Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:26:27 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Li2PdO2.save/ file Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 96 72 20 2099 1373 211 Max 97 73 21 2101 1391 213 Sum 3457 2613 749 75599 49669 7643 bravais-lattice index = 14 lattice parameter (alat) = 9.8991 a.u. unit-cell volume = 351.7953 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 36.00 number of Kohn-Sham states= 44 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 545.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.899138 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.837994 celldm(5)= -0.743302 celldm(6)= 0.581296 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.581296 0.813692 0.000000 ) a(3) = ( -0.743302 -0.498857 0.445695 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.714394 0.868131 ) b(2) = ( 0.000000 1.228966 1.375555 ) b(3) = ( 0.000000 0.000000 2.243686 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Li read from file: /users/gautes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Pd read from file: /users/gautes/Pseudo/Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 7926b04c0aa9b348bf6cb39d90ce6236 Pseudo is Ultrasoft + core correction, Zval = 18.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1235 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Li 3.00 6.94100 Li( 1.00) Pd 18.00 106.42000 Pd( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 481 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020790 k( 2) = ( -0.0046714 0.0090782 0.0128515), wk = 0.0020790 k( 3) = ( -0.0093428 0.0181564 0.0257031), wk = 0.0020790 k( 4) = ( -0.0140142 0.0272347 0.0385546), wk = 0.0020790 k( 5) = ( -0.0186856 0.0363129 0.0514062), wk = 0.0020790 k( 6) = ( -0.0233570 0.0453911 0.0642577), wk = 0.0020790 k( 7) = ( -0.0280284 0.0544693 0.0771093), wk = 0.0020790 k( 8) = ( -0.0326998 0.0635475 0.0899608), wk = 0.0020790 k( 9) = ( -0.0373712 0.0726257 0.1028123), wk = 0.0020790 k( 10) = ( -0.0420426 0.0817040 0.1156639), wk = 0.0020790 k( 11) = ( -0.0467140 0.0907822 0.1285154), wk = 0.0020790 k( 12) = ( -0.0513854 0.0998604 0.1413670), wk = 0.0020790 k( 13) = ( -0.0560568 0.1089386 0.1542185), wk = 0.0020790 k( 14) = ( -0.0607282 0.1180168 0.1670701), wk = 0.0020790 k( 15) = ( -0.0653996 0.1270950 0.1799216), wk = 0.0020790 k( 16) = ( -0.0700710 0.1361733 0.1927732), wk = 0.0020790 k( 17) = ( -0.0747425 0.1452515 0.2056247), wk = 0.0020790 k( 18) = ( -0.0794138 0.1543297 0.2184762), wk = 0.0020790 k( 19) = ( -0.0840853 0.1634079 0.2313278), wk = 0.0020790 k( 20) = ( -0.0887567 0.1724861 0.2441793), wk = 0.0020790 k( 21) = ( -0.0934281 0.1815643 0.2570309), wk = 0.0020790 k( 22) = ( -0.0980995 0.1906426 0.2698824), wk = 0.0020790 k( 23) = ( -0.1027709 0.1997208 0.2827340), wk = 0.0020790 k( 24) = ( -0.1074423 0.2087990 0.2955855), wk = 0.0020790 k( 25) = ( -0.1121137 0.2178772 0.3084370), wk = 0.0020790 k( 26) = ( -0.1167851 0.2269554 0.3212886), wk = 0.0020790 k( 27) = ( -0.1214565 0.2360337 0.3341401), wk = 0.0020790 k( 28) = ( -0.1261279 0.2451119 0.3469917), wk = 0.0020790 k( 29) = ( -0.1307993 0.2541901 0.3598432), wk = 0.0020790 k( 30) = ( -0.1354707 0.2632683 0.3726948), wk = 0.0020790 k( 31) = ( -0.1401421 0.2723465 0.3855463), wk = 0.0020790 k( 32) = ( -0.1448135 0.2814247 0.3983978), wk = 0.0020790 k( 33) = ( -0.1494849 0.2905030 0.4112494), wk = 0.0020790 k( 34) = ( -0.1541563 0.2995812 0.4241009), wk = 0.0020790 k( 35) = ( -0.1588277 0.3086594 0.4369525), wk = 0.0020790 k( 36) = ( -0.1634991 0.3177376 0.4498040), wk = 0.0020790 k( 37) = ( -0.1681705 0.3268158 0.4626556), wk = 0.0020790 k( 38) = ( -0.1728419 0.3358940 0.4755071), wk = 0.0020790 k( 39) = ( -0.1775133 0.3449723 0.4883587), wk = 0.0020790 k( 40) = ( -0.1821847 0.3540505 0.5012102), wk = 0.0020790 k( 41) = ( -0.1868561 0.3631287 0.5140617), wk = 0.0020790 k( 42) = ( -0.1915275 0.3722069 0.5269133), wk = 0.0020790 k( 43) = ( -0.1961989 0.3812851 0.5397648), wk = 0.0020790 k( 44) = ( -0.2008703 0.3903634 0.5526164), wk = 0.0020790 k( 45) = ( -0.2055417 0.3994416 0.5654679), wk = 0.0020790 k( 46) = ( -0.2102131 0.4085198 0.5783195), wk = 0.0020790 k( 47) = ( -0.2148845 0.4175980 0.5911710), wk = 0.0020790 k( 48) = ( -0.2195559 0.4266762 0.6040225), wk = 0.0020790 k( 49) = ( -0.2242273 0.4357544 0.6168741), wk = 0.0020790 k( 50) = ( -0.2288988 0.4448327 0.6297256), wk = 0.0020790 k( 51) = ( -0.2335702 0.4539109 0.6425772), wk = 0.0020790 k( 52) = ( -0.2382416 0.4629891 0.6554287), wk = 0.0020790 k( 53) = ( -0.2429130 0.4720673 0.6682803), wk = 0.0020790 k( 54) = ( -0.2475844 0.4811455 0.6811318), wk = 0.0020790 k( 55) = ( -0.2522558 0.4902237 0.6939833), wk = 0.0020790 k( 56) = ( -0.2569272 0.4993020 0.7068349), wk = 0.0020790 k( 57) = ( -0.2615986 0.5083802 0.7196864), wk = 0.0020790 k( 58) = ( -0.2662700 0.5174584 0.7325380), wk = 0.0020790 k( 59) = ( -0.2709414 0.5265366 0.7453895), wk = 0.0020790 k( 60) = ( -0.2756128 0.5356148 0.7582411), wk = 0.0020790 k( 61) = ( -0.2756128 0.5356148 0.7582411), wk = 0.0020790 k( 62) = ( -0.2697956 0.5243101 0.7683411), wk = 0.0020790 k( 63) = ( -0.2639785 0.5130053 0.7784412), wk = 0.0020790 k( 64) = ( -0.2581614 0.5017005 0.7885412), wk = 0.0020790 k( 65) = ( -0.2523443 0.4903958 0.7986413), wk = 0.0020790 k( 66) = ( -0.2465272 0.4790910 0.8087413), wk = 0.0020790 k( 67) = ( -0.2407100 0.4677862 0.8188414), wk = 0.0020790 k( 68) = ( -0.2348929 0.4564815 0.8289414), wk = 0.0020790 k( 69) = ( -0.2290758 0.4451767 0.8390415), wk = 0.0020790 k( 70) = ( -0.2232587 0.4338719 0.8491416), wk = 0.0020790 k( 71) = ( -0.2174415 0.4225672 0.8592416), wk = 0.0020790 k( 72) = ( -0.2116244 0.4112624 0.8693417), wk = 0.0020790 k( 73) = ( -0.2058073 0.3999576 0.8794417), wk = 0.0020790 k( 74) = ( -0.1999902 0.3886528 0.8895418), wk = 0.0020790 k( 75) = ( -0.1941730 0.3773481 0.8996418), wk = 0.0020790 k( 76) = ( -0.1883559 0.3660433 0.9097419), wk = 0.0020790 k( 77) = ( -0.1825388 0.3547386 0.9198419), wk = 0.0020790 k( 78) = ( -0.1767217 0.3434338 0.9299420), wk = 0.0020790 k( 79) = ( -0.1709045 0.3321290 0.9400420), wk = 0.0020790 k( 80) = ( -0.1650874 0.3208242 0.9501421), wk = 0.0020790 k( 81) = ( -0.1592703 0.3095195 0.9602422), wk = 0.0020790 k( 82) = ( -0.1534532 0.2982147 0.9703422), wk = 0.0020790 k( 83) = ( -0.1476360 0.2869099 0.9804423), wk = 0.0020790 k( 84) = ( -0.1418189 0.2756052 0.9905423), wk = 0.0020790 k( 85) = ( -0.1360018 0.2643004 1.0006424), wk = 0.0020790 k( 86) = ( -0.1301847 0.2529956 1.0107424), wk = 0.0020790 k( 87) = ( -0.1243675 0.2416909 1.0208425), wk = 0.0020790 k( 88) = ( -0.1185504 0.2303861 1.0309425), wk = 0.0020790 k( 89) = ( -0.1127333 0.2190813 1.0410426), wk = 0.0020790 k( 90) = ( -0.1069162 0.2077766 1.0511426), wk = 0.0020790 k( 91) = ( -0.1010990 0.1964718 1.0612427), wk = 0.0020790 k( 92) = ( -0.0952819 0.1851670 1.0713427), wk = 0.0020790 k( 93) = ( -0.0894648 0.1738622 1.0814428), wk = 0.0020790 k( 94) = ( -0.0836477 0.1625575 1.0915428), wk = 0.0020790 k( 95) = ( -0.0778305 0.1512527 1.1016429), wk = 0.0020790 k( 96) = ( -0.0720134 0.1399480 1.1117429), wk = 0.0020790 k( 97) = ( -0.0661963 0.1286432 1.1218430), wk = 0.0020790 k( 98) = ( -0.0661963 0.1286432 1.1218430), wk = 0.0020790 k( 99) = ( -0.0588411 0.1143495 1.1218430), wk = 0.0020790 k( 100) = ( -0.0514860 0.1000558 1.1218430), wk = 0.0020790 k( 101) = ( -0.0441308 0.0857621 1.1218430), wk = 0.0020790 k( 102) = ( -0.0367757 0.0714684 1.1218430), wk = 0.0020790 k( 103) = ( -0.0294206 0.0571747 1.1218430), wk = 0.0020790 k( 104) = ( -0.0220654 0.0428811 1.1218430), wk = 0.0020790 k( 105) = ( -0.0147103 0.0285874 1.1218430), wk = 0.0020790 k( 106) = ( -0.0073551 0.0142937 1.1218430), wk = 0.0020790 k( 107) = ( 0.0000000 0.0000000 1.1218430), wk = 0.0020790 k( 108) = ( 0.0000000 0.0000000 1.1218430), wk = 0.0020790 k( 109) = ( 0.0147059 0.0075672 1.1218430), wk = 0.0020790 k( 110) = ( 0.0294118 0.0151345 1.1218430), wk = 0.0020790 k( 111) = ( 0.0441177 0.0227017 1.1218430), wk = 0.0020790 k( 112) = ( 0.0588235 0.0302690 1.1218430), wk = 0.0020790 k( 113) = ( 0.0735294 0.0378362 1.1218430), wk = 0.0020790 k( 114) = ( 0.0882353 0.0454035 1.1218430), wk = 0.0020790 k( 115) = ( 0.1029412 0.0529707 1.1218430), wk = 0.0020790 k( 116) = ( 0.1176471 0.0605380 1.1218430), wk = 0.0020790 k( 117) = ( 0.1323529 0.0681052 1.1218430), wk = 0.0020790 k( 118) = ( 0.1470588 0.0756725 1.1218430), wk = 0.0020790 k( 119) = ( 0.1617647 0.0832397 1.1218430), wk = 0.0020790 k( 120) = ( 0.1764706 0.0908070 1.1218430), wk = 0.0020790 k( 121) = ( 0.1911765 0.0983742 1.1218430), wk = 0.0020790 k( 122) = ( 0.2058823 0.1059414 1.1218430), wk = 0.0020790 k( 123) = ( 0.2205882 0.1135087 1.1218430), wk = 0.0020790 k( 124) = ( 0.2352941 0.1210759 1.1218430), wk = 0.0020790 k( 125) = ( 0.2500000 0.1286432 1.1218430), wk = 0.0020790 k( 126) = ( 0.2500000 0.1286432 1.1218430), wk = 0.0020790 k( 127) = ( 0.2440476 0.1402108 1.1115081), wk = 0.0020790 k( 128) = ( 0.2380952 0.1517784 1.1011732), wk = 0.0020790 k( 129) = ( 0.2321429 0.1633460 1.0908383), wk = 0.0020790 k( 130) = ( 0.2261905 0.1749136 1.0805034), wk = 0.0020790 k( 131) = ( 0.2202381 0.1864813 1.0701685), wk = 0.0020790 k( 132) = ( 0.2142857 0.1980489 1.0598336), wk = 0.0020790 k( 133) = ( 0.2083333 0.2096165 1.0494987), wk = 0.0020790 k( 134) = ( 0.2023810 0.2211841 1.0391639), wk = 0.0020790 k( 135) = ( 0.1964286 0.2327517 1.0288290), wk = 0.0020790 k( 136) = ( 0.1904762 0.2443194 1.0184941), wk = 0.0020790 k( 137) = ( 0.1845238 0.2558870 1.0081592), wk = 0.0020790 k( 138) = ( 0.1785714 0.2674546 0.9978243), wk = 0.0020790 k( 139) = ( 0.1726190 0.2790222 0.9874894), wk = 0.0020790 k( 140) = ( 0.1666667 0.2905898 0.9771545), wk = 0.0020790 k( 141) = ( 0.1607143 0.3021575 0.9668196), wk = 0.0020790 k( 142) = ( 0.1547619 0.3137251 0.9564847), wk = 0.0020790 k( 143) = ( 0.1488095 0.3252927 0.9461498), wk = 0.0020790 k( 144) = ( 0.1428571 0.3368603 0.9358149), wk = 0.0020790 k( 145) = ( 0.1369048 0.3484279 0.9254800), wk = 0.0020790 k( 146) = ( 0.1309524 0.3599956 0.9151451), wk = 0.0020790 k( 147) = ( 0.1250000 0.3715632 0.9048102), wk = 0.0020790 k( 148) = ( 0.1190476 0.3831308 0.8944754), wk = 0.0020790 k( 149) = ( 0.1130952 0.3946984 0.8841405), wk = 0.0020790 k( 150) = ( 0.1071429 0.4062660 0.8738056), wk = 0.0020790 k( 151) = ( 0.1011905 0.4178336 0.8634707), wk = 0.0020790 k( 152) = ( 0.0952381 0.4294013 0.8531358), wk = 0.0020790 k( 153) = ( 0.0892857 0.4409689 0.8428009), wk = 0.0020790 k( 154) = ( 0.0833333 0.4525365 0.8324660), wk = 0.0020790 k( 155) = ( 0.0773810 0.4641041 0.8221311), wk = 0.0020790 k( 156) = ( 0.0714286 0.4756717 0.8117962), wk = 0.0020790 k( 157) = ( 0.0654762 0.4872394 0.8014613), wk = 0.0020790 k( 158) = ( 0.0595238 0.4988070 0.7911264), wk = 0.0020790 k( 159) = ( 0.0535714 0.5103746 0.7807915), wk = 0.0020790 k( 160) = ( 0.0476191 0.5219422 0.7704566), wk = 0.0020790 k( 161) = ( 0.0416667 0.5335098 0.7601217), wk = 0.0020790 k( 162) = ( 0.0357143 0.5450774 0.7497869), wk = 0.0020790 k( 163) = ( 0.0297619 0.5566451 0.7394519), wk = 0.0020790 k( 164) = ( 0.0238095 0.5682127 0.7291171), wk = 0.0020790 k( 165) = ( 0.0178571 0.5797803 0.7187822), wk = 0.0020790 k( 166) = ( 0.0119048 0.5913479 0.7084473), wk = 0.0020790 k( 167) = ( 0.0059524 0.6029155 0.6981124), wk = 0.0020790 k( 168) = ( 0.0000000 0.6144832 0.6877775), wk = 0.0020790 k( 169) = ( 0.0000000 0.6144832 0.6877775), wk = 0.0020790 k( 170) = ( 0.0153118 0.6188647 0.6838629), wk = 0.0020790 k( 171) = ( 0.0306236 0.6232463 0.6799482), wk = 0.0020790 k( 172) = ( 0.0459355 0.6276279 0.6760336), wk = 0.0020790 k( 173) = ( 0.0612473 0.6320095 0.6721189), wk = 0.0020790 k( 174) = ( 0.0765591 0.6363910 0.6682043), wk = 0.0020790 k( 175) = ( 0.0918709 0.6407726 0.6642896), wk = 0.0020790 k( 176) = ( 0.1071827 0.6451542 0.6603750), wk = 0.0020790 k( 177) = ( 0.1224946 0.6495357 0.6564603), wk = 0.0020790 k( 178) = ( 