 2.5222 2.6849 2.6849 3.0913 3.0913 3.1400 3.1400 3.4317 3.4317 4.8751 4.8751 5.3975 5.3975 5.7565 5.7565 5.8863 5.8863 8.0688 8.0688 9.7233 9.7233 10.1232 10.1232 10.6279 10.6279 k = 0.3846-0.5859-0.3519 ( 5032 PWs) bands (ev): -20.5297 -20.5297 -20.5206 -20.5206 -8.2956 -8.2956 -7.9838 -7.9838 -7.2885 -7.2885 -6.8867 -6.8867 -5.6170 -5.6170 -5.3739 -5.3739 -5.1355 -5.1355 -4.9269 -4.9269 -4.0152 -4.0152 -3.4293 -3.4293 1.1749 1.1749 2.5557 2.5557 2.6888 2.6888 3.0838 3.0838 3.1505 3.1505 3.4475 3.4475 4.8718 4.8718 5.3939 5.3939 5.7690 5.7690 5.9017 5.9017 7.9826 7.9826 9.7340 9.7340 10.1470 10.1470 10.6569 10.6569 k = 0.3974-0.6054-0.3636 ( 5031 PWs) bands (ev): -20.5292 -20.5292 -20.5205 -20.5205 -8.3006 -8.3006 -7.9677 -7.9677 -7.3012 -7.3012 -6.8819 -6.8819 -5.6325 -5.6325 -5.3811 -5.3811 -5.1365 -5.1365 -4.9204 -4.9204 -4.0263 -4.0263 -3.4244 -3.4244 1.1743 1.1743 2.5690 2.5690 2.7117 2.7117 3.0734 3.0734 3.1627 3.1627 3.4617 3.4617 4.8696 4.8696 5.3908 5.3908 5.7809 5.7809 5.9160 5.9160 7.9022 7.9022 9.7415 9.7415 10.1679 10.1679 10.6741 10.6741 k = 0.4103-0.6249-0.3754 ( 5036 PWs) bands (ev): -20.5287 -20.5287 -20.5205 -20.5205 -8.3053 -8.3053 -7.9525 -7.9525 -7.3133 -7.3133 -6.8776 -6.8776 -5.6467 -5.6467 -5.3875 -5.3875 -5.1374 -5.1374 -4.9143 -4.9143 -4.0364 -4.0364 -3.4200 -3.4200 1.1737 1.1737 2.5679 2.5679 2.7474 2.7474 3.0625 3.0625 3.1740 3.1740 3.4739 3.4739 4.8683 4.8683 5.3884 5.3884 5.7921 5.7921 5.9291 5.9291 7.8286 7.8286 9.7464 9.7464 10.1857 10.1857 10.6810 10.6810 k = 0.4231-0.6444-0.3871 ( 5034 PWs) bands (ev): -20.5282 -20.5282 -20.5204 -20.5204 -8.3094 -8.3094 -7.9383 -7.9383 -7.3245 -7.3245 -6.8738 -6.8738 -5.6593 -5.6593 -5.3930 -5.3930 -5.1381 -5.1381 -4.9089 -4.9089 -4.0453 -4.0453 -3.4162 -3.4162 1.1732 1.1732 2.5610 2.5610 2.7870 2.7870 3.0519 3.0519 3.1839 3.1839 3.4839 3.4839 4.8678 4.8678 5.3867 5.3867 5.8022 5.8022 5.9408 5.9408 7.7624 7.7624 9.7491 9.7491 10.2005 10.2005 10.6805 10.6805 k = 0.4359-0.6640-0.3988 ( 5039 PWs) bands (ev): -20.5278 -20.5278 -20.5204 -20.5204 -8.3130 -8.3130 -7.9257 -7.9257 -7.3346 -7.3346 -6.8705 -6.8705 -5.6702 -5.6702 -5.3978 -5.3978 -5.1387 -5.1387 -4.9042 -4.9042 -4.0529 -4.0529 -3.4130 -3.4130 1.1727 1.1727 2.5529 2.5529 2.8255 2.8255 3.0417 3.0417 3.1921 3.1921 3.4919 3.4919 4.8679 4.8679 5.3857 5.3857 5.8111 5.8111 5.9510 5.9510 7.7047 7.7047 9.7503 9.7503 10.2126 10.2126 10.6757 10.6757 k = 0.4487-0.6835-0.4106 ( 5040 PWs) bands (ev): -20.5275 -20.5275 -20.5204 -20.5204 -8.3160 -8.3160 -7.9147 -7.9147 -7.3433 -7.3433 -6.8677 -6.8677 -5.6794 -5.6794 -5.4016 -5.4016 -5.1392 -5.1392 -4.9002 -4.9002 -4.0593 -4.0593 -3.4103 -3.4103 1.1723 1.1723 2.5452 2.5452 2.8607 2.8607 3.0318 3.0318 3.1986 3.1986 3.4977 3.4977 4.8683 4.8683 5.3853 5.3853 5.8186 5.8186 5.9596 5.9596 7.6561 7.6561 9.7504 9.7504 10.2221 10.2221 10.6693 10.6693 k = 0.4615-0.7030-0.4223 ( 5042 PWs) bands (ev): -20.5272 -20.5272 -20.5204 -20.5204 -8.3184 -8.3184 -7.9059 -7.9059 -7.3504 -7.3504 -6.8655 -6.8655 -5.6865 -5.6865 -5.4047 -5.4047 -5.1396 -5.1396 -4.8971 -4.8971 -4.0642 -4.0642 -3.4082 -3.4082 1.1720 1.1720 2.5388 2.5388 2.8914 2.8914 3.0223 3.0223 3.2035 3.2035 3.5019 3.5019 4.8689 4.8689 5.3852 5.3852 5.8246 5.8246 5.9664 5.9664 7.6174 7.6174 9.7499 9.7499 10.2293 10.2293 10.6628 10.6628 k = 0.4744-0.7226-0.4340 ( 5040 PWs) bands (ev): -20.5270 -20.5270 -20.5204 -20.5204 -8.3201 -8.3201 -7.8993 -7.8993 -7.3557 -7.3557 -6.8639 -6.8639 -5.6917 -5.6917 -5.4068 -5.4068 -5.1399 -5.1399 -4.8948 -4.8948 -4.0678 -4.0678 -3.4068 -3.4068 1.1717 1.1717 2.5340 2.5340 2.9164 2.9164 3.0131 3.0131 3.2069 3.2069 3.5045 3.5045 4.8694 4.8694 5.3854 5.3854 5.8290 5.8290 5.9713 5.9713 7.5893 7.5893 9.7493 9.7493 10.2344 10.2344 10.6574 10.6574 k = 0.4872-0.7421-0.4458 ( 5040 PWs) bands (ev): -20.5269 -20.5269 -20.5204 -20.5204 -8.3211 -8.3211 -7.8953 -7.8953 -7.3589 -7.3589 -6.8630 -6.8630 -5.6949 -5.6949 -5.4081 -5.4081 -5.1400 -5.1400 -4.8934 -4.8934 -4.0700 -4.0700 -3.4059 -3.4059 1.1716 1.1716 2.5311 2.5311 2.9341 2.9341 3.0053 3.0053 3.2088 3.2088 3.5059 3.5059 4.8698 4.8698 5.3856 5.3856 5.8316 5.8316 5.9742 5.9742 7.5722 7.5722 9.7488 9.7488 10.2375 10.2375 10.6539 10.6539 k = 0.5000-0.7616-0.4575 ( 5042 PWs) bands (ev): -20.5268 -20.5268 -20.5204 -20.5204 -8.3214 -8.3214 -7.8940 -7.8940 -7.3600 -7.3600 -6.8627 -6.8627 -5.6959 -5.6959 -5.4086 -5.4086 -5.1401 -5.1401 -4.8930 -4.8930 -4.0707 -4.0707 -3.4056 -3.4056 1.1715 1.1715 2.5301 2.5301 2.9409 2.9409 3.0018 3.0018 3.2095 3.2095 3.5064 3.5064 4.8700 4.8700 5.3856 5.3856 5.8325 5.8325 5.9752 5.9752 7.5665 7.5665 9.7486 9.7486 10.2385 10.2385 10.6527 10.6527 k = 0.5000-0.7616 0.4327 ( 5026 PWs) bands (ev): -20.5275 -20.5275 -20.5198 -20.5198 -8.2674 -8.2674 -8.0256 -8.0256 -7.1044 -7.1044 -7.0604 -7.0604 -5.4786 -5.4786 -5.4214 -5.4214 -5.2010 -5.2010 -5.1273 -5.1273 -3.9543 -3.9543 -3.4075 -3.4075 1.1754 1.1754 2.6546 2.6546 2.9319 2.9319 3.0614 3.0614 3.1940 3.1940 3.2861 3.2861 4.8528 4.8528 5.5187 5.5187 5.8080 5.8080 5.9182 5.9182 7.6260 7.6260 9.4430 9.4430 10.2455 10.2455 10.5803 10.5803 k = 0.4872-0.7421 0.4216 ( 5028 PWs) bands (ev): -20.5275 -20.5275 -20.5198 -20.5198 -8.2674 -8.2674 -8.0259 -8.0259 -7.1058 -7.1058 -7.0589 -7.0589 -5.4813 -5.4813 -5.4180 -5.4180 -5.2009 -5.2009 -5.1262 -5.1262 -3.9544 -3.9544 -3.4078 -3.4078 1.1754 1.1754 2.6535 2.6535 2.9286 2.9286 3.0622 3.0622 3.1948 3.1948 3.2863 3.2863 4.8532 4.8532 5.5164 5.5164 5.8076 5.8076 5.9181 5.9181 7.6313 7.6313 9.4436 9.4436 10.2417 10.2417 10.5803 10.5803 k = 0.4744-0.7226 0.4105 ( 5025 PWs) bands (ev): -20.5276 -20.5276 -20.5198 -20.5198 -8.2672 -8.2672 -8.0269 -8.0269 -7.1094 -7.1094 -7.0551 -7.0551 -5.4879 -5.4879 -5.4092 -5.4092 -5.2007 -5.2007 -5.1232 -5.1232 -3.9547 -3.9547 -3.4087 -3.4087 1.1754 1.1754 2.6500 2.6500 2.9191 2.9191 3.0643 3.0643 3.1969 3.1969 3.2870 3.2870 4.8542 4.8542 5.5097 5.5097 5.8064 5.8064 5.9177 5.9177 7.6473 7.6473 9.4455 9.4455 10.2307 10.2307 10.5799 10.5799 k = 0.4615-0.7030 