0.1378064 0.6539173 0.6525457), wk = 0.0020790 k( 179) = ( 0.1531182 0.6582989 0.6486311), wk = 0.0020790 k( 180) = ( 0.1684300 0.6626805 0.6447164), wk = 0.0020790 k( 181) = ( 0.1837419 0.6670621 0.6408018), wk = 0.0020790 k( 182) = ( 0.1990537 0.6714436 0.6368871), wk = 0.0020790 k( 183) = ( 0.2143655 0.6758252 0.6329725), wk = 0.0020790 k( 184) = ( 0.2296773 0.6802068 0.6290578), wk = 0.0020790 k( 185) = ( 0.2449891 0.6845883 0.6251432), wk = 0.0020790 k( 186) = ( 0.2603010 0.6889699 0.6212286), wk = 0.0020790 k( 187) = ( 0.2756128 0.6933515 0.6173139), wk = 0.0020790 k( 188) = ( 0.2756128 0.6933515 0.6173139), wk = 0.0020790 k( 189) = ( 0.2802875 0.6842668 0.6044532), wk = 0.0020790 k( 190) = ( 0.2849622 0.6751821 0.5915925), wk = 0.0020790 k( 191) = ( 0.2896370 0.6660974 0.5787318), wk = 0.0020790 k( 192) = ( 0.2943117 0.6570127 0.5658711), wk = 0.0020790 k( 193) = ( 0.2989865 0.6479280 0.5530104), wk = 0.0020790 k( 194) = ( 0.3036612 0.6388434 0.5401497), wk = 0.0020790 k( 195) = ( 0.3083359 0.6297587 0.5272890), wk = 0.0020790 k( 196) = ( 0.3130107 0.6206740 0.5144283), wk = 0.0020790 k( 197) = ( 0.3176854 0.6115893 0.5015676), wk = 0.0020790 k( 198) = ( 0.3223601 0.6025046 0.4887068), wk = 0.0020790 k( 199) = ( 0.3270348 0.5934199 0.4758461), wk = 0.0020790 k( 200) = ( 0.3317096 0.5843352 0.4629855), wk = 0.0020790 k( 201) = ( 0.3363843 0.5752505 0.4501247), wk = 0.0020790 k( 202) = ( 0.3410590 0.5661658 0.4372640), wk = 0.0020790 k( 203) = ( 0.3457338 0.5570811 0.4244033), wk = 0.0020790 k( 204) = ( 0.3504085 0.5479964 0.4115426), wk = 0.0020790 k( 205) = ( 0.3550833 0.5389118 0.3986819), wk = 0.0020790 k( 206) = ( 0.3597580 0.5298271 0.3858212), wk = 0.0020790 k( 207) = ( 0.3644327 0.5207424 0.3729605), wk = 0.0020790 k( 208) = ( 0.3691075 0.5116577 0.3600998), wk = 0.0020790 k( 209) = ( 0.3737822 0.5025730 0.3472391), wk = 0.0020790 k( 210) = ( 0.3784569 0.4934883 0.3343784), wk = 0.0020790 k( 211) = ( 0.3831317 0.4844036 0.3215177), wk = 0.0020790 k( 212) = ( 0.3878064 0.4753189 0.3086570), wk = 0.0020790 k( 213) = ( 0.3924811 0.4662342 0.2957963), wk = 0.0020790 k( 214) = ( 0.3971559 0.4571495 0.2829355), wk = 0.0020790 k( 215) = ( 0.4018306 0.4480649 0.2700748), wk = 0.0020790 k( 216) = ( 0.4065053 0.4389802 0.2572141), wk = 0.0020790 k( 217) = ( 0.4111801 0.4298955 0.2443534), wk = 0.0020790 k( 218) = ( 0.4158548 0.4208108 0.2314927), wk = 0.0020790 k( 219) = ( 0.4205295 0.4117261 0.2186320), wk = 0.0020790 k( 220) = ( 0.4252043 0.4026414 0.2057713), wk = 0.0020790 k( 221) = ( 0.4298790 0.3935567 0.1929106), wk = 0.0020790 k( 222) = ( 0.4345537 0.3844720 0.1800499), wk = 0.0020790 k( 223) = ( 0.4392285 0.3753873 0.1671892), wk = 0.0020790 k( 224) = ( 0.4439032 0.3663027 0.1543285), wk = 0.0020790 k( 225) = ( 0.4485779 0.3572179 0.1414678), wk = 0.0020790 k( 226) = ( 0.4532527 0.3481333 0.1286071), wk = 0.0020790 k( 227) = ( 0.4579274 0.3390486 0.1157463), wk = 0.0020790 k( 228) = ( 0.4626021 0.3299639 0.1028857), wk = 0.0020790 k( 229) = ( 0.4672769 0.3208792 0.0900250), wk = 0.0020790 k( 230) = ( 0.4719516 0.3117945 0.0771642), wk = 0.0020790 k( 231) = ( 0.4766263 0.3027098 0.0643035), wk = 0.0020790 k( 232) = ( 0.4813011 0.2936251 0.0514428), wk = 0.0020790 k( 233) = ( 0.4859758 0.2845404 0.0385821), wk = 0.0020790 k( 234) = ( 0.4906505 0.2754557 0.0257214), wk = 0.0020790 k( 235) = ( 0.4953253 0.2663710 0.0128607), wk = 0.0020790 k( 236) = ( 0.5000000 0.2572864 0.0000000), wk = 0.0020790 k( 237) = ( 0.5000000 0.2572864 0.0000000), wk = 0.0020790 k( 238) = ( 0.4852941 0.2497191 0.0000000), wk = 0.0020790 k( 239) = ( 0.4705882 0.2421519 0.0000000), wk = 0.0020790 k( 240) = ( 0.4558823 0.2345846 0.0000000), wk = 0.0020790 k( 241) = ( 0.4411765 0.2270174 0.0000000), wk = 0.0020790 k( 242) = ( 0.4264706 0.2194501 0.0000000), wk = 0.0020790 k( 243) = ( 0.4117647 0.2118829 0.0000000), wk = 0.0020790 k( 244) = ( 0.3970588 0.2043156 0.0000000), wk = 0.0020790 k( 245) = ( 0.3823529 0.1967484 0.0000000), wk = 0.0020790 k( 246) = ( 0.3676471 0.1891811 0.0000000), wk = 0.0020790 k( 247) = ( 0.3529412 0.1816139 0.0000000), wk = 0.0020790 k( 248) = ( 0.3382353 0.1740467 0.0000000), wk = 0.0020790 k( 249) = ( 0.3235294 0.1664794 0.0000000), wk = 0.0020790 k( 250) = ( 0.3088235 0.1589122 0.0000000), wk = 0.0020790 k( 251) = ( 0.2941177 0.1513449 0.0000000), wk = 0.0020790 k( 252) = ( 0.2794118 0.1437777 0.0000000), wk = 0.0020790 k( 253) = ( 0.2647059 0.1362104 0.0000000), wk = 0.0020790 k( 254) = ( 0.2500000 0.1286432 0.0000000), wk = 0.0020790 k( 255) = ( 0.2352941 0.1210759 0.0000000), wk = 0.0020790 k( 256) = ( 0.2205882 0.1135087 0.0000000), wk = 0.0020790 k( 257) = ( 0.2058823 0.1059414 0.0000000), wk = 0.0020790 k( 258) = ( 0.1911765 0.0983742 0.0000000), wk = 0.0020790 k( 259) = ( 0.1764706 0.0908070 0.0000000), wk = 0.0020790 k( 260) = ( 0.1617647 0.0832397 0.0000000), wk = 0.0020790 k( 261) = ( 0.1470588 0.0756725 0.0000000), wk = 0.0020790 k( 262) = ( 0.1323529 0.0681052 0.0000000), wk = 0.0020790 k( 263) = ( 0.1176471 0.0605380 0.0000000), wk = 0.0020790 k( 264) = ( 0.1029412 0.0529707 0.0000000), wk = 0.0020790 k( 265) = ( 0.0882353 0.0454035 0.0000000), wk = 0.0020790 k( 266) = ( 0.0735294 0.0378362 0.0000000), wk = 0.0020790 k( 267) = ( 0.0588235 0.0302690 0.0000000), wk = 0.0020790 k( 268) = ( 0.0441177 0.0227017 0.0000000), wk = 0.0020790 k( 269) = ( 0.0294118 0.0151345 0.0000000), wk = 0.0020790 k( 270) = ( 0.0147059 0.0075672 0.0000000), wk = 0.0020790 k( 271) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020790 k( 272) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020790 k( 273) = ( 0.0059303 -0.0115247 0.0102965), wk = 0.0020790 k( 274) = ( 0.0118605 -0.0230493 0.0205930), wk = 0.0020790 k( 275) = ( 0.0177908 -0.0345740 0.0308895), wk = 0.0020790 k( 276) = ( 0.0237211 -0.0460986 0.0411860), wk = 0.0020790 k( 277) = ( 0.0296514 -0.0576233 0.0514826), wk = 0.0020790 k( 278) = ( 0.0355816 -0.0691480 0.0617791), wk = 0.0020790 k( 279) = ( 0.0415119 -0.0806726 0.0720756), wk = 0.0020790 k( 280) = ( 0.0474422 -0.0921973 0.0823721), wk = 0.0020790 k( 281) = ( 0.0533725 -0.1037219 0.0926686), wk = 0.0020790 k( 282) = ( 0.0593028 -0.1152466 0.1029651), wk = 0.0020790 k( 283) = ( 0.0652330 -0.1267713 0.1132616), wk = 0.0020790 k( 284) = ( 0.0711633 -0.1382959 0.1235581), wk = 0.0020790 k( 285) = ( 0.0770936 -0.1498206 0.1338547), wk = 0.0020790 k( 286) = ( 0.0830238 -0.1613452 0.1441512), wk = 0.0020790 k( 287) = ( 0.0889541 -0.1728699 0.1544477), wk = 0.0020790 k( 288) = ( 0.0948844 -0.1843946 0.1647442), wk = 0.0020790 k( 289) = ( 0.1008147 -0.1959192 0.1750407), wk = 0.0020790 k( 290) = ( 0.1067450 -0.2074439 0.1853372), wk = 0.0020790 k( 291) = ( 0.1126752 -0.2189685 0.1956337), wk = 0.0020790 k( 292) = ( 0.1186055 -0.2304932 0.2059302), wk = 0.0020790 k( 293) = ( 0.1245358 -0.2420178 0.2162267), wk = 0.0020790 k( 294) = ( 0.1304661 -0.2535425 0.2265233), wk = 0.0020790 k( 295) = ( 0.1363963 -0.2650672 0.2368198), wk = 0.0020790 k( 296) = ( 0.1423266 -0.2765918 0.2471163), wk = 0.0020790 k( 297) = ( 0.1482569 -0.2881165 0.2574128), wk = 0.0020790 k( 298) = ( 0.1541872 -0.2996411 0.2677093), wk = 0.0020790 k( 299) = ( 0.1601174 -0.3111658 0.2780058), wk = 0.0020790 k( 300) = ( 0.1660477 -0.3226905 0.2883023), wk = 0.0020790 k( 301) = ( 0.1719780 -0.3342151 0.2985988), wk = 0.0020790 k( 302) = ( 0.1779083 -0.3457398 0.3088954), wk = 0.0020790 k( 303) = ( 0.1838385 -0.3572644 0.3191919), wk = 0.0020790 k( 304) = ( 0.1897688 -0.3687891 0.3294884), wk = 0.0020790 k( 305) = ( 0.1956991 -0.3803138 0.3397849), wk = 0.0020790 k( 306) = ( 0.2016294 -0.3918384 0.3500814), wk = 0.0020790 k( 307) = ( 0.2075596 -0.4033631 0.3603779), wk = 0.0020790 k( 308) = ( 0.2134899 -0.4148877 0.3706744), wk = 0.0020790 k( 309) = ( 0.2194202 -0.4264124 0.3809709), wk = 0.0020790 k( 310) = ( 0.2253505 -0.4379371 0.3912675), wk = 0.0020790 k( 311) = ( 0.2312807 -0.4494617 0.4015640), wk = 0.0020790 k( 312) = ( 0.2372110 -0.4609864 0.4118605), wk = 0.0020790 k( 313) = ( 0.2431413 -0.4725110 0.4221570), wk = 0.0020790 k( 314) = ( 0.2490716 -0.4840357 0.4324535), wk = 0.0020790 k( 315) = ( 0.2550018 -0.4955604 0.4427500), wk = 0.0020790 k( 316) = ( 0.2609321 -0.5070850 0.4530465), wk = 0.0020790 k( 317) = ( 0.2668624 -0.5186097 0.4633430), wk = 0.0020790 k( 318) = ( 0.2727927 -0.5301343 0.4736395), wk = 0.0020790 k( 319) = ( 0.2787229 -0.5416590 0.4839361), wk = 0.0020790 k( 320) = ( 0.2846532 -0.5531837 0.4942326), wk = 0.0020790 k( 321) = ( 0.2905835 -0.5647083 0.5045291), wk = 0.0020790 k( 322) = ( 0.2905835 -0.5647083 0.5045291), wk = 0.0020790 k( 323) = ( 0.3016054 -0.5537866 0.5008205), wk = 0.0020790 k( 324) = ( 0.3126273 -0.5428650 0.4971119), wk = 0.0020790 k( 325) = ( 0.3236493 -0.5319433 0.4934033), wk = 0.0020790 k( 326) = ( 0.3346712 -0.5210217 0.4896947), wk = 0.0020790 k( 327) = ( 0.3456931 -0.5101000 0.4859860), wk = 0.0020790 k( 328) = ( 0.3567150 -0.4991784 0.4822774), wk = 0.0020790 k( 329) = ( 0.3677369 -0.4882567 0.4785688), wk = 0.0020790 k( 330) = ( 0.3787589 -0.4773350 0.4748602), wk = 0.0020790 k( 331) = ( 0.3897808 -0.4664134 0.4711516), wk = 0.0020790 k( 332) = ( 0.4008027 -0.4554917 0.4674430), wk = 0.0020790 k( 333) = ( 0.4118246 -0.4445701 0.4637344), wk = 0.0020790 k( 334) = ( 0.4228465 -0.4336484 0.4600258), wk = 0.0020790 k( 335) = ( 0.4338685 -0.4227268 0.4563172), wk = 0.0020790 k( 336) = ( 0.4448904 -0.4118051 0.4526086), wk = 0.0020790 k( 337) = ( 0.4559123 -0.4008834 0.4488999), wk = 0.0020790 k( 338) = ( 0.4669342 -0.3899618 0.4451913), wk = 0.0020790 k( 339) = ( 0.4779562 -0.3790401 0.4414827), wk = 0.0020790 k( 340) = ( 0.4889781 -0.3681185 0.4377741), wk = 0.0020790 k( 341) = ( 0.5000000 -0.3571968 0.4340655), wk = 0.0020790 k( 342) = ( 0.5000000 -0.3571968 0.4340655), wk = 0.0020790 k( 343) = ( 0.4952830 -0.3480300 0.4470424), wk = 0.0020790 k( 344) = ( 0.4905660 -0.3388632 0.4600194), wk = 0.0020790 k( 345) = ( 0.4858491 -0.3296964 0.4729963), wk = 0.0020790 k( 346) = ( 0.4811321 -0.3205296 0.4859732), wk = 0.0020790 k( 347) = ( 0.4764151 -0.3113628 0.4989502), wk = 0.0020790 k( 348) = ( 0.4716981 -0.3021960 0.5119271), wk = 0.0020790 k( 349) = ( 0.4669811 -0.2930293 0.5249041), wk = 0.0020790 k( 350) = ( 0.4622641 -0.2838625 0.5378810), wk = 0.0020790 k( 351) = ( 0.4575472 -0.2746957 0.5508579), wk = 0.0020790 k( 352) = ( 0.4528302 -0.2655289 0.5638348), wk = 0.0020790 k( 353) = ( 0.4481132 -0.2563621 0.5768118), wk = 0.0020790 k( 354) = ( 0.4433962 -0.2471953 0.5897887), wk = 0.0020790 k( 355) = ( 0.4386793 -0.2380285 0.6027656), wk = 0.0020790 k( 356) = ( 0.4339623 -0.2288617 0.6157426), wk = 0.0020790 k( 357) = ( 0.4292453 -0.2196949 0.6287195), wk = 0.0020790 k( 358) = ( 0.4245283 -0.2105281 0.6416965), wk = 0.0020790 k( 359) = ( 0.4198113 -0.2013613 0.6546734), wk = 0.0020790 k( 360) = ( 0.4150943 -0.1921945 0.6676503), wk = 0.0020790 k( 361) = ( 0.4103774 -0.1830278 0.6806272), wk = 0.0020790 k( 362) = ( 0.4056604 -0.1738610 0.6936042), wk = 0.0020790 k( 363) = ( 0.4009434 -0.1646942 0.7065811), wk = 0.0020790 k( 364) = ( 0.3962264 -0.1555274 0.7195580), wk = 0.0020790 k( 365) = ( 0.3915094 -0.1463606 0.7325350), wk = 0.0020790 k( 366) = ( 0.3867925 -0.1371938 0.7455119), wk = 0.0020790 k( 367) = ( 0.3820755 -0.1280270 0.7584889), wk = 0.0020790 k( 368) = ( 0.3773585 -0.1188602 0.7714658), wk = 0.0020790 k( 369) = ( 0.3726415 -0.1096934 0.7844427), wk = 0.0020790 k( 370) = ( 0.3679245 -0.1005266 0.7974197), wk = 0.0020790 k( 371) = ( 0.3632075 -0.0913598 0.8103966), wk = 0.0020790 k( 372) = ( 0.3584906 -0.0821930 0.8233735), wk = 0.0020790 k( 373) = ( 0.3537736 -0.0730262 0.8363505), wk = 0.0020790 k( 374) = ( 0.3490566 -0.0638594 0.8493274), wk = 0.0020790 k( 375) = ( 0.3443396 -0.0546927 0.8623043), wk = 0.0020790 k( 376) = ( 0.3396226 -0.0455259 0.8752813), wk = 0.0020790 k( 377) = ( 0.3349057 -0.0363591 0.8882582), wk = 0.0020790 k( 378) = ( 0.3301887 -0.0271923 0.9012351), wk = 0.0020790 k( 379) = ( 0.3254717 -0.0180255 0.9142121), wk = 0.0020790 k( 380) = ( 0.3207547 -0.0088587 0.9271890), wk = 0.0020790 k( 381) = ( 0.3160377 0.0003081 0.9401659), wk = 0.0020790 k( 382) = ( 0.3113207 0.0094749 0.9531429), wk = 0.0020790 k( 383) = ( 0.3066038 0.0186417 0.9661198), wk = 0.0020790 k( 384) = ( 0.3018868 0.0278085 0.9790967), wk = 0.0020790 k( 385) = ( 0.2971698 0.0369753 0.9920737), wk = 0.0020790 k( 386) = ( 0.2924528 0.0461421 1.0050506), wk = 0.0020790 k( 387) = ( 0.2877359 0.0553088 1.0180275), wk = 0.0020790 k( 388) = ( 0.2830189 0.0644756 1.0310045), wk = 0.0020790 k( 389) = ( 0.2783019 0.0736424 1.0439814), wk = 0.0020790 k( 390) = ( 0.2735849 0.0828092 1.0569583), wk = 0.0020790 k( 391) = ( 0.2688679 0.0919760 1.0699353), wk = 0.0020790 k( 392) = ( 0.2641509 0.1011428 1.0829122), wk = 0.0020790 k( 393) = ( 0.2594340 0.1103096 1.0958891), wk = 0.0020790 k( 394) = ( 0.2547170 0.1194764 1.1088661), wk = 0.0020790 k( 395) = ( 0.2500000 0.1286432 1.1218430), wk = 0.0020790 k( 396) = ( 0.0661963 -0.1286432 1.1218430), wk = 0.0020790 k( 397) = ( 0.0708710 -0.1377279 1.1089823), wk = 0.0020790 k( 398) = ( 0.0755457 -0.1468126 1.0961216), wk = 0.0020790 k( 399) = ( 0.0802205 -0.1558972 1.0832609), wk = 0.0020790 k( 400) = ( 0.0848952 -0.1649819 1.0704002), wk = 0.0020790 k( 401) = ( 0.0895699 -0.1740666 1.0575395), wk = 0.0020790 k( 402) = ( 0.0942447 -0.1831513 1.0446788), wk = 0.0020790 k( 403) = ( 0.0989194 -0.1922360 1.0318180), wk = 0.0020790 k( 404) = ( 0.1035941 -0.2013207 1.0189573), wk = 0.0020790 k( 405) = ( 0.1082689 -0.2104054 1.0060967), wk = 0.0020790 k( 406) = ( 0.1129436 -0.2194901 0.9932359), wk = 0.0020790 k( 407) = ( 0.1176183 -0.2285748 0.9803752), wk = 0.0020790 k( 408) = ( 0.1222931 -0.2376595 0.9675145), wk = 0.0020790 k( 409) = ( 0.1269678 -0.2467442 0.9546538), wk = 0.0020790 k( 410) = ( 0.1316425 -0.2558288 0.9417931), wk = 0.0020790 k( 411) = ( 0.1363173 -0.2649135 0.9289324), wk = 0.0020790 k( 412) = ( 0.1409920 -0.2739982 0.9160717), wk = 0.0020790 k( 413) = ( 0.1456667 -0.2830829 0.9032110), wk = 0.0020790 k( 414) = ( 0.1503415 -0.2921676 0.8903503), wk = 0.0020790 k( 415) = ( 0.1550162 -0.3012523 0.8774896), wk = 0.0020790 k( 416) = ( 0.1596909 -0.3103370 0.8646289), wk = 0.0020790 k( 417) = ( 0.1643657 -0.3194217 0.8517682), wk = 0.0020790 k( 418) = ( 0.1690404 -0.3285064 0.8389075), wk = 0.0020790 k( 419) = ( 0.1737152 -0.3375911 0.8260467), wk = 0.0020790 k( 420) = ( 0.1783899 -0.3466757 0.8131860), wk = 0.0020790 k( 421) = ( 0.1830646 -0.3557604 0.8003253), wk = 0.0020790 k( 422) = ( 0.1877393 -0.3648451 0.7874646), wk = 0.0020790 k( 423) = ( 0.1924141 -0.3739298 0.7746039), wk = 0.0020790 k( 424) = ( 0.1970888 -0.3830145 0.7617432), wk = 0.0020790 k( 425) = ( 0.2017636 -0.3920992 0.7488825), wk = 0.0020790 k( 426) = ( 0.2064383 -0.4011839 0.7360218), wk = 0.0020790 k( 427) = ( 0.2111130 -0.4102686 0.7231611), wk = 0.0020790 k( 428) = ( 0.2157878 -0.4193533 0.7103004), wk = 0.0020790 k( 429) = ( 0.2204625 -0.4284380 0.6974397), wk = 0.0020790 k( 430) = ( 0.2251372 -0.4375227 0.6845790), wk = 0.0020790 k( 431) = ( 0.2298119 -0.4466073 0.6717183), wk = 0.0020790 k( 432) = ( 0.2344867 -0.4556920 0.6588576), wk = 0.0020790 k( 433) = ( 0.2391614 -0.4647767 0.6459969), wk = 0.0020790 k( 434) = ( 0.2438362 -0.4738614 0.6331362), wk = 0.0020790 k( 435) = ( 0.2485109 -0.4829461 0.6202754), wk = 0.0020790 k( 436) = ( 0.2531856 -0.4920308 0.6074147), wk = 0.0020790 k( 437) = ( 0.2578604 -0.5011155 0.5945540), wk = 0.0020790 k( 438) = ( 0.2625351 -0.5102002 0.5816933), wk = 0.0020790 k( 439) = ( 0.2672098 -0.5192849 0.5688326), wk = 0.0020790 k( 440) = ( 0.2718846 -0.5283696 0.5559719), wk = 0.0020790 k( 441) = ( 0.2765593 -0.5374542 0.5431112), wk = 0.0020790 k( 442) = ( 0.2812340 -0.5465389 0.5302505), wk = 0.0020790 k( 443) = ( 0.2859088 -0.5556236 0.5173898), wk = 0.0020790 k( 444) = ( 0.2905835 -0.5647083 0.5045291), wk = 0.0020790 k( 445) = ( 0.7094165 -0.1496853 0.3636019), wk = 0.0020790 k( 446) = ( 0.7035994 -0.1383805 0.3535019), wk = 0.0020790 k( 447) = ( 0.6977823 -0.1270758 0.3434018), wk = 0.0020790 k( 448) = ( 0.6919651 -0.1157710 0.3333018), wk = 0.0020790 k( 449) = ( 0.6861480 -0.1044662 0.3232017), wk = 0.0020790 k( 450) = ( 0.6803309 -0.0931614 0.3131017), wk = 0.0020790 k( 451) = ( 0.6745138 -0.0818567 0.3030016), wk = 0.0020790 k( 452) = ( 0.6686966 -0.0705519 0.2929016), wk = 0.0020790 k( 453) = ( 0.6628795 -0.0592472 0.2828015), wk = 0.0020790 k( 454) = ( 0.6570624 -0.0479424 0.2727014), wk = 0.0020790 k( 455) = ( 0.6512453 -0.0366376 0.2626014), wk = 0.0020790 k( 456) = ( 0.6454281 -0.0253328 0.2525013), wk = 0.0020790 k( 457) = ( 0.6396110 -0.0140281 0.2424013), wk = 0.0020790 k( 458) = ( 0.6337939 -0.0027233 0.2323012), wk = 0.0020790 k( 459) = ( 0.6279768 0.0085815 0.2222012), wk = 0.0020790 k( 460) = ( 0.6221596 0.0198862 0.2121011), wk = 0.0020790 k( 461) = ( 0.6163425 0.0311910 0.2020011), wk = 0.0020790 k( 462) = ( 0.6105254 0.0424958 0.1919010), wk = 0.0020790 k( 463) = ( 0.6047082 0.0538005 0.1818010), wk = 0.0020790 k( 464) = ( 0.5988911 0.0651053 0.1717009), wk = 0.0020790 k( 465) = ( 0.5930740 0.0764101 0.1616009), wk = 0.0020790 k( 466) = ( 0.5872569 0.0877148 0.1515008), wk = 0.0020790 k( 467) = ( 0.5814398 0.0990196 0.1414007), wk = 0.0020790 k( 468) = ( 0.5756226 0.1103244 0.1313007), wk = 0.0020790 k( 469) = ( 0.5698055 0.1216291 0.1212006), wk = 0.0020790 k( 470) = ( 0.5639884 0.1329339 0.1111006), wk = 0.0020790 k( 471) = ( 0.5581713 0.1442387 0.1010005), wk = 0.0020790 k( 472) = ( 0.5523541 0.1555434 0.0909005), wk = 0.0020790 k( 473) = ( 0.5465370 0.1668482 0.0808004), wk = 0.0020790 k( 474) = ( 0.5407199 0.1781530 0.0707004), wk = 0.0020790 k( 475) = ( 0.5349027 0.1894578 0.0606003), wk = 0.0020790 k( 476) = ( 0.5290856 0.2007625 0.0505003), wk = 0.0020790 k( 477) = ( 0.5232685 0.2120673 0.0404002), wk = 0.0020790 k( 478) = ( 0.5174514 0.2233720 0.0303002), wk = 0.0020790 k( 479) = ( 0.5116342 0.2346768 0.0202001), wk = 0.0020790 k( 480) = ( 0.5058171 0.2459816 0.0101001), wk = 0.0020790 k( 481) = ( 0.5000000 0.2572864 0.0000000), wk = 0.0020790 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020790 k( 2) = ( -0.0046714 0.0046714 0.0046714), wk = 0.0020790 k( 3) = ( -0.0093428 0.0093428 0.0093428), wk = 0.0020790 k( 4) = ( -0.0140142 0.0140142 0.0140142), wk = 0.0020790 k( 5) = ( -0.0186856 0.0186856 0.0186856), wk = 0.0020790 k( 6) = ( -0.0233570 0.0233570 0.0233570), wk = 0.0020790 k( 7) = ( -0.0280284 0.0280284 0.0280284), wk = 0.0020790 k( 8) = ( -0.0326998 0.0326998 0.0326998), wk = 0.0020790 k( 9) = ( -0.0373712 0.0373712 0.0373712), wk = 0.0020790 k( 10) = ( -0.0420426 0.0420426 0.0420426), wk = 0.0020790 k( 11) = ( -0.0467140 0.0467140 0.0467140), wk = 0.0020790 k( 12) = ( -0.0513854 0.0513854 0.0513854), wk = 0.0020790 k( 13) = ( -0.0560568 0.0560568 0.0560568), wk = 0.0020790 k( 14) = ( -0.0607282 0.0607282 0.0607282), wk = 0.0020790 k( 15) = ( -0.0653996 0.0653996 0.0653996), wk = 0.0020790 k( 16) = ( -0.0700710 0.0700710 0.0700710), wk = 0.0020790 k( 17) = ( -0.0747425 0.0747425 0.0747425), wk = 0.0020790 k( 18) = ( -0.0794138 0.0794139 0.0794138), wk = 0.0020790 k( 19) = ( -0.0840853 0.0840853 0.0840853), wk = 0.0020790 k( 20) = ( -0.0887567 0.0887567 0.0887567), wk = 0.0020790 k( 21) = ( -0.0934281 0.0934281 0.0934281), wk = 0.0020790 k( 22) = ( -0.0980995 0.0980995 0.0980995), wk = 0.0020790 k( 23) = ( -0.1027709 0.1027709 0.1027709), wk = 0.0020790 k( 24) = ( -0.1074423 0.1074423 0.1074423), wk = 0.0020790 k( 25) = ( -0.1121137 0.1121137 0.1121137), wk = 0.0020790 k( 26) = ( -0.1167851 0.1167851 0.1167851), wk = 0.0020790 k( 27) = ( -0.1214565 0.1214565 0.1214565), wk = 0.0020790 k( 28) = ( -0.1261279 0.1261279 0.1261279), wk = 0.0020790 k( 29) = ( -0.1307993 0.1307993 0.1307993), wk = 0.0020790 k( 30) = ( -0.1354707 0.1354707 0.1354707), wk = 0.0020790 k( 31) = ( -0.1401421 0.1401421 0.1401421), wk = 0.0020790 k( 32) = ( -0.1448135 0.1448135 0.1448135), wk = 0.0020790 k( 33) = ( -0.1494849 0.1494849 0.1494849), wk = 0.0020790 k( 34) = ( -0.1541563 0.1541563 0.1541563), wk = 0.0020790 k( 35) = ( -0.1588277 0.1588277 0.1588277), wk = 0.0020790 k( 36) = ( -0.1634991 0.1634991 0.1634991), wk = 0.0020790 k( 37) = ( -0.1681705 0.1681705 0.1681705), wk = 0.0020790 k( 38) = ( -0.1728419 0.1728419 0.1728419), wk = 0.0020790 k( 39) = ( -0.1775133 0.1775133 0.1775133), wk = 0.0020790 k( 40) = ( -0.1821847 0.1821847 0.1821847), wk = 0.0020790 k( 41) = ( -0.1868561 0.1868561 0.1868561), wk = 0.0020790 k( 42) = ( -0.1915275 0.1915275 0.1915275), wk = 0.0020790 k( 43) = ( -0.1961989 0.1961989 0.1961989), wk = 0.0020790 k( 44) = ( -0.2008703 0.2008703 0.2008703), wk = 0.0020790 k( 45) = ( -0.2055417 0.2055417 0.2055417), wk = 0.0020790 k( 46) = ( -0.2102131 0.2102131 0.2102131), wk = 0.0020790 k( 47) = ( -0.2148845 0.2148845 0.2148845), wk = 0.0020790 k( 48) = ( -0.2195559 0.2195559 0.2195559), wk = 0.0020790 k( 49) = ( -0.2242273 0.2242273 0.2242274), wk = 0.0020790 k( 50) = ( -0.2288988 0.2288987 0.2288988), wk = 0.0020790 k( 51) = ( -0.2335702 0.2335702 0.2335702), wk = 0.0020790 k( 52) = ( -0.2382416 0.2382416 0.2382416), wk = 0.0020790 k( 53) = ( -0.2429130 0.2429130 0.2429130), wk = 0.0020790 k( 54) = ( -0.2475844 0.2475844 0.2475844), wk = 0.0020790 k( 55) = ( -0.2522558 0.2522558 0.2522558), wk = 0.0020790 k( 56) = ( -0.2569272 0.2569272 0.2569272), wk = 0.0020790 k( 57) = ( -0.2615986 0.2615986 0.2615986), wk = 0.0020790 k( 58) = ( -0.2662700 0.2662700 0.2662700), wk = 0.0020790 k( 59) = ( -0.2709414 0.2709414 0.2709414), wk = 0.0020790 k( 60) = ( -0.2756128 0.2756128 0.2756128), wk = 0.0020790 k( 61) = ( -0.2756128 0.2756128 0.2756128), wk = 0.0020790 k( 62) = ( -0.2697956 0.2697956 0.2814299), wk = 0.0020790 k( 63) = ( -0.2639785 0.2639785 0.2872470), wk = 0.0020790 k( 64) = ( -0.2581614 0.2581614 0.2930642), wk = 0.0020790 k( 65) = ( -0.2523443 0.2523443 0.2988813), wk = 0.0020790 k( 66) = ( -0.2465272 0.2465271 0.3046984), wk = 0.0020790 k( 67) = ( -0.2407100 0.2407100 0.3105155), wk = 0.0020790 k( 68) = ( -0.2348929 0.2348929 0.3163327), wk = 0.0020790 k( 69) = ( -0.2290758 0.2290758 0.3221498), wk = 0.0020790 k( 70) = ( -0.2232587 0.2232586 0.3279669), wk = 0.0020790 k( 71) = ( -0.2174415 0.2174415 0.3337840), wk = 0.0020790 k( 72) = ( -0.2116244 0.2116244 0.3396012), wk = 0.0020790 k( 73) = ( -0.2058073 0.2058073 0.3454183), wk = 0.0020790 k( 74) = ( -0.1999902 0.1999901 0.3512354), wk = 0.0020790 k( 75) = ( -0.1941730 0.1941730 0.3570525), wk = 0.0020790 k( 76) = ( -0.1883559 0.1883559 0.3628697), wk = 0.0020790 k( 77) = ( -0.1825388 0.1825388 0.3686868), wk = 0.0020790 k( 78) = ( -0.1767217 0.1767216 0.3745039), wk = 0.0020790 k( 79) = ( -0.1709045 0.1709045 0.3803210), wk = 0.0020790 k( 80) = ( -0.1650874 0.1650874 0.3861382), wk = 0.0020790 k( 81) = ( -0.1592703 0.1592703 0.3919553), wk = 0.0020790 k( 82) = ( -0.1534532 0.1534532 0.3977724), wk = 0.0020790 k( 83) = ( -0.1476360 0.1476360 0.4035895), wk = 0.0020790 k( 84) = ( -0.1418189 0.1418189 0.4094067), wk = 0.0020790 k( 85) = ( -0.1360018 0.1360018 0.4152238), wk = 0.0020790 k( 86) = ( -0.1301847 0.1301846 0.4210409), wk = 0.0020790 k( 87) = ( -0.1243675 0.1243675 0.4268580), wk = 0.0020790 k( 88) = ( -0.1185504 0.1185504 0.4326752), wk = 0.0020790 k( 89) = ( -0.1127333 0.1127333 0.4384923), wk = 0.0020790 k( 90) = ( -0.1069162 0.1069161 0.4443094), wk = 0.0020790 k( 91) = ( -0.1010990 0.1010990 0.4501265), wk = 0.0020790 k( 92) = ( -0.0952819 0.0952819 0.4559437), wk = 0.0020790 k( 93) = ( -0.0894648 0.0894648 0.4617608), wk = 0.0020790 k( 94) = ( -0.0836477 0.0836476 0.4675779), wk = 0.0020790 k( 95) = ( -0.0778305 0.0778305 0.4733950), wk = 0.0020790 k( 96) = ( -0.0720134 0.0720134 0.4792122), wk = 0.0020790 k( 97) = ( -0.0661963 0.0661963 0.4850293), wk = 0.0020790 k( 98) = ( -0.0661963 