0.3994 ( 5024 PWs) bands (ev): -20.5278 -20.5278 -20.5198 -20.5198 -8.2668 -8.2668 -8.0285 -8.0285 -7.1143 -7.1143 -7.0499 -7.0499 -5.4959 -5.4959 -5.3976 -5.3976 -5.2003 -5.2003 -5.1182 -5.1182 -3.9551 -3.9551 -3.4102 -3.4102 1.1755 1.1755 2.6441 2.6441 2.9044 2.9044 3.0675 3.0675 3.1990 3.1990 3.2889 3.2889 4.8560 4.8560 5.4991 5.4991 5.8043 5.8043 5.9170 5.9170 7.6735 7.6735 9.4485 9.4485 10.2134 10.2134 10.5781 10.5781 k = 0.4487-0.6835 0.3883 ( 5028 PWs) bands (ev): -20.5281 -20.5281 -20.5198 -20.5198 -8.2663 -8.2663 -8.0308 -8.0308 -7.1196 -7.1196 -7.0440 -7.0440 -5.5038 -5.5038 -5.3847 -5.3847 -5.1996 -5.1996 -5.1114 -5.1114 -3.9556 -3.9556 -3.4124 -3.4124 1.1756 1.1756 2.6352 2.6352 2.8863 2.8863 3.0711 3.0711 3.1998 3.1998 3.2927 3.2927 4.8585 4.8585 5.4851 5.4851 5.8011 5.8011 5.9158 5.9158 7.7098 7.7098 9.4529 9.4529 10.1907 10.1907 10.5735 10.5735 k = 0.4359-0.6640 0.3772 ( 5027 PWs) bands (ev): -20.5284 -20.5284 -20.5199 -20.5199 -8.2656 -8.2656 -8.0339 -8.0339 -7.1248 -7.1248 -7.0380 -7.0380 -5.5107 -5.5107 -5.3714 -5.3714 -5.1987 -5.1987 -5.1030 -5.1030 -3.9561 -3.9561 -3.4151 -3.4151 1.1757 1.1757 2.6229 2.6229 2.8663 2.8663 3.0744 3.0744 3.1986 3.1986 3.2989 3.2989 4.8620 4.8620 5.4686 5.4686 5.7967 5.7967 5.9138 5.9138 7.7556 7.7556 9.4584 9.4584 10.1639 10.1639 10.5644 10.5644 k = 0.4231-0.6444 0.3661 ( 5025 PWs) bands (ev): -20.5287 -20.5287 -20.5199 -20.5199 -8.2647 -8.2647 -8.0377 -8.0377 -7.1297 -7.1297 -7.0320 -7.0320 -5.5164 -5.5164 -5.3581 -5.3581 -5.1974 -5.1974 -5.0931 -5.0931 -3.9563 -3.9563 -3.4185 -3.4185 1.1759 1.1759 2.6063 2.6063 2.8463 2.8463 3.0764 3.0764 3.1957 3.1957 3.3074 3.3074 4.8664 4.8664 5.4503 5.4503 5.7911 5.7911 5.9109 5.9109 7.8104 7.8104 9.4650 9.4650 10.1341 10.1341 10.5493 10.5493 k = 0.4103-0.6249 0.3550 ( 5023 PWs) bands (ev): -20.5292 -20.5292 -20.5200 -20.5200 -8.2636 -8.2636 -8.0423 -8.0423 -7.1339 -7.1339 -7.0264 -7.0264 -5.5206 -5.5206 -5.3451 -5.3451 -5.1957 -5.1957 -5.0821 -5.0821 -3.9562 -3.9562 -3.4224 -3.4224 1.1761 1.1761 2.5844 2.5844 2.8282 2.8282 3.0756 3.0756 3.1925 3.1925 3.3174 3.3174 4.8719 4.8719 5.4310 5.4310 5.7843 5.7843 5.9070 5.9070 7.8735 7.8735 9.4728 9.4728 10.1022 10.1022 10.5266 10.5266 k = 0.3974-0.6054 0.3439 ( 5023 PWs) bands (ev): -20.5297 -20.5297 -20.5200 -20.5200 -8.2623 -8.2623 -8.0477 -8.0477 -7.1373 -7.1373 -7.0211 -7.0211 -5.5230 -5.5230 -5.3327 -5.3327 -5.1937 -5.1937 -5.0703 -5.0703 -3.9555 -3.9555 -3.4269 -3.4269 1.1764 1.1764 2.5566 2.5566 2.8134 2.8134 3.0706 3.0706 3.1906 3.1906 3.3283 3.3283 4.8785 4.8785 5.4112 5.4112 5.7762 5.7762 5.9021 5.9021 7.9442 7.9442 9.4816 9.4816 10.0689 10.0689 10.4956 10.4956 k = 0.3846-0.5859 0.3328 ( 5022 PWs) bands (ev): -20.5302 -20.5302 -20.5201 -20.5201 -8.2609 -8.2609 -8.0538 -8.0538 -7.1398 -7.1398 -7.0163 -7.0163 -5.5237 -5.5237 -5.3208 -5.3208 -5.1912 -5.1912 -5.0580 -5.0580 -3.9542 -3.9542 -3.4319 -3.4319 1.1767 1.1767 2.5225 2.5225 2.8028 2.8028 3.0602 3.0602 3.1912 3.1912 3.3394 3.3394 4.8862 