0.0661963 0.4850293), wk = 0.0020790 k( 99) = ( -0.0588411 0.0588411 0.4866927), wk = 0.0020790 k( 100) = ( -0.0514860 0.0514860 0.4883561), wk = 0.0020790 k( 101) = ( -0.0441308 0.0441308 0.4900195), wk = 0.0020790 k( 102) = ( -0.0367757 0.0367757 0.4916829), wk = 0.0020790 k( 103) = ( -0.0294206 0.0294206 0.4933464), wk = 0.0020790 k( 104) = ( -0.0220654 0.0220654 0.4950098), wk = 0.0020790 k( 105) = ( -0.0147103 0.0147103 0.4966732), wk = 0.0020790 k( 106) = ( -0.0073551 0.0073551 0.4983366), wk = 0.0020790 k( 107) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020790 k( 108) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020790 k( 109) = ( 0.0147059 0.0147059 0.4852941), wk = 0.0020790 k( 110) = ( 0.0294118 0.0294118 0.4705882), wk = 0.0020790 k( 111) = ( 0.0441177 0.0441176 0.4558823), wk = 0.0020790 k( 112) = ( 0.0588235 0.0588235 0.4411765), wk = 0.0020790 k( 113) = ( 0.0735294 0.0735294 0.4264706), wk = 0.0020790 k( 114) = ( 0.0882353 0.0882353 0.4117647), wk = 0.0020790 k( 115) = ( 0.1029412 0.1029412 0.3970588), wk = 0.0020790 k( 116) = ( 0.1176471 0.1176471 0.3823529), wk = 0.0020790 k( 117) = ( 0.1323529 0.1323529 0.3676471), wk = 0.0020790 k( 118) = ( 0.1470588 0.1470588 0.3529412), wk = 0.0020790 k( 119) = ( 0.1617647 0.1617647 0.3382353), wk = 0.0020790 k( 120) = ( 0.1764706 0.1764706 0.3235294), wk = 0.0020790 k( 121) = ( 0.1911765 0.1911765 0.3088235), wk = 0.0020790 k( 122) = ( 0.2058823 0.2058823 0.2941177), wk = 0.0020790 k( 123) = ( 0.2205882 0.2205882 0.2794118), wk = 0.0020790 k( 124) = ( 0.2352941 0.2352941 0.2647059), wk = 0.0020790 k( 125) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0020790 k( 126) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0020790 k( 127) = ( 0.2440476 0.2559524 0.2440476), wk = 0.0020790 k( 128) = ( 0.2380952 0.2619048 0.2380952), wk = 0.0020790 k( 129) = ( 0.2321429 0.2678571 0.2321429), wk = 0.0020790 k( 130) = ( 0.2261905 0.2738095 0.2261905), wk = 0.0020790 k( 131) = ( 0.2202381 0.2797619 0.2202381), wk = 0.0020790 k( 132) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0020790 k( 133) = ( 0.2083333 0.2916667 0.2083333), wk = 0.0020790 k( 134) = ( 0.2023810 0.2976190 0.2023809), wk = 0.0020790 k( 135) = ( 0.1964286 0.3035714 0.1964286), wk = 0.0020790 k( 136) = ( 0.1904762 0.3095238 0.1904762), wk = 0.0020790 k( 137) = ( 0.1845238 0.3154762 0.1845238), wk = 0.0020790 k( 138) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0020790 k( 139) = ( 0.1726190 0.3273810 0.1726191), wk = 0.0020790 k( 140) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0020790 k( 141) = ( 0.1607143 0.3392857 0.1607143), wk = 0.0020790 k( 142) = ( 0.1547619 0.3452381 0.1547619), wk = 0.0020790 k( 143) = ( 0.1488095 0.3511905 0.1488095), wk = 0.0020790 k( 144) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0020790 k( 145) = ( 0.1369048 0.3630952 0.1369048), wk = 0.0020790 k( 146) = ( 0.1309524 0.3690476 0.1309524), wk = 0.0020790 k( 147) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0020790 k( 148) = ( 0.1190476 0.3809524 0.1190476), wk = 0.0020790 k( 149) = ( 0.1130952 0.3869048 0.1130952), wk = 0.0020790 k( 150) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0020790 k( 151) = ( 0.1011905 0.3988095 0.1011905), wk = 0.0020790 k( 152) = ( 0.0952381 0.4047619 0.0952381), wk = 0.0020790 k( 153) = ( 0.0892857 0.4107143 0.0892857), wk = 0.0020790 k( 154) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0020790 k( 155) = ( 0.0773810 0.4226190 0.0773810), wk = 0.0020790 k( 156) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0020790 k( 157) = ( 0.0654762 0.4345238 0.0654762), wk = 0.0020790 k( 158) = ( 0.0595238 0.4404762 0.0595238), wk = 0.0020790 k( 159) = ( 0.0535714 0.4464286 0.0535714), wk = 0.0020790 k( 160) = ( 0.0476191 0.4523810 0.0476190), wk = 0.0020790 k( 161) = ( 0.0416667 0.4583333 0.0416667), wk = 0.0020790 k( 162) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0020790 k( 163) = ( 0.0297619 0.4702381 0.0297619), wk = 0.0020790 k( 164) = ( 0.0238095 0.4761905 0.0238095), wk = 0.0020790 k( 165) = ( 0.0178571 0.4821429 0.0178571), wk = 0.0020790 k( 166) = ( 0.0119048 0.4880952 0.0119048), wk = 0.0020790 k( 167) = ( 0.0059524 0.4940476 0.0059524), wk = 0.0020790 k( 168) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0020790 k( 169) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0020790 k( 170) = ( 0.0153118 0.5124660 -0.0153118), wk = 0.0020790 k( 171) = ( 0.0306236 0.5249319 -0.0306236), wk = 0.0020790 k( 172) = ( 0.0459355 0.5373979 -0.0459355), wk = 0.0020790 k( 173) = ( 0.0612473 0.5498638 -0.0612473), wk = 0.0020790 k( 174) = ( 0.0765591 0.5623298 -0.0765591), wk = 0.0020790 k( 175) = ( 0.0918709 0.5747957 -0.0918709), wk = 0.0020790 k( 176) = ( 0.1071827 0.5872617 -0.1071827), wk = 0.0020790 k( 177) = ( 0.1224946 0.5997276 -0.1224946), wk = 0.0020790 k( 178) = ( 0.1378064 0.6121936 -0.1378064), wk = 0.0020790 k( 179) = ( 0.1531182 0.6246596 -0.1531182), wk = 0.0020790 k( 180) = ( 0.1684300 0.6371255 -0.1684300), wk = 0.0020790 k( 181) = ( 0.1837419 0.6495915 -0.1837418), wk = 0.0020790 k( 182) = ( 0.1990537 0.6620574 -0.1990537), wk = 0.0020790 k( 183) = ( 0.2143655 0.6745234 -0.2143655), wk = 0.0020790 k( 184) = ( 0.2296773 0.6869894 -0.2296773), wk = 0.0020790 k( 185) = ( 0.2449891 0.6994553 -0.2449891), wk = 0.0020790 k( 186) = ( 0.2603010 0.7119213 -0.2603010), wk = 0.0020790 k( 187) = ( 0.2756128 0.7243872 -0.2756128), wk = 0.0020790 k( 188) = ( 0.2756128 0.7243872 -0.2756128), wk = 0.0020790 k( 189) = ( 0.2802875 0.7197125 -0.2802875), wk = 0.0020790 k( 190) = ( 0.2849622 0.7150377 -0.2849622), wk = 0.0020790 k( 191) = ( 0.2896370 0.7103630 -0.2896370), wk = 0.0020790 k( 192) = ( 0.2943117 0.7056883 -0.2943117), wk = 0.0020790 k( 193) = ( 0.2989865 0.7010135 -0.2989865), wk = 0.0020790 k( 194) = ( 0.3036612 0.6963388 -0.3036612), wk = 0.0020790 k( 195) = ( 0.3083359 0.6916641 -0.3083359), wk = 0.0020790 k( 196) = ( 0.3130107 0.6869893 -0.3130107), wk = 0.0020790 k( 197) = ( 0.3176854 0.6823146 -0.3176854), wk = 0.0020790 k( 198) = ( 0.3223601 0.6776399 -0.3223601), wk = 0.0020790 k( 199) = ( 0.3270348 0.6729652 -0.3270348), wk = 0.0020790 k( 200) = ( 0.3317096 0.6682904 -0.3317096), wk = 0.0020790 k( 201) = ( 0.3363843 0.6636157 -0.3363843), wk = 0.0020790 k( 202) = ( 0.3410590 0.6589409 -0.3410590), wk = 0.0020790 k( 203) = ( 0.3457338 0.6542662 -0.3457338), wk = 0.0020790 k( 204) = ( 0.3504085 0.6495915 -0.3504085), wk = 0.0020790 k( 205) = ( 0.3550833 0.6449167 -0.3550833), wk = 0.0020790 k( 206) = ( 0.3597580 0.6402420 -0.3597580), wk = 0.0020790 k( 207) = ( 0.3644327 0.6355673 -0.3644327), wk = 0.0020790 k( 208) = ( 0.3691075 0.6308925 -0.3691075), wk = 0.0020790 k( 209) = ( 0.3737822 0.6262178 -0.3737822), wk = 0.0020790 k( 210) = ( 0.3784569 0.6215431 -0.3784569), wk = 0.0020790 k( 211) = ( 0.3831317 0.6168683 -0.3831317), wk = 0.0020790 k( 212) = ( 0.3878064 0.6121936 -0.3878064), wk = 0.0020790 k( 213) = ( 0.3924811 0.6075189 -0.3924811), wk = 0.0020790 k( 214) = ( 0.3971559 0.6028441 -0.3971559), wk = 0.0020790 k( 215) = ( 0.4018306 0.5981694 -0.4018306), wk = 0.0020790 k( 216) = ( 0.4065053 0.5934947 -0.4065053), wk = 0.0020790 k( 217) = ( 0.4111801 0.5888199 -0.4111801), wk = 0.0020790 k( 218) = ( 0.4158548 0.5841452 -0.4158548), wk = 0.0020790 k( 219) = ( 0.4205295 0.5794705 -0.4205295), wk = 0.0020790 k( 220) = ( 0.4252043 0.5747957 -0.4252043), wk = 0.0020790 k( 221) = ( 0.4298790 0.5701210 -0.4298790), wk = 0.0020790 k( 222) = ( 0.4345537 0.5654463 -0.4345537), wk = 0.0020790 k( 223) = ( 0.4392285 0.5607715 -0.4392285), wk = 0.0020790 k( 224) = ( 0.4439032 0.5560968 -0.4439032), wk = 0.0020790 k( 225) = ( 0.4485779 0.5514221 -0.4485779), wk = 0.0020790 k( 226) = ( 0.4532527 0.5467473 -0.4532527), wk = 0.0020790 k( 227) = ( 0.4579274 0.5420726 -0.4579274), wk = 0.0020790 k( 228) = ( 0.4626021 0.5373979 -0.4626021), wk = 0.0020790 k( 229) = ( 0.4672769 0.5327231 -0.4672769), wk = 0.0020790 k( 230) = ( 0.4719516 0.5280484 -0.4719516), wk = 0.0020790 k( 231) = ( 0.4766263 0.5233737 -0.4766263), wk = 0.0020790 k( 232) = ( 0.4813011 0.5186989 -0.4813011), wk = 0.0020790 k( 233) = ( 0.4859758 0.5140242 -0.4859758), wk = 0.0020790 k( 234) = ( 0.4906505 0.5093495 -0.4906505), wk = 0.0020790 k( 235) = ( 0.4953253 0.5046747 -0.4953253), wk = 0.0020790 k( 236) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0020790 k( 237) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0020790 k( 238) = ( 0.4852941 0.4852941 -0.4852941), wk = 0.0020790 k( 239) = ( 0.4705882 0.4705882 -0.4705882), wk = 0.0020790 k( 240) = ( 0.4558823 0.4558823 -0.4558823), wk = 0.0020790 k( 241) = ( 0.4411765 0.4411765 -0.4411765), wk = 0.0020790 k( 242) = ( 0.4264706 0.4264706 -0.4264706), wk = 0.0020790 k( 243) = ( 0.4117647 0.4117647 -0.4117647), wk = 0.0020790 k( 244) = ( 0.3970588 0.3970588 -0.3970588), wk = 0.0020790 k( 245) = ( 0.3823529 0.3823529 -0.3823529), wk = 0.0020790 k( 246) = ( 0.3676471 0.3676471 -0.3676471), wk = 0.0020790 k( 247) = ( 0.3529412 0.3529412 -0.3529412), wk = 0.0020790 k( 248) = ( 0.3382353 0.3382353 -0.3382353), wk = 0.0020790 k( 249) = ( 0.3235294 0.3235294 -0.3235294), wk = 0.0020790 k( 250) = ( 0.3088235 0.3088235 -0.3088235), wk = 0.0020790 k( 251) = ( 0.2941177 0.2941177 -0.2941177), wk = 0.0020790 k( 252) = ( 0.2794118 0.2794118 -0.2794118), wk = 0.0020790 k( 253) = ( 0.2647059 0.2647059 -0.2647059), wk = 0.0020790 k( 254) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0020790 k( 255) = ( 0.2352941 0.2352941 -0.2352941), wk = 0.0020790 k( 256) = ( 0.2205882 0.2205882 -0.2205882), wk = 0.0020790 k( 257) = ( 0.2058823 0.2058823 -0.2058823), wk = 0.0020790 k( 258) = ( 0.1911765 0.1911765 -0.1911765), wk = 0.0020790 k( 259) = ( 0.1764706 0.1764706 -0.1764706), wk = 0.0020790 k( 260) = ( 0.1617647 0.1617647 -0.1617647), wk = 0.0020790 k( 261) = ( 0.1470588 0.1470588 -0.1470588), wk = 0.0020790 k( 262) = ( 0.1323529 0.1323529 -0.1323529), wk = 0.0020790 k( 263) = ( 0.1176471 0.1176471 -0.1176471), wk = 0.0020790 k( 264) = ( 0.1029412 0.1029412 -0.1029412), wk = 0.0020790 k( 265) = ( 0.0882353 0.0882353 -0.0882353), wk = 0.0020790 k( 266) = ( 0.0735294 0.0735294 -0.0735294), wk = 0.0020790 k( 267) = ( 0.0588235 0.0588235 -0.0588235), wk = 0.0020790 k( 268) = ( 0.0441177 0.0441176 -0.0441177), wk = 0.0020790 k( 269) = ( 0.0294118 0.0294118 -0.0294118), wk = 0.0020790 k( 270) = ( 0.0147059 0.0147059 -0.0147059), wk = 0.0020790 k( 271) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020790 k( 272) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020790 k( 273) = ( 0.0059303 -0.0059303 0.0059303), wk = 0.0020790 k( 274) = ( 0.0118605 -0.0118605 0.0118605), wk = 0.0020790 k( 275) = ( 0.0177908 -0.0177908 0.0177908), wk = 0.0020790 k( 276) = ( 0.0237211 -0.0237211 0.0237211), wk = 0.0020790 k( 277) = ( 0.0296514 -0.0296514 0.0296514), wk = 0.0020790 k( 278) = ( 0.0355816 -0.0355816 0.0355816), wk = 0.0020790 k( 279) = ( 0.0415119 -0.0415119 0.0415119), wk = 0.0020790 k( 280) = ( 0.0474422 -0.0474422 0.0474422), wk = 0.0020790 k( 281) = ( 0.0533725 -0.0533725 0.0533725), wk = 0.0020790 k( 282) = ( 0.0593028 -0.0593027 0.0593027), wk = 0.0020790 k( 283) = ( 0.0652330 -0.0652330 0.0652330), wk = 0.0020790 k( 284) = ( 0.0711633 -0.0711633 0.0711633), wk = 0.0020790 k( 285) = ( 0.0770936 -0.0770936 0.0770936), wk = 0.0020790 k( 286) = ( 0.0830238 -0.0830238 0.0830238), wk = 0.0020790 k( 287) = ( 0.0889541 -0.0889541 0.0889541), wk = 0.0020790 k( 288) = ( 0.0948844 -0.0948844 0.0948844), wk = 0.0020790 k( 289) = ( 0.1008147 -0.1008147 0.1008147), wk = 0.0020790 k( 290) = ( 0.1067450 -0.1067450 0.1067450), wk = 0.0020790 k( 291) = ( 0.1126752 -0.1126752 0.1126752), wk = 0.0020790 k( 292) = ( 0.1186055 -0.1186055 0.1186055), wk = 0.0020790 k( 293) = ( 0.1245358 -0.1245358 0.1245358), wk = 0.0020790 k( 294) = ( 0.1304661 -0.1304661 0.1304661), wk = 0.0020790 k( 295) = ( 0.1363963 -0.1363963 0.1363963), wk = 0.0020790 k( 296) = ( 0.1423266 -0.1423266 0.1423266), wk = 0.0020790 k( 297) = ( 0.1482569 -0.1482569 0.1482569), wk = 0.0020790 k( 298) = ( 0.1541872 -0.1541872 0.1541872), wk = 0.0020790 k( 299) = ( 0.1601174 -0.1601174 0.1601174), wk = 0.0020790 k( 300) = ( 0.1660477 -0.1660477 0.1660477), wk = 0.0020790 k( 301) = ( 0.1719780 -0.1719780 0.1719780), wk = 0.0020790 k( 302) = ( 0.1779083 -0.1779083 0.1779083), wk = 0.0020790 k( 303) = ( 0.1838385 -0.1838385 0.1838385), wk = 0.0020790 k( 304) = ( 0.1897688 -0.1897688 0.1897688), wk = 0.0020790 k( 305) = ( 0.1956991 -0.1956991 0.1956991), wk = 0.0020790 k( 306) = ( 0.2016294 -0.2016294 0.2016294), wk = 0.0020790 k( 307) = ( 0.2075596 -0.2075596 0.2075596), wk = 0.0020790 k( 308) = ( 0.2134899 -0.2134899 0.2134899), wk = 0.0020790 k( 309) = ( 0.2194202 -0.2194202 0.2194202), wk = 0.0020790 k( 310) = ( 0.2253505 -0.2253505 0.2253505), wk = 0.0020790 k( 311) = ( 0.2312807 -0.2312807 0.2312807), wk = 0.0020790 k( 312) = ( 0.2372110 -0.2372110 0.2372110), wk = 0.0020790 k( 313) = ( 0.2431413 -0.2431413 0.2431413), wk = 0.0020790 k( 314) = ( 0.2490716 -0.2490716 0.2490716), wk = 0.0020790 k( 315) = ( 0.2550018 -0.2550018 0.2550018), wk = 0.0020790 k( 316) = ( 0.2609321 -0.2609321 0.2609321), wk = 0.0020790 k( 317) = ( 0.2668624 -0.2668624 0.2668624), wk = 0.0020790 k( 318) = ( 0.2727927 -0.2727927 0.2727927), wk = 0.0020790 k( 319) = ( 0.2787229 -0.2787229 0.2787229), wk = 0.0020790 k( 320) = ( 0.2846532 -0.2846532 0.2846532), wk = 0.0020790 k( 321) = ( 0.2905835 -0.2905835 0.2905835), wk = 0.0020790 k( 322) = ( 0.2905835 -0.2905835 0.2905835), wk = 0.0020790 k( 323) = ( 0.3016054 -0.2752896 0.2752896), wk = 0.0020790 k( 324) = ( 0.3126273 -0.2599958 0.2599958), wk = 0.0020790 k( 325) = ( 0.3236493 -0.2447019 0.2447019), wk = 0.0020790 k( 326) = ( 0.3346712 -0.2294080 0.2294080), wk = 0.0020790 k( 327) = ( 0.3456931 -0.2141141 0.2141141), wk = 0.0020790 k( 328) = ( 0.3567150 -0.1988203 0.1988203), wk = 0.0020790 k( 329) = ( 0.3677369 -0.1835264 0.1835264), wk = 0.0020790 k( 330) = ( 0.3787589 -0.1682325 0.1682325), wk = 0.0020790 k( 331) = ( 0.3897808 -0.1529387 0.1529387), wk = 0.0020790 k( 332) = ( 0.4008027 -0.1376448 0.1376448), wk = 0.0020790 k( 333) = ( 0.4118246 -0.1223509 0.1223509), wk = 0.0020790 k( 334) = ( 0.4228465 -0.1070571 0.1070571), wk = 0.0020790 k( 335) = ( 0.4338685 -0.0917632 0.0917632), wk = 0.0020790 k( 336) = ( 0.4448904 -0.0764693 0.0764693), wk = 0.0020790 k( 337) = ( 0.4559123 -0.0611755 0.0611755), wk = 0.0020790 k( 338) = ( 0.4669342 -0.0458816 0.0458816), wk = 0.0020790 k( 339) = ( 0.4779562 -0.0305877 0.0305877), wk = 0.0020790 k( 340) = ( 0.4889781 -0.0152939 0.0152939), wk = 0.0020790 k( 341) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0020790 k( 342) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0020790 k( 343) = ( 0.4952830 0.0047170 0.0047170), wk = 0.0020790 k( 344) = ( 0.4905660 0.0094340 0.0094340), wk = 0.0020790 k( 345) = ( 0.4858491 0.0141509 0.0141509), wk = 0.0020790 k( 346) = ( 0.4811321 0.0188679 0.0188679), wk = 0.0020790 k( 347) = ( 0.4764151 0.0235849 0.0235849), wk = 0.0020790 k( 348) = ( 0.4716981 0.0283019 0.0283019), wk = 0.0020790 k( 349) = ( 0.4669811 0.0330189 0.0330189), wk = 0.0020790 k( 350) = ( 0.4622641 0.0377359 0.0377358), wk = 0.0020790 k( 351) = ( 0.4575472 0.0424528 0.0424528), wk = 0.0020790 k( 352) = ( 0.4528302 0.0471698 0.0471698), wk = 0.0020790 k( 353) = ( 0.4481132 0.0518868 0.0518868), wk = 0.0020790 k( 354) = ( 0.4433962 0.0566038 0.0566038), wk = 0.0020790 k( 355) = ( 0.4386793 0.0613208 0.0613207), wk = 0.0020790 k( 356) = ( 0.4339623 0.0660377 0.0660377), wk = 0.0020790 k( 357) = ( 0.4292453 0.0707547 0.0707547), wk = 0.0020790 k( 358) = ( 0.4245283 0.0754717 0.0754717), wk = 0.0020790 k( 359) = ( 0.4198113 0.0801887 0.0801887), wk = 0.0020790 k( 360) = ( 0.4150943 0.0849057 0.0849057), wk = 0.0020790 k( 361) = ( 0.4103774 0.0896226 0.0896226), wk = 0.0020790 k( 362) = ( 0.4056604 0.0943396 0.0943396), wk = 0.0020790 k( 363) = ( 0.4009434 0.0990566 0.0990566), wk = 0.0020790 k( 364) = ( 0.3962264 0.1037736 0.1037736), wk = 0.0020790 k( 365) = ( 0.3915094 0.1084906 0.1084906), wk = 0.0020790 k( 366) = ( 0.3867925 0.1132076 0.1132075), wk = 0.0020790 k( 367) = ( 0.3820755 0.1179245 0.1179245), wk = 0.0020790 k( 368) = ( 0.3773585 0.1226415 0.1226415), wk = 0.0020790 k( 369) = ( 0.3726415 0.1273585 0.1273585), wk = 0.0020790 k( 370) = ( 0.3679245 0.1320755 0.1320755), wk = 0.0020790 k( 371) = ( 0.3632075 0.1367925 0.1367924), wk = 0.0020790 k( 372) = ( 0.3584906 0.1415094 0.1415094), wk = 0.0020790 k( 373) = ( 0.3537736 0.1462264 0.1462264), wk = 0.0020790 k( 374) = ( 0.3490566 0.1509434 0.1509434), wk = 0.0020790 k( 375) = ( 0.3443396 0.1556604 0.1556604), wk = 0.0020790 k( 376) = ( 0.3396226 0.1603774 0.1603774), wk = 0.0020790 k( 377) = ( 0.3349057 0.1650943 0.1650943), wk = 0.0020790 k( 378) = ( 0.3301887 0.1698113 0.1698113), wk = 0.0020790 k( 379) = ( 0.3254717 0.1745283 0.1745283), wk = 0.0020790 k( 380) = ( 0.3207547 0.1792453 0.1792453), wk = 0.0020790 k( 381) = ( 0.3160377 0.1839623 0.1839623), wk = 0.0020790 k( 382) = ( 0.3113207 0.1886792 0.1886792), wk = 0.0020790 k( 383) = ( 0.3066038 0.1933962 0.1933962), wk = 0.0020790 k( 384) = ( 0.3018868 0.1981132 0.1981132), wk = 0.0020790 k( 385) = ( 0.2971698 0.2028302 0.2028302), wk = 0.0020790 k( 386) = ( 0.2924528 0.2075472 0.2075472), wk = 0.0020790 k( 387) = ( 0.2877359 0.2122642 0.2122641), wk = 0.0020790 k( 388) = ( 0.2830189 0.2169811 0.2169811), wk = 0.0020790 k( 389) = ( 0.2783019 0.2216981 0.2216981), wk = 0.0020790 k( 390) = ( 0.2735849 0.2264151 0.2264151), wk = 0.0020790 k( 391) = ( 0.2688679 0.2311321 0.2311321), wk = 0.0020790 k( 392) = ( 0.2641509 0.2358491 0.2358491), wk = 0.0020790 k( 393) = ( 0.2594340 0.2405660 0.2405660), wk = 0.0020790 k( 394) = ( 0.2547170 0.2452830 0.2452830), wk = 0.0020790 k( 395) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0020790 k( 396) = ( 0.0661963 -0.0661963 0.5149707), wk = 0.0020790 k( 397) = ( 0.0708710 -0.0708710 0.5102960), wk = 0.0020790 k( 398) = ( 0.0755457 -0.0755457 0.5056212), wk = 0.0020790 k( 399) = ( 0.0802205 -0.0802205 0.5009465), wk = 0.0020790 k( 400) = ( 0.0848952 -0.0848952 0.4962718), wk = 0.0020790 k( 401) = ( 0.0895699 -0.0895699 0.4915970), wk = 0.0020790 k( 402) = ( 0.0942447 -0.0942447 0.4869223), wk = 0.0020790 k( 403) = ( 0.0989194 -0.0989194 0.4822476), wk = 0.0020790 k( 404) = ( 0.1035941 -0.1035941 0.4775728), wk = 0.0020790 k( 405) = ( 0.1082689 -0.1082689 0.4728981), wk = 0.0020790 k( 406) = ( 0.1129436 -0.1129436 0.4682234), wk = 0.0020790 k( 407) = ( 0.1176183 -0.1176183 0.4635486), wk = 0.0020790 k( 408) = ( 0.1222931 -0.1222931 0.4588739), wk = 0.0020790 k( 409) = ( 0.1269678 -0.1269678 0.4541992), wk = 0.0020790 k( 410) = ( 0.1316425 -0.1316425 0.4495244), wk = 0.0020790 k( 411) = ( 0.1363173 -0.1363173 0.4448497), wk = 0.0020790 k( 412) = ( 0.1409920 -0.1409920 0.4401750), wk = 0.0020790 k( 413) = ( 0.1456667 -0.1456667 0.4355002), wk = 0.0020790 k( 414) = ( 0.1503415 -0.1503415 0.4308255), wk = 0.0020790 k( 415) = ( 0.1550162 -0.1550162 0.4261508), wk = 0.0020790 k( 416) = ( 0.1596909 -0.1596909 0.4214760), wk = 0.0020790 k( 417) = ( 0.1643657 -0.1643657 0.4168013), wk = 0.0020790 k( 418) = ( 0.1690404 -0.1690404 0.4121266), wk = 0.0020790 k( 419) = ( 0.1737152 -0.1737151 0.4074518), wk = 0.0020790 k( 420) = ( 0.1783899 -0.1783899 0.4027771), wk = 0.0020790 k( 421) = ( 0.1830646 -0.1830646 0.3981024), wk = 0.0020790 k( 422) = ( 0.1877393 -0.1877393 0.3934276), wk = 0.0020790 k( 423) = ( 0.1924141 -0.1924141 0.3887529), wk = 0.0020790 k( 424) = ( 0.1970888 -0.1970888 0.3840782), wk = 0.0020790 k( 425) = ( 0.2017636 -0.2017636 0.3794034), wk = 0.0020790 k( 426) = ( 0.2064383 -0.2064383 0.3747287), wk = 0.0020790 k( 427) = ( 0.2111130 -0.2111130 0.3700540), wk = 0.0020790 k( 428) = ( 0.2157878 -0.2157878 0.3653792), wk = 0.0020790 k( 429) = ( 0.2204625 -0.2204625 0.3607045), wk = 0.0020790 k( 430) = ( 0.2251372 -0.2251372 0.3560298), wk = 0.0020790 k( 431) = ( 0.2298119 -0.2298119 0.3513550), wk = 0.0020790 k( 432) = ( 0.2344867 -0.2344867 0.3466803), wk = 0.0020790 k( 433) = ( 0.2391614 -0.2391614 0.3420056), wk = 0.0020790 k( 434) = ( 0.2438362 -0.2438361 0.3373308), wk = 0.0020790 k( 435) = ( 0.2485109 -0.2485109 0.3326561), wk = 0.0020790 k( 436) = ( 0.2531856 -0.2531856 0.3279814), wk = 0.0020790 k( 437) = ( 0.2578604 -0.2578604 0.3233066), wk = 0.0020790 k( 438) = ( 0.2625351 -0.2625351 0.3186319), wk = 0.0020790 k( 439) = ( 0.2672098 -0.2672098 0.3139572), wk = 0.0020790 k( 440) = ( 0.2718846 -0.2718846 0.3092824), wk = 0.0020790 k( 441) = ( 0.2765593 -0.2765593 0.3046077), wk = 0.0020790 k( 442) = ( 0.2812340 -0.2812340 0.2999330), wk = 0.0020790 k( 443) = ( 0.2859088 -0.2859088 0.2952582), wk = 0.0020790 k( 444) = ( 0.2905835 -0.2905835 0.2905835), wk = 0.0020790 k( 445) = ( 0.7094165 0.2905835 -0.2905835), wk = 0.0020790 k( 446) = ( 0.7035994 0.2964006 -0.2964006), wk = 0.0020790 k( 447) = ( 0.6977823 0.3022177 -0.3022177), wk = 0.0020790 k( 448) = ( 0.6919651 0.3080349 -0.3080349), wk = 0.0020790 k( 449) = ( 0.6861480 0.3138520 -0.3138520), wk = 0.0020790 k( 450) = ( 0.6803309 0.3196691 -0.3196691), wk = 0.0020790 k( 451) = ( 0.6745138 0.3254862 -0.3254862), wk = 0.0020790 k( 452) = ( 0.6686966 0.3313034 -0.3313034), wk = 0.0020790 k( 453) = ( 0.6628795 0.3371205 -0.3371205), wk = 0.0020790 k( 454) = ( 0.6570624 0.3429376 -0.3429376), wk = 0.0020790 k( 455) = ( 0.6512453 0.3487547 -0.3487547), wk = 0.0020790 k( 456) = ( 0.6454281 0.3545719 -0.3545719), wk = 0.0020790 k( 457) = ( 0.6396110 0.3603890 -0.3603890), wk = 0.0020790 k( 458) = ( 0.6337939 0.3662061 -0.3662061), wk = 0.0020790 k( 459) = ( 0.6279768 0.3720232 -0.3720232), wk = 0.0020790 k( 460) = ( 0.6221596 0.3778404 -0.3778404), wk = 0.0020790 k( 461) = ( 0.6163425 0.3836575 -0.3836575), wk = 0.0020790 k( 462) = ( 0.6105254 0.3894746 -0.3894746), wk = 0.0020790 k( 463) = ( 0.6047082 0.3952917 -0.3952918), wk = 0.0020790 k( 464) = ( 0.5988911 0.4011089 -0.4011089), wk = 0.0020790 k( 465) = ( 0.5930740 0.4069260 -0.4069260), wk = 0.0020790 k( 466) = ( 0.5872569 0.4127431 -0.4127431), wk = 0.0020790 k( 467) = ( 0.5814398 0.4185603 -0.4185603), wk = 0.0020790 k( 468) = ( 0.5756226 0.4243774 -0.4243774), wk = 0.0020790 k( 469) = ( 0.5698055 0.4301945 -0.4301945), wk = 0.0020790 k( 470) = ( 0.5639884 0.4360116 -0.4360116), wk = 0.0020790 k( 471) = ( 0.5581713 0.4418287 -0.4418287), wk = 0.0020790 k( 472) = ( 0.5523541 0.4476459 -0.4476459), wk = 0.0020790 k( 473) = ( 0.5465370 0.4534630 -0.4534630), wk = 0.0020790 k( 474) = ( 0.5407199 0.4592801 -0.4592801), wk = 0.0020790 k( 475) = ( 0.5349027 0.4650972 -0.4650973), wk = 0.0020790 k( 476) = ( 0.5290856 0.4709144 -0.4709144), wk = 0.0020790 k( 477) = ( 0.5232685 0.4767315 -0.4767315), wk = 0.0020790 k( 478) = ( 0.5174514 0.4825486 -0.4825486), wk = 0.0020790 k( 479) = ( 0.5116342 0.4883657 -0.4883657), wk = 0.0020790 k( 480) = ( 0.5058171 0.4941829 -0.4941829), wk = 0.0020790 k( 481) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0020790 Dense grid: 75599 G-vectors FFT dimensions: ( 75, 75, 75) Smooth grid: 49669 G-vectors FFT dimensions: ( 64, 64, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.24 Mb ( 356, 44) NL pseudopotentials 0.24 Mb ( 178, 90) Each V/rho on FFT grid 0.26 Mb ( 16875) Each G-vector array 0.02 Mb ( 2100) G-vector shells 0.01 Mb ( 1923) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.96 Mb ( 356, 176) Each subspace H/S matrix 0.03 Mb ( 44, 44) Each matrix 0.12 Mb ( 90, 2, 44) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./Li2PdO2.save/charge-density.dat Starting wfc are 56 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.5 secs Computing kpt #: 2 total cpu time spent up to now is 4.2 secs Computing kpt #: 3 total cpu