4.8862 5.3917 5.3917 5.7671 5.7671 5.8961 5.8961 8.0218 8.0218 9.4913 9.4913 10.0350 10.0350 10.4557 10.4557 k = 0.3718-0.5663 0.3217 ( 5022 PWs) bands (ev): -20.5307 -20.5307 -20.5202 -20.5202 -8.2593 -8.2593 -8.0607 -8.0607 -7.1413 -7.1413 -7.0121 -7.0121 -5.5225 -5.5225 -5.3096 -5.3096 -5.1882 -5.1882 -5.0456 -5.0456 -3.9518 -3.9518 -3.4374 -3.4374 1.1770 1.1770 2.4824 2.4824 2.7968 2.7968 3.0446 3.0446 3.1945 3.1945 3.3504 3.3504 4.8950 4.8950 5.3729 5.3729 5.7569 5.7569 5.8893 5.8893 8.1056 8.1056 9.5016 9.5016 10.0010 10.0010 10.4072 10.4072 k = 0.3590-0.5468 0.3106 ( 5020 PWs) bands (ev): -20.5314 -20.5314 -20.5203 -20.5203 -8.2576 -8.2576 -8.0681 -8.0681 -7.1419 -7.1419 -7.0083 -7.0083 -5.5195 -5.5195 -5.2990 -5.2990 -5.1848 -5.1848 -5.0334 -5.0334 -3.9484 -3.9484 -3.4435 -3.4435 1.1774 1.1774 2.4370 2.4370 2.7952 2.7952 3.0242 3.0242 3.2000 3.2000 3.3610 3.3610 4.9047 4.9047 5.3552 5.3552 5.7460 5.7460 5.8816 5.8816 8.1948 8.1948 9.5126 9.5126 9.9672 9.9672 10.3513 10.3513 k = 0.3462-0.5273 0.2995 ( 5023 PWs) bands (ev): -20.5320 -20.5320 -20.5204 -20.5204 -8.2560 -8.2560 -8.0760 -8.0760 -7.1415 -7.1415 -7.0051 -7.0051 -5.5147 -5.5147 -5.2890 -5.2890 -5.1810 -5.1810 -5.0219 -5.0219 -3.9437 -3.9437 -3.4500 -3.4500 1.1778 1.1778 2.3871 2.3871 2.7976 2.7976 3.0001 3.0001 3.2066 3.2066 3.3711 3.3711 4.9153 4.9153 5.3388 5.3388 5.7344 5.7344 5.8734 5.8734 8.2886 8.2886 9.5240 9.5240 9.9338 9.9338 10.2891 10.2891 k = 0.3333-0.5077 0.2884 ( 5020 PWs) bands (ev): -20.5327 -20.5327 -20.5206 -20.5206 -8.2546 -8.2546 -8.0839 -8.0839 -7.1402 -7.1402 -7.0024 -7.0024 -5.5081 -5.5081 -5.2797 -5.2797 -5.1767 -5.1767 -5.0113 -5.0113 -3.9375 -3.9375 -3.4570 -3.4570 1.1783 1.1783 2.3335 2.3335 2.8036 2.8036 2.9730 2.9730 3.2138 3.2138 3.3807 3.3807 4.9266 4.9266 5.3240 5.3240 5.7226 5.7226 5.8647 5.8647 8.3862 8.3862 9.5356 9.5356 9.9011 9.9011 10.2226 10.2226 k = 0.3205-0.4882 0.2774 ( 5020 PWs) bands (ev): -20.5334 -20.5334 -20.5207 -20.5207 -8.2538 -8.2538 -8.0916 -8.0916 -7.1382 -7.1382 -7.0002 -7.0002 -5.4999 -5.4999 -5.2709 -5.2709 -5.1720 -5.1720 -5.0018 -5.0018 -3.9298 -3.9298 -3.4643 -3.4643 1.1788 1.1788 2.2771 2.2771 2.8127 2.8127 2.9438 2.9438 3.2207 3.2207 3.3898 3.3898 4.9384 4.9384 5.3108 5.3108 5.7108 5.7108 5.8558 5.8558 8.4867 8.4867 9.5473 9.5473 9.8687 9.8687 10.1535 10.1535 k = 0.3077-0.4687 0.2663 ( 5016 PWs) bands (ev): -20.5341 -20.5341 -20.5209 -20.5209 -8.2537 -8.2537 -8.0987 -8.0987 -7.1356 -7.1356 -6.9984 -6.9984 -5.4900 -5.4900 -5.2626 -5.2626 -5.1669 -5.1669 -4.9937 -4.9937 -3.9204 -3.9204 -3.4721 -3.4721 1.1793 1.1793 2.2184 2.2184 2.8238 2.8238 2.9137 2.9137 3.2268 3.2268 3.3987 3.3987 4.9504 4.9504 5.2992 5.2992 5.6993 5.6993 5.8468 5.8468 8.5893 8.5893 9.5591 9.5591 9.8361 9.8361 10.0842 10.0842 k = 0.2949-0.4492 0.2552 ( 5020 PWs) bands (ev): -20.5348 -20.5348 -20.5211 -20.5211 -8.2548 -8.2548 -8.1046 -8.1046 -7.1325 -7.1325 -6.9968 -6.9968 -5.4788 -5.4788 -5.2549 -5.2549 -5.1614 -5.1614 -4.9869 -4.9869 -3.9095 -3.9095 -3.4801 -3.4801 1.1797 1.1797 2.1580 2.1580 2.8330 2.8330 2.8870 2.8870 3.2317 3.2317 3.4076 3.4076 4.9625 4.9625 5.2891 5.2891 5.6884 5.6884 5.8379 5.8379 8.6930 8.6930 9.5706 9.5706 9.8024 9.8024 10.0173 10.0173 k = 0.2821-0.4296 0.2441 ( 5025 PWs) bands (ev): -20.5356 -20.5356 -20.5213 -20.5213 -8.2576 -8.2576 -8.1088 -8.1088 -7.1292 -7.1292 -6.9955 -6.9955 -5.4662 -5.4662 -5.2476 -5.2476 -5.1557 -5.1557 -4.9815 -4.9815 -3.8971 -3.8971 -3.4884 -3.4884 1.1802 1.1802 2.0964 2.0964 2.8239 2.8239 2.8799 2.8799 3.2350 3.2350 3.4169 3.4169 4.9744 4.9744 5.2803 5.2803 5.6786 5.6786 5.8292 5.8292 8.7965 8.7965 9.5817 9.5817 9.7658 9.7658 9.9566 9.9566 k = 0.2692-0.4101 0.2330 ( 5016 PWs) bands (ev): -20.5363 -20.5363 -20.5215 -20.5215 -8.2621 -8.2621 -8.1110 -8.1110 -7.1259 -7.1259 -6.9942 -6.9942 -5.4524 -5.4524 -5.2409 -5.2409 -5.1499 -5.1499 -4.9773 -4.9773 -3.8832 -3.8832 -3.4969 -3.4969 1.1807 1.1807 2.0342 2.0342 2.7945 2.7945 2.8950 2.8950 3.2365 3.2365 3.4267 3.4267 4.9856 4.9856 5.2726 5.2726 5.6701 5.6701 5.8211 5.8211 8.8985 8.8985 9.5904 9.5904 9.7260 9.7260 9.9061 9.9061 k = 0.2564-0.3906 0.2219 ( 5009 PWs) bands (ev): -20.5371 -20.5371 -20.5217 -20.5217 -8.2687 -8.2687 -8.1109 -8.1109 -7.1229 -7.1229 -6.9927 -6.9927 -5.4377 -5.4377 -5.2346 -5.2346 -5.1442 -5.1442 -4.9741 -4.9741 -3.8681 -3.8681 -3.5056 -3.5056 1.1812 1.1812 1.9718 1.9718 2.7592 2.7592 2.9175 2.9175 3.2363 3.2363 3.4371 3.4371 4.9960 4.9960 5.2658 5.2658 5.6632 5.6632 5.8136 5.8136 8.9969 8.9969 9.5899 9.5899 9.6894 9.6894 9.8681 9.8681 k = 0.2436-0.3710 0.2108 ( 5007 PWs) bands (ev): -20.5378 -20.5378 -20.5219 -20.5219 -8.2770 -8.2770 -8.1086 -8.1086 -7.1205 -7.1205 -6.9910 -6.9910 -5.4223 -5.4223 -5.2288 -5.2288 -5.1387 -5.1387 -4.9714 -4.9714 -3.8520 -3.8520 -3.5143 -3.5143 1.1816 1.1816 1.9096 1.9096 2.7222 2.7222 2.9435 2.9435 3.2343 3.2343 3.4483 3.4483 5.0052 5.0052 5.2596 5.2596 5.6580 5.6580 5.8069 5.8069 9.0896 9.0896 9.5632 9.5632 9.6752 9.6752 9.8429 9.8429 k = 0.2308-0.3515 0.1997 ( 5012 PWs) bands (ev): -20.5386 -20.5386 -20.5221 -20.5221 -8.2870 -8.2870 -8.1041 -8.1041 -7.1189 -7.1189 -6.9889 -6.9889 -5.4063 -5.4063 -5.2234 -5.2234 -5.1339 -5.1339 -4.9689 -4.9689 -3.8351 -3.8351 -3.5231 -3.5231 1.1819 1.1819 1.8481 1.8481 2.6844 2.6844 2.9720 2.9720 3.2308 3.2308 3.4602 3.4602 5.0128 5.0128 5.2539 5.2539 5.6545 5.6545 5.8013 5.8013 9.1733 9.1733 9.5126 9.5126 9.6844 9.6844 9.8299 9.8299 k = 0.2179-0.3320 0.1886 ( 5013 PWs) bands (ev): -20.5393 -20.5393 -20.5223 -20.5223 -8.2981 -8.2981 -8.0979 -8.0979 -7.1183 -7.1183 -6.9862 -6.9862 -5.3900 -5.3900 -5.2185 -5.2185 -5.1300 -5.1300 -4.9660 -4.9660 -3.8178 -3.8178 -3.5317 -3.5317 1.1822 1.1822 1.7875 1.7875 2.6464 2.6464 3.0023 3.0023 3.2264 3.2264 3.4728 3.4728 5.0185 5.0185 5.2487 5.2487 5.6526 5.6526 5.7970 5.7970 9.2441 9.2441 9.4552 9.4552 9.7020 9.7020 9.8310 9.8310 k = 0.2051-0.3125 0.1775 ( 5016 PWs) bands (ev): -20.5400 -20.5400 -20.5225 -20.5225 -8.3100 -8.3100 -8.0903 -8.0903 -7.1188 -7.1188 -6.9829 -6.9829 -5.3735 -5.3735 -5.2139 -5.2139 -5.1274 -5.1274 -4.9623 -4.9623 -3.8004 -3.8004 -3.5402 -3.5402 1.1824 1.1824 1.7284 1.7284 2.6086 2.6086 3.0335 3.0335 3.2216 3.2216 3.4859 3.4859 5.0222 5.0222 5.2440 5.2440 5.6520 5.6520 5.7942 5.7942 9.2938 9.2938 9.4037 9.4037 9.7185 9.7185 9.8503 9.8503 k = 0.1923-0.2929 0.1664 ( 5012 PWs) bands (ev): -20.5407 -20.5407 -20.5228 -20.5228 -8.3223 -8.3223 -8.0815 -8.0815 -7.1204 -7.1204 -6.9789 -6.9789 -5.3572 -5.3572 -5.2097 -5.2097 -5.1262 -5.1262 -4.9573 -4.9573 -3.7831 -3.7831 -3.5483 -3.5483 1.1826 1.1826 1.6710 1.6710 2.5712 2.5712 3.0646 3.0646 3.2175 3.2175 3.4995 3.4995 5.0237 5.0237 5.2397 5.2397 5.6523 5.6523 5.7931 5.7931 9.2942 9.2942 9.3882 9.3882 9.7301 9.7301 9.8893 9.8893 k = 0.1795-0.2734 0.1553 ( 5008 PWs) bands (ev): -20.5414 -20.5414 -20.5230 -20.5230 -8.3348 -8.3348 -8.0718 -8.0718 -7.1232 -7.1232 -6.9745 -6.9745 -5.3412 -5.3412 -5.2060 -5.2060 -5.1266 -5.1266 -4.9509 -4.9509 -3.7664 -3.7664 -3.5559 -3.5559 1.1826 1.1826 1.6157 1.6157 2.5346 2.5346 3.0936 3.0936 3.2161 3.2161 3.5133 3.5133 5.0229 5.0229 5.2359 5.2359 5.6530 5.6530 5.7939 5.7939 9.2492 9.2492 9.4071 9.4071 9.7386 9.7386 9.9426 9.9426 k = 0.1667-0.2539 0.1442 ( 5012 PWs) bands (ev): -20.5420 -20.5420 -20.5232 -20.5232 -8.3473 -8.3473 -8.0615 -8.0615 -7.1270 -7.1270 -6.9696 -6.9696 -5.3257 -5.3257 -5.2026 -5.2026 -5.1284 -5.1284 -4.9429 -4.9429 -3.7505 -3.7505 -3.5628 -3.5628 1.1825 1.1825 1.5629 1.5629 2.4991 2.4991 3.1166 3.1166 3.2208 3.2208 3.5274 3.5274 5.0200 5.0200 5.2325 5.2325 5.6537 5.6537 5.7966 5.7966 9.1967 9.1967 9.4258 9.4258 9.7471 9.7471 10.0032 10.0032 k = 0.1538-0.2343 0.1331 ( 5013 PWs) bands (ev): -20.5426 -20.5426 -20.5234 -20.5234 -8.3594 -8.3594 -8.0508 -8.0508 -7.1317 -7.1317 -6.9644 -6.9644 -5.3109 -5.3109 -5.1997 -5.1997 -5.1315 -5.1315 -4.9334 -4.9334 -3.7359 -3.7359 -3.5689 -3.5689 1.1823 1.1823 1.5128 1.5128 2.4649 2.4649 3.1298 3.1298 3.2355 3.2355 3.5415 3.5415 5.0153 5.0153 5.2294 5.2294 5.6540 5.6540 5.8011 5.8011 9.1452 9.1452 9.4385 9.4385 9.7575 9.7575 10.0653 10.0653 k = 0.1410-0.2148 0.1220 ( 5005 PWs) bands (ev): -20.5432 -20.5432 -20.5235 -20.5235 -8.3711 -8.3711 -8.0400 -8.0400 -7.1371 -7.1371 -6.9591 -6.9591 -5.2969 -5.2969 -5.1973 -5.1973 -5.1355 -5.1355 -4.9229 -4.9229 -3.7229 -3.7229 -3.5740 -3.5740 1.1818 1.1818 1.4659 1.4659 2.4324 2.4324 3.1332 3.1332 3.2598 3.2598 3.5557 3.5557 5.0091 5.0091 5.2264 5.2264 5.6537 5.6537 5.8073 5.8073 9.0968 9.0968 9.4461 9.4461 9.7703 9.7703 10.1245 10.1245 k = 0.1282-0.1953 0.1109 ( 5002 PWs) bands (ev): -20.5438 -20.5438 -20.5237 -20.5237 -8.3821 -8.3821 -8.0291 -8.0291 -7.1429 -7.1429 -6.9538 -6.9538 -5.2838 -5.2838 -5.1954 -5.1954 -5.1400 -5.1400 -4.9115 -4.9115 -3.7119 -3.7119 -3.5776 -3.5776 1.1812 1.1812 1.4223 1.4223 2.4017 2.4017 3.1309 3.1309 3.2891 3.2891 3.5698 3.5698 5.0018 5.0018 5.2235 5.2235 5.6527 5.6527 5.8149 5.8149 9.0520 9.0520 9.4500 9.4500 9.7855 9.7855 10.1773 10.1773 k = 0.1154-0.1758 