time spent up to now is 4.9 secs Computing kpt #: 4 total cpu time spent up to now is 5.6 secs Computing kpt #: 5 total cpu time spent up to now is 6.3 secs Computing kpt #: 6 total cpu time spent up to now is 7.0 secs Computing kpt #: 7 total cpu time spent up to now is 7.7 secs Computing kpt #: 8 total cpu time spent up to now is 8.4 secs Computing kpt #: 9 total cpu time spent up to now is 9.1 secs Computing kpt #: 10 total cpu time spent up to now is 9.7 secs Computing kpt #: 11 total cpu time spent up to now is 10.4 secs Computing kpt #: 12 total cpu time spent up to now is 11.1 secs Computing kpt #: 13 total cpu time spent up to now is 11.8 secs Computing kpt #: 14 total cpu time spent up to now is 12.4 secs Computing kpt #: 15 total cpu time spent up to now is 12.9 secs Computing kpt #: 16 total cpu time spent up to now is 13.5 secs Computing kpt #: 17 total cpu time spent up to now is 14.2 secs Computing kpt #: 18 total cpu time spent up to now is 14.8 secs Computing kpt #: 19 total cpu time spent up to now is 15.3 secs Computing kpt #: 20 total cpu time spent up to now is 15.9 secs Computing kpt #: 21 total cpu time spent up to now is 16.5 secs Computing kpt #: 22 total cpu time spent up to now is 17.0 secs Computing kpt #: 23 total cpu time spent up to now is 17.6 secs Computing kpt #: 24 total cpu time spent up to now is 18.2 secs Computing kpt #: 25 total cpu time spent up to now is 18.7 secs Computing kpt #: 26 total cpu time spent up to now is 19.3 secs Computing kpt #: 27 total cpu time spent up to now is 19.8 secs Computing kpt #: 28 total cpu time spent up to now is 20.4 secs Computing kpt #: 29 total cpu time spent up to now is 20.9 secs Computing kpt #: 30 total cpu time spent up to now is 21.5 secs Computing kpt #: 31 total cpu time spent up to now is 22.1 secs Computing kpt #: 32 total cpu time spent up to now is 22.6 secs Computing kpt #: 33 total cpu time spent up to now is 23.2 secs Computing kpt #: 34 total cpu time spent up to now is 23.8 secs Computing kpt #: 35 total cpu time spent up to now is 24.3 secs Computing kpt #: 36 total cpu time spent up to now is 24.9 secs Computing kpt #: 37 total cpu time spent up to now is 25.5 secs Computing kpt #: 38 total cpu time spent up to now is 26.0 secs Computing kpt #: 39 total cpu time spent up to now is 26.6 secs Computing kpt #: 40 total cpu time spent up to now is 27.2 secs Computing kpt #: 41 total cpu time spent up to now is 27.7 secs Computing kpt #: 42 total cpu time spent up to now is 28.3 secs Computing kpt #: 43 total cpu time spent up to now is 28.8 secs Computing kpt #: 44 total cpu time spent up to now is 29.4 secs Computing kpt #: 45 total cpu time spent up to now is 29.9 secs Computing kpt #: 46 total cpu time spent up to now is 30.5 secs Computing kpt #: 47 total cpu time spent up to now is 31.0 secs Computing kpt #: 48 total cpu time spent up to now is 31.5 secs Computing kpt #: 49 total cpu time spent up to now is 32.1 secs Computing kpt #: 50 total cpu time spent up to now is 32.6 secs Computing kpt #: 51 total cpu time spent up to now is 33.2 secs Computing kpt #: 52 total cpu time spent up to now is 33.7 secs Computing kpt #: 53 total cpu time spent up to now is 34.3 secs Computing kpt #: 54 total cpu time spent up to now is 34.8 secs Computing kpt #: 55 total cpu time spent up to now is 35.3 secs Computing kpt #: 56 total cpu time spent up to now is 35.9 secs Computing kpt #: 57 total cpu time spent up to now is 36.4 secs Computing kpt #: 58 total cpu time spent up to now is 36.9 secs Computing kpt #: 59 total cpu time spent up to now is 37.5 secs Computing kpt #: 60 total cpu time spent up to now is 38.0 secs Computing kpt #: 61 total cpu time spent up to now is 38.5 secs Computing kpt #: 62 total cpu time spent up to now is 39.1 secs Computing kpt #: 63 total cpu time spent up to now is 39.6 secs Computing kpt #: 64 total cpu time spent up to now is 40.1 secs Computing kpt #: 65 total cpu time spent up to now is 40.6 secs Computing kpt #: 66 total cpu time spent up to now is 41.2 secs Computing kpt #: 67 total cpu time spent up to now is 41.7 secs Computing kpt #: 68 total cpu time spent up to now is 42.2 secs Computing kpt #: 69 total cpu time spent up to now is 42.8 secs Computing kpt #: 70 total cpu time spent up to now is 43.3 secs Computing kpt #: 71 total cpu time spent up to now is 43.9 secs Computing kpt #: 72 total cpu time spent up to now is 44.4 secs Computing kpt #: 73 total cpu time spent up to now is 44.9 secs Computing kpt #: 74 total cpu time spent up to now is 45.5 secs Computing kpt #: 75 total cpu time spent up to now is 46.0 secs Computing kpt #: 76 total cpu time spent up to now is 46.6 secs Computing kpt #: 77 total cpu time spent up to now is 47.1 secs Computing kpt #: 78 total cpu time spent up to now is 47.7 secs Computing kpt #: 79 total cpu time spent up to now is 48.2 secs Computing kpt #: 80 total cpu time spent up to now is 48.8 secs Computing kpt #: 81 total cpu time spent up to now is 49.3 secs Computing kpt #: 82 total cpu time spent up to now is 49.9 secs Computing kpt #: 83 total cpu time spent up to now is 50.4 secs Computing kpt #: 84 total cpu time spent up to now is 51.0 secs Computing kpt #: 85 total cpu time spent up to now is 51.5 secs Computing kpt #: 86 total cpu time spent up to now is 52.1 secs Computing kpt #: 87 total cpu time spent up to now is 52.7 secs Computing kpt #: 88 total cpu time spent up to now is 53.2 secs Computing kpt #: 89 total cpu time spent up to now is 53.8 secs Computing kpt #: 90 total cpu time spent up to now is 54.4 secs Computing kpt #: 91 total cpu time spent up to now is 54.9 secs Computing kpt #: 92 total cpu time spent up to now is 55.5 secs Computing kpt #: 93 total cpu time spent up to now is 56.1 secs Computing kpt #: 94 total cpu time spent up to now is 56.7 secs Computing kpt #: 95 total cpu time spent up to now is 57.3 secs Computing kpt #: 96 total cpu time spent up to now is 57.8 secs Computing kpt #: 97 total cpu time spent up to now is 58.4 secs Computing kpt #: 98 total cpu time spent up to now is 59.0 secs Computing kpt #: 99 total cpu time spent up to now is 59.6 secs Computing kpt #: 100 total cpu time spent up to now is 60.2 secs Computing kpt #: 101 total cpu time spent up to now is 60.7 secs Computing kpt #: 102 total cpu time spent up to now is 61.3 secs Computing kpt #: 103 total cpu time spent up to now is 61.9 secs Computing kpt #: 104 total cpu time spent up to now is 62.5 secs Computing kpt #: 105 total cpu time spent up to now is 63.1 secs Computing kpt #: 106 total cpu time spent up to now is 63.6 secs Computing kpt #: 107 total cpu time spent up to now is 64.2 secs Computing kpt #: 108 total cpu time spent up to now is 64.7 secs Computing kpt #: 109 total cpu time spent up to now is 65.3 secs Computing kpt #: 110 total cpu time spent up to now is 65.9 secs Computing kpt #: 111 total cpu time spent up to now is 66.4 secs Computing kpt #: 112 total cpu time spent up to now is 67.0 secs Computing kpt #: 113 total cpu time spent up to now is 67.5 secs Computing kpt #: 114 total cpu time spent up to now is 68.1 secs Computing kpt #: 115 total cpu time spent up to now is 68.6 secs Computing kpt #: 116 total cpu time spent up to now is 69.2 secs Computing kpt #: 117 total cpu time spent up to now is 69.7 secs Computing kpt #: 118 total cpu time spent up to now is 70.3 secs Computing kpt #: 119 total cpu time spent up to now is 70.9 secs Computing kpt #: 120 total cpu time spent up to now is 71.4 secs Computing kpt #: 121 total cpu time spent up to now is 72.0 secs Computing kpt #: 122 total cpu time spent up to now is 72.5 secs Computing kpt #: 123 total cpu time spent up to now is 73.1 secs Computing kpt #: 124 total cpu time spent up to now is 73.7 secs Computing kpt #: 125 total cpu time spent up to now is 74.2 secs Computing kpt #: 126 total cpu time spent up to now is 74.8 secs Computing kpt #: 127 total cpu time spent up to now is 75.3 secs Computing kpt #: 128 total cpu time spent up to now is 75.9 secs Computing kpt #: 129 total cpu time spent up to now is 76.4 secs Computing kpt #: 130 total cpu time spent up to now is 77.0 secs Computing kpt #: 131 total cpu time spent up to now is 77.6 secs Computing kpt #: 132 total cpu time spent up to now is 78.1 secs Computing kpt #: 133 total cpu time spent up to now is 78.7 secs Computing kpt #: 134 total cpu time spent up to now is 79.3 secs Computing kpt #: 135 total cpu time spent up to now is 79.9 secs Computing kpt #: 136 total cpu time spent up to now is 80.5 secs Computing kpt #: 137 total cpu time spent up to now is 81.1 secs Computing kpt #: 138 total cpu time spent up to now is 81.7 secs Computing kpt #: 139 total cpu time spent up to now is 82.3 secs Computing kpt #: 140 total cpu time spent up to now is 83.0 secs Computing kpt #: 141 total cpu time spent up to now is 83.8 secs Computing kpt #: 142 total cpu time spent up to now is 84.5 secs Computing kpt #: 143 total cpu time spent up to now is 85.2 secs Computing kpt #: 144 total cpu time spent up to now is 85.9 secs Computing kpt #: 145 total cpu time spent up to now is 86.5 secs Computing kpt #: 146 total cpu time spent up to now is 87.2 secs Computing kpt #: 147 total cpu time spent up to now is 87.8 secs Computing kpt #: 148 total cpu time spent up to now is 88.4 secs Computing kpt #: 149 total cpu time spent up to now is 89.0 secs Computing kpt #: 150 total cpu time spent up to now is 89.6 secs Computing kpt #: 151 total cpu time spent up to now is 90.2 secs Computing kpt #: 152 total cpu time spent up to now is 90.8 secs Computing kpt #: 153 total cpu time spent up to now is 91.4 secs Computing kpt #: 154 total cpu time spent up to now is 92.0 secs Computing kpt #: 155 total cpu time spent up to now is 92.6 secs Computing kpt #: 156 total cpu time spent up to now is 93.1 secs Computing kpt #: 157 total cpu time spent up to now is 93.7 secs Computing kpt #: 158 total cpu time spent up to now is 94.2 secs Computing kpt #: 159 total cpu time spent up to now is 94.8 secs Computing kpt #: 160 total cpu time spent up to now is 95.3 secs Computing kpt #: 161 total cpu time spent up to now is 95.8 secs Computing kpt #: 162 total cpu time spent up to now is 96.4 secs Computing kpt #: 163 total cpu time spent up to now is 96.9 secs Computing kpt #: 164 total cpu time spent up to now is 97.5 secs Computing kpt #: 165 total cpu time spent up to now is 98.0 secs Computing kpt #: 166 total cpu time spent up to now is 98.5 secs Computing kpt #: 167 total cpu time spent up to now is 99.1 secs Computing kpt #: 168 total cpu time spent up to now is 99.6 secs Computing kpt #: 169 total cpu time spent up to now is 100.1 secs Computing kpt #: 170 total cpu time spent up to now is 100.7 secs Computing kpt #: 171 total cpu time spent up to now is 101.2 secs Computing kpt #: 172 total cpu time spent up to now is 101.8 secs Computing kpt #: 173 total cpu time spent up to now is 102.3 secs Computing kpt #: 174 total cpu time spent up to now is 102.9 secs Computing kpt #: 175 total cpu time spent up to now is 103.4 secs Computing kpt #: 176 total cpu time spent up to now is 104.0 secs Computing kpt #: 177 total cpu time spent up to now is 104.5 secs Computing kpt #: 178 total cpu time spent up to now is 105.0 secs Computing kpt #: 179 total cpu time spent up to now is 105.6 secs Computing kpt #: 180 total cpu time spent up to now is 106.1 secs Computing kpt #: 181 total cpu time spent up to now is 106.6 secs Computing kpt #: 182 total cpu time spent up to now is 107.2 secs Computing kpt #: 183 total cpu time spent up to now is 107.7 secs Computing kpt #: 184 total cpu time spent up to now is 108.3 secs Computing kpt #: 185 total cpu time spent up to now is 108.8 secs Computing kpt #: 186 total cpu time spent up to now is 109.3 secs Computing kpt #: 187 total cpu time spent up to now is 109.9 secs Computing kpt #: 188 total cpu time spent up to now is 110.4 secs Computing kpt #: 189 total cpu time spent up to now is 110.9 secs Computing kpt #: 190 total cpu time spent up to now is 111.5 secs Computing kpt #: 191 total cpu time spent up to now is 112.0 secs Computing kpt #: 192 total cpu time spent up to now is 112.5 secs Computing kpt #: 193 total cpu time spent up to now is 113.1 secs Computing kpt #: 194 total cpu time spent up to now is 113.6 secs Computing kpt #: 195 total cpu time spent up to now is 114.1 secs Computing kpt #: 196 total cpu time spent up to now is 114.6 secs Computing kpt #: 197 total cpu time spent up to now is 115.2 secs Computing kpt #: 198 total cpu time spent up to now is 115.7 secs Computing kpt #: 199 total cpu time spent up to now is 116.3 secs Computing kpt #: 200 total cpu time spent up to now is 116.8 secs Computing kpt #: 201 total cpu time spent up to now is 117.3 secs Computing kpt #: 202 total cpu time spent up to now is 117.9 secs Computing kpt #: 203 total cpu time spent up to now is 118.4 secs Computing kpt #: 204 total cpu time spent up to now is 119.0 secs Computing kpt #: 205 total cpu time spent up to now is 119.5 secs Computing kpt #: 206 total cpu time spent up to now is 120.1 secs Computing kpt #: 207 total cpu time spent up to now is 120.7 secs Computing kpt #: 208 total cpu time spent up to now is 121.3 secs Computing kpt #: 209 total cpu time spent up to now is 122.0 secs Computing kpt #: 210 total cpu time spent up to now is 122.7 secs Computing kpt #: 211 total cpu time spent up to now is 123.4 secs Computing kpt #: 212 total cpu time spent up to now is 124.1 secs Computing kpt #: 213 total cpu time spent up to now is 125.4 secs Computing kpt #: 214 total cpu time spent up to now is 126.8 secs Computing kpt #: 215 total cpu time spent up to now is 127.6 secs Computing kpt #: 216 total cpu time spent up to now is 128.5 secs Computing kpt #: 217 total cpu time spent up to now is 129.5 secs Computing kpt #: 218 total cpu time spent up to now is 130.4 secs Computing kpt #: 219 total cpu time spent up to now is 131.3 secs Computing kpt #: 220 total cpu time spent up to now is 132.2 secs Computing kpt #: 221 total cpu time spent up to now is 133.0 secs Computing kpt #: 222 total cpu time spent up to now is 133.8 secs Computing kpt #: 223 total cpu time spent up to now is 134.7 secs Computing kpt #: 224 total cpu time spent up to now is 135.5 secs Computing kpt #: 225 total cpu time spent up to now is 136.3 secs Computing kpt #: 226 total cpu time spent up to now is 137.2 secs Computing kpt #: 227 total cpu time spent up to now is 138.1 secs Computing kpt #: 228 total cpu time spent up to now is 138.9 secs Computing kpt #: 229 total cpu time spent up to now is 139.7 secs Computing kpt #: 230 total cpu time spent up to now is 140.5 secs Computing kpt #: 231 total cpu time spent up to now is 141.3 secs Computing kpt #: 232 total cpu time spent up to now is 142.0 secs Computing kpt #: 233 total cpu time spent up to now is 142.8 secs Computing kpt #: 234 total cpu time spent up to now is 143.6 secs Computing kpt #: 235 total cpu time spent up to now is 144.4 secs Computing kpt #: 236 total cpu time spent up to now is 145.1 secs Computing kpt #: 237 total cpu time spent up to now is 145.9 secs Computing kpt #: 238 total cpu time spent up to now is 146.6 secs Computing kpt #: 239 total cpu time spent up to now is 147.4 secs Computing kpt #: 240 total cpu time spent up to now is 148.2 secs Computing kpt #: 241 total cpu time spent up to now is 149.0 secs Computing kpt #: 242 total cpu time spent up to now is 149.8 secs Computing kpt #: 243 total cpu time spent up to now is 150.6 secs Computing kpt #: 244 total cpu time spent up to now is 151.4 secs Computing kpt #: 245 total cpu time spent up to now is 152.2 secs Computing kpt #: 246 total cpu time spent up to now is 153.0 secs Computing kpt #: 247 total cpu time spent up to now is 153.8 secs Computing kpt #: 248 total cpu time spent up to now is 154.5 secs Computing kpt #: 249 total cpu time spent up to now is 155.3 secs Computing kpt #: 250 total cpu time spent up to now is 156.0 secs Computing kpt #: 251 total cpu time spent up to now is 156.8 secs Computing kpt #: 252 total cpu time spent up to now is 157.6 secs Computing kpt #: 253 total cpu time spent up to now is 158.3 secs Computing kpt #: 254 total cpu time spent up to now is 159.0 secs Computing kpt #: 255 total cpu time spent up to now is 159.8 secs Computing kpt #: 256 total cpu time spent up to now is 160.5 secs Computing kpt #: 257 total cpu time spent up to now is 161.2 secs Computing kpt #: 258 total cpu time spent up to now is 162.0 secs Computing kpt #: 259 total cpu time spent up to now is 162.7 secs Computing kpt #: 260 total cpu time spent up to now is 163.4 secs Computing kpt #: 261 total cpu time spent up to now is 164.1 secs Computing kpt #: 262 total cpu time spent up to now is 164.9 secs Computing kpt #: 263 total cpu time spent up to now is 165.6 secs Computing kpt #: 264 total cpu time spent up to now is 166.3 secs Computing kpt #: 265 total cpu time spent up to now is 167.1 secs Computing kpt #: 266 total cpu time spent up to now is 167.8 secs Computing kpt #: 267 total cpu time spent up to now is 168.5 secs Computing kpt #: 268 total cpu time spent up to now is 169.3 secs Computing kpt #: 269 total cpu time spent up to now is 170.0 secs Computing kpt #: 270 total cpu time spent up to now is 170.7 secs Computing kpt #: 271 total cpu time spent up to now is 171.6 secs Computing kpt #: 272 total cpu time spent up to now is 172.3 secs Computing kpt #: 273 total cpu time spent up to now is 173.0 secs Computing kpt #: 274 total cpu time spent up to now is 173.8 secs Computing kpt #: 275 total cpu time spent up to now is 174.5 secs Computing kpt #: 276 total cpu time spent up to now is 175.3 secs Computing kpt #: 277 total cpu time spent up to now is 176.1 secs Computing kpt #: 278 total cpu time spent up to now is 176.8 secs Computing kpt #: 279 total cpu time spent up to now is 177.6 secs Computing kpt #: 280 total cpu time spent up to now is 178.3 secs Computing kpt #: 281 total cpu time spent up to now is 179.1 secs Computing kpt #: 282 total cpu time spent up to now is 179.8 secs Computing kpt #: 283 total cpu time spent up to now is 180.5 secs Computing kpt #: 284 total cpu time spent up to now is 181.2 secs Computing kpt #: 285 total cpu time spent up to now is 181.9 secs Computing kpt #: 286 total cpu time spent up to now is 182.5 secs Computing kpt #: 287 total cpu time spent up to now is 183.1 secs Computing kpt #: 288 total cpu time spent up to now is 183.7 secs Computing kpt #: 289 total cpu time spent up to now is 184.3 secs Computing kpt #: 290 total cpu time spent up to now is 184.9 secs Computing kpt #: 291 total cpu time spent up to now is 185.4 secs Computing kpt #: 292 total cpu time spent up to now is 186.0 secs Computing kpt #: 293 total cpu time spent up to now is 186.6 secs Computing kpt #: 294 total cpu time spent up to now is 187.1 secs Computing kpt #: 295 total cpu time spent up to now is 187.7 secs Computing kpt #: 296 total cpu time spent up to now is 188.3 secs Computing kpt #: 297 total cpu time spent up to now is 188.8 secs Computing kpt #: 298 total cpu time spent up to now is 189.4 secs Computing kpt #: 299 total cpu time spent up to now is 190.0 secs Computing kpt #: 300 total cpu time spent up to now is 190.5 secs Computing kpt #: 301 total cpu time spent up to now is 191.1 secs Computing kpt #: 302 total cpu time spent up to now is 191.6 secs Computing kpt #: 303 total cpu time spent up to now is 192.2 secs Computing kpt #: 304 total cpu time spent up to now is 192.7 secs Computing kpt #: 305 total cpu time spent up to now is 193.3 secs Computing kpt #: 306 total cpu time spent up to now is 193.8 secs Computing kpt #: 307 total cpu time spent up to now is 194.4 secs Computing kpt #: 308 total cpu time spent up to now is 194.9 secs Computing kpt #: 309 total cpu time spent up to now is 195.5 secs Computing kpt #: 310 total cpu time spent up to now is 196.0 secs Computing kpt #: 311 total cpu time spent up to now is 196.6 secs Computing kpt #: 312 total cpu time spent up to now is 197.1 secs Computing kpt #: 313 total cpu time spent up to now is 197.7 secs Computing kpt #: 314 total cpu time spent up to now is 198.2 secs Computing kpt #: 315 total cpu time spent up to now is 198.7 secs Computing kpt #: 316 total cpu time spent up to now is 199.3 secs Computing kpt #: 317 total cpu time spent up to now is 199.8 secs Computing kpt #: 318 total cpu time spent up to now is 200.4 secs Computing kpt #: 319 total cpu time spent up to now is 200.9 secs Computing kpt #: 320 total cpu time spent up to now is 201.5 secs Computing kpt #: 321 total cpu time spent up to now is 202.0 secs Computing kpt #: 322 total cpu time spent up to now is 202.5 secs Computing kpt #: 323 total cpu time spent up to now is 203.1 secs Computing kpt #: 324 total cpu time spent up to now is 203.6 secs Computing kpt #: 325 total cpu time spent up to now is 204.2 secs Computing kpt #: 326 total cpu time spent up to now is 204.7 secs Computing kpt #: 327 total cpu time spent up to now is 205.3 secs Computing kpt #: 328 total cpu time spent up to now is 205.9 secs Computing kpt #: 329 total cpu time spent up to now is 206.4 secs Computing kpt #: 330 total cpu time spent up to now is 207.0 secs Computing kpt #: 331 total cpu time spent up to now is 207.5 secs Computing kpt #: 332 total cpu time spent up to now is 208.1 secs Computing kpt #: 333 total cpu time spent up to now is 208.6 secs Computing kpt #: 334 total cpu time spent up to now is 209.2 secs Computing kpt #: 335 total cpu time spent up to now is 209.7 secs Computing kpt #: 336 total cpu time spent up to now is 210.3 secs Computing kpt #: 337 total cpu time spent up to now is 210.8 secs Computing kpt #: 338 total cpu time spent up to now is 211.4 secs Computing kpt #: 339 total cpu time spent up to now is 211.9 secs Computing kpt #: 340 total cpu time spent up to now is 212.5 secs Computing kpt #: 341 total cpu time spent up to now is 213.0 secs Computing kpt #: 342 total cpu time spent up to now is 213.5 secs Computing kpt #: 343 total cpu time spent up to now is 214.0 secs Computing kpt #: 344 total cpu time spent up to now is 214.5 secs Computing kpt #: 345 total cpu time spent up to now is 215.1 secs Computing kpt #: 346 total cpu time spent up to now is 215.6 secs Computing kpt #: 347 total cpu time spent up to now is 216.2 secs Computing kpt #: 348 total cpu time spent up to now is 216.7 secs Computing kpt #: 349 total cpu time spent up to now is 217.2 secs Computing kpt #: 350 total cpu time spent up to now is 217.7 secs Computing kpt #: 351 total cpu time spent up to now is 218.3 secs Computing kpt #: 352 total cpu time spent up to now is 218.8 secs Computing kpt #: 353 total cpu time spent up to now is 219.3 secs Computing kpt #: 354 total cpu time spent up to now is 219.9 secs Computing kpt #: 355 total cpu time spent up to now is 220.4 secs Computing kpt #: 356 total cpu time spent up to now is 221.0 secs Computing kpt #: 357 total cpu time spent up to now is 221.5 secs Computing kpt #: 358 total cpu time spent up to now is 222.1 secs Computing kpt #: 359 total cpu time spent up to now is 222.7 secs Computing kpt #: 360 total cpu time spent up to now is 223.2 secs Computing kpt #: 361 total cpu time spent up to now is 223.8 secs Computing kpt #: 362 total cpu time spent up to now is 224.3 secs Computing kpt #: 363 total cpu time spent up to now is 224.9 secs Computing kpt #: 364 total cpu time spent up to now is 225.5 secs Computing kpt #: 365 total cpu time spent up to now is 226.1 secs Computing kpt #: 366 total cpu time spent up to now is 226.7 secs Computing kpt #: 367 total cpu time spent up to now is 227.3 secs Computing kpt #: 368 total cpu time spent up to now is 227.9 secs