0.0998 ( 4994 PWs) bands (ev): -20.5443 -20.5443 -20.5239 -20.5239 -8.3924 -8.3924 -8.0185 -8.0185 -7.1490 -7.1490 -6.9487 -6.9487 -5.2718 -5.2718 -5.1941 -5.1941 -5.1446 -5.1446 -4.8997 -4.8997 -3.7030 -3.7030 -3.5798 -3.5798 1.1803 1.1803 1.3825 1.3825 2.3731 2.3731 3.1259 3.1259 3.3201 3.3201 3.5839 3.5839 4.9939 4.9939 5.2206 5.2206 5.6510 5.6510 5.8233 5.8233 9.0112 9.0112 9.4518 9.4518 9.8024 9.8024 10.2126 10.2126 k = 0.1026-0.1562 0.0888 ( 4990 PWs) bands (ev): -20.5447 -20.5447 -20.5240 -20.5240 -8.4019 -8.4019 -8.0082 -8.0082 -7.1552 -7.1552 -6.9438 -6.9438 -5.2608 -5.2608 -5.1935 -5.1935 -5.1490 -5.1490 -4.8878 -4.8878 -3.6965 -3.6965 -3.5803 -3.5803 1.1789 1.1789 1.3467 1.3467 2.3469 2.3469 3.1199 3.1199 3.3505 3.3505 3.5977 3.5977 4.9857 4.9857 5.2176 5.2176 5.6486 5.6486 5.8322 5.8322 8.9745 8.9745 9.4532 9.4532 9.8194 9.8194 10.1722 10.1722 k = 0.0897-0.1367 0.0777 ( 4988 PWs) bands (ev): -20.5451 -20.5451 -20.5242 -20.5242 -8.4105 -8.4105 -7.9986 -7.9986 -7.1613 -7.1613 -6.9393 -6.9393 -5.2510 -5.2510 -5.1937 -5.1937 -5.1527 -5.1527 -4.8763 -4.8763 -3.6921 -3.6921 -3.5795 -3.5795 1.1770 1.1770 1.3153 1.3153 2.3232 2.3232 3.1138 3.1138 3.3791 3.3791 3.6112 3.6112 4.9777 4.9777 5.2145 5.2145 5.6458 5.6458 5.8411 5.8411 8.9422 8.9422 9.4556 9.4556 9.8333 9.8333 10.1214 10.1214 k = 0.0769-0.1172 0.0666 ( 4993 PWs) bands (ev): -20.5455 -20.5455 -20.5243 -20.5243 -8.4180 -8.4180 -7.9898 -7.9898 -7.1670 -7.1670 -6.9352 -6.9352 -5.2424 -5.2424 -5.1947 -5.1947 -5.1557 -5.1557 -4.8655 -4.8655 -3.6896 -3.6896 -3.5775 -3.5775 1.1744 1.1744 1.2888 1.2888 2.3023 2.3023 3.1079 3.1079 3.4049 3.4049 3.6242 3.6242 4.9701 4.9701 5.2114 5.2114 5.6427 5.6427 5.8497 5.8497 8.9141 8.9141 9.4600 9.4600 9.8384 9.8384 10.0813 10.0813 k = 0.0641-0.0976 0.0555 ( 4990 PWs) bands (ev): -20.5458 -20.5458 -20.5244 -20.5244 -8.4245 -8.4245 -7.9820 -7.9820 -7.1723 -7.1723 -6.9317 -6.9317 -5.2349 -5.2349 -5.1963 -5.1963 -5.1578 -5.1578 -4.8557 -4.8557 -3.6885 -3.6885 -3.5749 -3.5749 1.1710 1.1710 1.2672 1.2672 2.2843 2.2843 3.1026 3.1026 3.4273 3.4273 3.6364 3.6364 4.9632 4.9632 5.2083 5.2083 5.6395 5.6395 5.8576 5.8576 8.8904 8.8904 9.4675 9.4675 9.8275 9.8275 10.0617 10.0617 k = 0.0513-0.0781 0.0444 ( 4992 PWs) bands (ev): -20.5461 -20.5461 -20.5245 -20.5245 -8.4299 -8.4299 -7.9753 -7.9753 -7.1768 -7.1768 -6.9287 -6.9287 -5.2286 -5.2286 -5.1984 -5.1984 -5.1592 -5.1592 -4.8473 -4.8473 -3.6883 -3.6883 -3.5721 -3.5721 1.1667 1.1667 1.2509 1.2509 2.2693 2.2693 3.0981 3.0981 3.4458 3.4458 3.6474 3.6474 4.9573 4.9573 5.2056 5.2056 5.6366 5.6366 5.8644 5.8644 8.8710 8.8710 9.4784 9.4784 9.8000 9.8000 10.0647 10.0647 k = 0.0385-0.0586 0.0333 ( 4992 PWs) bands (ev): -20.5463 -20.5463 -20.5245 -20.5245 -8.4341 -8.4341 -7.9700 -7.9700 -7.1805 -7.1805 -6.9263 -6.9263 -5.2233 -5.2233 -5.2006 -5.2006 -5.1601 -5.1601 -4.8405 -4.8405 -3.6886 -3.6886 -3.5696 -3.5696 1.1621 1.1621 1.2393 1.2393 2.2576 2.2576 3.0945 3.0945 3.4603 3.4603 3.6568 3.6568 4.9525 4.9525 5.2032 5.2032 5.6340 5.6340 5.8699 5.8699 8.8559 8.8559 9.4925 9.4925 9.7639 9.7639 10.0831 10.0831 k = 0.0256-0.0391 0.0222 ( 4991 PWs) bands (ev): -20.5464 -20.5464 -20.5246 -20.5246 -8.4371 -8.4371 -7.9660 -7.9660 -7.1833 -7.1833 -6.9246 -6.9246 -5.2192 -5.2192 -5.2027 -5.2027 -5.1606 -5.1606 -4.8355 -4.8355 -3.6890 -3.6890 -3.5676 -3.5676 1.1578 1.1578 1.2320 1.2320 2.2491 2.2491 3.0918 3.0918 3.4706 3.4706 3.6639 3.6639 4.9489 4.9489 5.2014 5.2014 5.6319 5.6319 5.8740 5.8740 8.8452 8.8452 9.5085 9.5085 9.7282 9.7282 10.1083 10.1083 k = 0.0128-0.0195 0.0111 ( 4992 PWs) bands (ev): -20.5465 -20.5465 -20.5246 -20.5246 -8.4389 -8.4389 -7.9636 -7.9636 -7.1850 -7.1850 -6.9236 -6.9236 -5.2164 -5.2164 -5.2045 -5.2045 -5.1609 -5.1609 -4.8324 -4.8324 -3.6893 -3.6893 -3.5663 -3.5663 1.1549 1.1549 1.2280 1.2280 2.2440 2.2440 3.0902 3.0902 3.4768 3.4768 3.6684 3.6684 4.9468 4.9468 5.2003 5.2003 5.6307 5.6307 5.8766 5.8766 8.8387 8.8387 9.5227 9.5227 9.7008 9.7008 10.1321 10.1321 k = 0.0000 0.0000 0.0000 ( 4987 PWs) bands (ev): -20.5465 -20.5465 -20.5246 -20.5246 -8.4395 -8.4395 -7.9628 -7.9628 -7.1856 -7.1856 -6.9232 -6.9232 -5.2153 -5.2153 -5.2052 -5.2052 -5.1609 -5.1609 -4.8313 -4.8313 -3.6894 -3.6894 -3.5659 -3.5659 1.1538 1.1538 1.2267 1.2267 2.2423 2.2423 3.0897 3.0897 3.4788 3.4788 3.6699 3.6699 4.9461 4.9461 5.1999 5.1999 5.6302 5.6302 5.8774 5.8774 8.8366 8.8366 9.5288 9.5288 9.6901 9.6901 10.1429 10.1429 Writing output data file BaS2.save init_run : 3.29s CPU 13.58s WALL ( 1 calls) electrons : 1410.05s CPU 1423.04s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.44s CPU 1.58s WALL ( 1 calls) Called by electrons: c_bands : 1409.92s CPU 1422.62s WALL ( 1 calls) v_of_rho : 0.04s CPU 0.92s WALL ( 1 calls) v_h : 0.01s CPU 0.01s WALL ( 1 calls) v_xc : 0.04s CPU 0.59s WALL ( 1 calls) newd : 0.49s CPU 0.65s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.10s WALL ( 323 calls) cegterg : 1083.58s CPU 1089.87s WALL ( 859 calls) Called by sum_band: Called by *egterg: h_psi : 645.05s CPU 655.53s WALL ( 15105 calls) s_psi : 56.36s CPU 56.71s WALL ( 15105 calls) g_psi : 0.92s CPU 0.97s WALL ( 13923 calls) cdiaghg : 285.25s CPU 282.13s WALL ( 14246 calls) cegterg:over : 64.12s CPU 60.24s WALL ( 13923 calls) cegterg:upda : 16.05s CPU 20.48s WALL ( 13923 calls) cegterg:last : 12.71s CPU 13.53s WALL ( 2150 calls) Called by h_psi: h_psi:vloc : 542.71s CPU 550.94s WALL ( 15105 calls) h_psi:vnl : 101.92s CPU 103.57s WALL ( 15105 calls) add_vuspsi : 40.28s CPU 45.14s WALL ( 15105 calls) General routines calbec : 61.57s CPU 58.32s WALL ( 15105 calls) fft : 0.42s CPU 1.18s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 511.03s CPU 515.49s WALL ( 1280708 calls) interpolate : 0.07s CPU 0.13s WALL ( 4 calls) davcio : 0.03s CPU 13.12s WALL ( 646 calls) Parallel routines fft_scatter : 273.30s CPU 258.67s WALL ( 1280731 calls) PWSCF : 26m24.99s CPU 30m46.09s WALL This run was terminated on: 3:39:23 13Jun2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=