Computing kpt #: 369 total cpu time spent up to now is 228.5 secs Computing kpt #: 370 total cpu time spent up to now is 229.1 secs Computing kpt #: 371 total cpu time spent up to now is 229.8 secs Computing kpt #: 372 total cpu time spent up to now is 230.4 secs Computing kpt #: 373 total cpu time spent up to now is 231.0 secs Computing kpt #: 374 total cpu time spent up to now is 231.6 secs Computing kpt #: 375 total cpu time spent up to now is 232.3 secs Computing kpt #: 376 total cpu time spent up to now is 233.0 secs Computing kpt #: 377 total cpu time spent up to now is 233.6 secs Computing kpt #: 378 total cpu time spent up to now is 234.2 secs Computing kpt #: 379 total cpu time spent up to now is 234.8 secs Computing kpt #: 380 total cpu time spent up to now is 235.4 secs Computing kpt #: 381 total cpu time spent up to now is 236.0 secs Computing kpt #: 382 total cpu time spent up to now is 236.6 secs Computing kpt #: 383 total cpu time spent up to now is 237.2 secs Computing kpt #: 384 total cpu time spent up to now is 237.8 secs Computing kpt #: 385 total cpu time spent up to now is 238.4 secs Computing kpt #: 386 total cpu time spent up to now is 239.0 secs Computing kpt #: 387 total cpu time spent up to now is 239.6 secs Computing kpt #: 388 total cpu time spent up to now is 240.1 secs Computing kpt #: 389 total cpu time spent up to now is 240.7 secs Computing kpt #: 390 total cpu time spent up to now is 241.3 secs Computing kpt #: 391 total cpu time spent up to now is 241.9 secs Computing kpt #: 392 total cpu time spent up to now is 242.5 secs Computing kpt #: 393 total cpu time spent up to now is 243.0 secs Computing kpt #: 394 total cpu time spent up to now is 243.6 secs Computing kpt #: 395 total cpu time spent up to now is 244.1 secs Computing kpt #: 396 total cpu time spent up to now is 244.7 secs Computing kpt #: 397 total cpu time spent up to now is 245.3 secs Computing kpt #: 398 total cpu time spent up to now is 245.9 secs Computing kpt #: 399 total cpu time spent up to now is 246.5 secs Computing kpt #: 400 total cpu time spent up to now is 247.0 secs Computing kpt #: 401 total cpu time spent up to now is 247.6 secs Computing kpt #: 402 total cpu time spent up to now is 248.1 secs Computing kpt #: 403 total cpu time spent up to now is 248.7 secs Computing kpt #: 404 total cpu time spent up to now is 249.3 secs Computing kpt #: 405 total cpu time spent up to now is 249.8 secs Computing kpt #: 406 total cpu time spent up to now is 250.4 secs Computing kpt #: 407 total cpu time spent up to now is 251.0 secs Computing kpt #: 408 total cpu time spent up to now is 251.5 secs Computing kpt #: 409 total cpu time spent up to now is 252.1 secs Computing kpt #: 410 total cpu time spent up to now is 252.7 secs Computing kpt #: 411 total cpu time spent up to now is 253.2 secs Computing kpt #: 412 total cpu time spent up to now is 253.8 secs Computing kpt #: 413 total cpu time spent up to now is 254.3 secs Computing kpt #: 414 total cpu time spent up to now is 254.9 secs Computing kpt #: 415 total cpu time spent up to now is 255.5 secs Computing kpt #: 416 total cpu time spent up to now is 256.2 secs Computing kpt #: 417 total cpu time spent up to now is 256.9 secs Computing kpt #: 418 total cpu time spent up to now is 257.6 secs Computing kpt #: 419 total cpu time spent up to now is 258.2 secs Computing kpt #: 420 total cpu time spent up to now is 258.8 secs Computing kpt #: 421 total cpu time spent up to now is 259.3 secs Computing kpt #: 422 total cpu time spent up to now is 259.9 secs Computing kpt #: 423 total cpu time spent up to now is 260.4 secs Computing kpt #: 424 total cpu time spent up to now is 261.0 secs Computing kpt #: 425 total cpu time spent up to now is 261.5 secs Computing kpt #: 426 total cpu time spent up to now is 262.1 secs Computing kpt #: 427 total cpu time spent up to now is 262.6 secs Computing kpt #: 428 total cpu time spent up to now is 263.2 secs Computing kpt #: 429 total cpu time spent up to now is 263.8 secs Computing kpt #: 430 total cpu time spent up to now is 264.3 secs Computing kpt #: 431 total cpu time spent up to now is 264.9 secs Computing kpt #: 432 total cpu time spent up to now is 265.4 secs Computing kpt #: 433 total cpu time spent up to now is 266.0 secs Computing kpt #: 434 total cpu time spent up to now is 266.5 secs Computing kpt #: 435 total cpu time spent up to now is 267.1 secs Computing kpt #: 436 total cpu time spent up to now is 267.6 secs Computing kpt #: 437 total cpu time spent up to now is 268.2 secs Computing kpt #: 438 total cpu time spent up to now is 268.7 secs Computing kpt #: 439 total cpu time spent up to now is 269.3 secs Computing kpt #: 440 total cpu time spent up to now is 269.8 secs Computing kpt #: 441 total cpu time spent up to now is 270.3 secs Computing kpt #: 442 total cpu time spent up to now is 270.9 secs Computing kpt #: 443 total cpu time spent up to now is 271.4 secs Computing kpt #: 444 total cpu time spent up to now is 272.0 secs Computing kpt #: 445 total cpu time spent up to now is 272.5 secs Computing kpt #: 446 total cpu time spent up to now is 273.1 secs Computing kpt #: 447 total cpu time spent up to now is 273.6 secs Computing kpt #: 448 total cpu time spent up to now is 274.2 secs Computing kpt #: 449 total cpu time spent up to now is 274.7 secs Computing kpt #: 450 total cpu time spent up to now is 275.3 secs Computing kpt #: 451 total cpu time spent up to now is 275.8 secs Computing kpt #: 452 total cpu time spent up to now is 276.4 secs Computing kpt #: 453 total cpu time spent up to now is 276.9 secs Computing kpt #: 454 total cpu time spent up to now is 277.5 secs Computing kpt #: 455 total cpu time spent up to now is 278.0 secs Computing kpt #: 456 total cpu time spent up to now is 278.6 secs Computing kpt #: 457 total cpu time spent up to now is 279.1 secs Computing kpt #: 458 total cpu time spent up to now is 279.7 secs Computing kpt #: 459 total cpu time spent up to now is 280.3 secs Computing kpt #: 460 total cpu time spent up to now is 280.8 secs Computing kpt #: 461 total cpu time spent up to now is 281.4 secs Computing kpt #: 462 total cpu time spent up to now is 282.0 secs Computing kpt #: 463 total cpu time spent up to now is 282.5 secs Computing kpt #: 464 total cpu time spent up to now is 283.1 secs Computing kpt #: 465 total cpu time spent up to now is 283.7 secs Computing kpt #: 466 total cpu time spent up to now is 284.2 secs Computing kpt #: 467 total cpu time spent up to now is 284.8 secs Computing kpt #: 468 total cpu time spent up to now is 285.4 secs Computing kpt #: 469 total cpu time spent up to now is 286.0 secs Computing kpt #: 470 total cpu time spent up to now is 286.5 secs Computing kpt #: 471 total cpu time spent up to now is 287.1 secs Computing kpt #: 472 total cpu time spent up to now is 287.8 secs Computing kpt #: 473 total cpu time spent up to now is 288.5 secs Computing kpt #: 474 total cpu time spent up to now is 289.2 secs Computing kpt #: 475 total cpu time spent up to now is 289.9 secs Computing kpt #: 476 total cpu time spent up to now is 290.6 secs Computing kpt #: 477 total cpu time spent up to now is 291.3 secs Computing kpt #: 478 total cpu time spent up to now is 292.0 secs Computing kpt #: 479 total cpu time spent up to now is 292.8 secs Computing kpt #: 480 total cpu time spent up to now is 293.6 secs Computing kpt #: 481 total cpu time spent up to now is 294.4 secs ethr = 2.78E-08, avg # of iterations = 18.9 total cpu time spent up to now is 294.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6219 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1270 -35.1270 -35.0255 -35.0255 -9.5048 -9.5048 -8.8059 -8.8059 2.5824 2.5824 2.8384 2.8384 4.3682 4.3682 4.6606 4.6606 5.2363 5.2363 5.4510 5.4510 6.1408 6.1408 6.1761 6.1761 6.2489 6.2489 6.6577 6.6577 7.8185 7.8185 9.2958 9.2958 13.0050 13.0050 18.3811 18.3811 k =-0.0047 0.0091 0.0129 ( 6215 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1270 -35.1270 -35.0254 -35.0254 -9.5050 -9.5050 -8.8062 -8.8062 2.5828 2.5828 2.8387 2.8387 4.3693 4.3693 4.6593 4.6593 5.2363 5.2363 5.4508 5.4508 6.1423 6.1423 6.1763 6.1763 6.2489 6.2489 6.6573 6.6573 7.8187 7.8187 9.2966 9.2966 13.0069 13.0069 18.3790 18.3790 k =-0.0093 0.0182 0.0257 ( 6207 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7978 -40.7978 -35.1268 -35.1268 -35.0254 -35.0254 -9.5056 -9.5056 -8.8074 -8.8074 2.5841 2.5841 2.8395 2.8395 4.3724 4.3724 4.6557 4.6557 5.2366 5.2366 5.4504 5.4504 6.1466 6.1466 6.1770 6.1770 6.2491 6.2491 6.6560 6.6560 7.8194 7.8194 9.2991 9.2991 13.0125 13.0125 18.3730 18.3730 k =-0.0140 0.0272 0.0386 ( 6211 PWs) bands (ev): -76.6632 -76.6632 -45.4566 -45.4566 -41.1185 -41.1185 -40.7981 -40.7981 -35.1266 -35.1266 -35.0254 -35.0254 -9.5065 -9.5065 -8.8094 -8.8094 2.5861 2.5861 2.8409 2.8409 4.3776 4.3776 4.6498 4.6498 5.2370 5.2370 5.4497 5.4497 6.1538 6.1538 6.1777 6.1777 6.2497 6.2497 6.6539 6.6539 7.8205 7.8205 9.3033 9.3033 13.0218 13.0218 18.3629 18.3629 k =-0.0187 0.0363 0.0514 ( 6207 PWs) bands (ev): -76.6632 -76.6632 -45.4567 -45.4567 -41.1184 -41.1184 -40.7984 -40.7984 -35.1262 -35.1262 -35.0254 -35.0254 -9.5078 -9.5078 -8.8122 -8.8122 2.5890 2.5890 2.8428 2.8428 4.3847 4.3847 4.6418 4.6418 5.2375 5.2375 5.4488 5.4488 6.1634 6.1634 6.1779 6.1779 6.2515 6.2515 6.6511 6.6511 7.8221 7.8221 9.3092 9.3092 13.0348 13.0348 18.3489 18.3489 k =-0.0234 0.0454 0.0643 ( 6209 PWs) bands (ev): -76.6631 -76.6631 -45.4568 -45.4568 -41.1184 -41.1184 -40.7989 -40.7989 -35.1258 -35.1258 -35.0253 -35.0253 -9.5095 -9.5095 -8.8157 -8.8157 2.5927 2.5927 2.8452 2.8452 4.3935 4.3935 4.6320 4.6320 5.2382 5.2382 5.4478 5.4478 6.1737 6.1737 6.1784 6.1784 6.2550 6.2550 6.6475 6.6475 7.8242 7.8242 9.3167 9.3167 13.0515 13.0515 18.3309 18.3309 k =-0.0280 0.0545 0.0771 ( 6203 PWs) bands (ev): -76.6631 -76.6631 -45.4569 -45.4569 -41.1183 -41.1183 -40.7995 -40.7995 -35.1253 -35.1253 -35.0253 -35.0253 -9.5115 -9.5115 -8.8200 -8.8200 2.5973 2.5973 2.8483 2.8483 4.4037 4.4037 4.6209 4.6209 5.2390 5.2390 5.4468 5.4468 6.1727 6.1727 6.1905 6.1905 6.2610 6.2610 6.6433 6.6433 7.8267 7.8267 9.3260 9.3260 13.0718 13.0718 18.3089 18.3089 k =-0.0327 0.0635 0.0900 ( 6203 PWs) bands (ev): -76.6630 -76.6630 -45.4571 -45.4571 -41.1182 -41.1182 -40.8002 -40.8002 -35.1247 -35.1247 -35.0252 -35.0252 -9.5139 -9.5139 -8.8251 -8.8251 2.6026 2.6026 2.8519 2.8519 4.4149 4.4149 4.6090 4.6090 5.2399 5.2399 5.4458 5.4458 6.1675 6.1675 6.2061 6.2061 6.2696 6.2696 6.6386 6.6386 7.8297 7.8297 9.3370 9.3370 13.0957 13.0957 18.2826 18.2826 k =-0.0374 0.0726 0.1028 ( 6197 PWs) bands (ev): -76.6629 -76.6629 -45.4573 -45.4573 -41.1181 -41.1181 -40.8010 -40.8010 -35.1239 -35.1239 -35.0252 -35.0252 -9.5166 -9.5166 -8.8308 -8.8308 2.6087 2.6087 2.8560 2.8560 4.4262 4.4262 4.5972 4.5972 5.2410 5.2410 5.4449 5.4449 6.1600 6.1600 6.2230 6.2230 6.2809 6.2809 6.6336 6.6336 7.8331 7.8331 9.3497 9.3497 13.1231 13.1231 18.2521 18.2521 k =-0.0420 0.0817 0.1157 ( 6199 PWs) bands (ev): -76.6629 -76.6629 -45.4575 -45.4575 -41.1180 -41.1180 -40.8020 -40.8020 -35.1232 -35.1232 -35.0251 -35.0251 -9.5196 -9.5196 -8.8373 -8.8373 2.6155 2.6155 2.8608 2.8608 4.4364 4.4364 4.5870 4.5870 5.2421 5.2421 5.4444 5.4444 6.1506 6.1506 6.2406 6.2406 6.2948 6.2948 6.6284 6.6284 7.8369 7.8369 9.3642 9.3642 13.1540 13.1540 18.2171 18.2171 k =-0.0467 0.0908 0.1285 ( 6199 PWs) bands (ev): -76.6628 -76.6628 -45.4577 -45.4577 -41.1179 -41.1179 -40.8029 -40.8029 -35.1223 -35.1223 -35.0250 -35.0250 -9.5230 -9.5230 -8.8445 -8.8445 2.6232 2.6232 2.8662 2.8662 4.4436 4.4436 4.5803 4.5803 5.2434 5.2434 5.4442 5.4442 6.1393 6.1393 6.2583 6.2583 6.3111 6.3111 6.6232 6.6232 7.8413 7.8413 9.3806 9.3806 13.1884 13.1884 18.1776 18.1776 k =-0.0514 0.0999 0.1414 ( 6197 PWs) bands (ev): -76.6627 -76.6627 -45.4580 -45.4580 -41.1177 -41.1177 -40.8040 -40.8040 -35.1213 -35.1213 -35.0250 -35.0250 -9.5266 -9.5266 -8.8524 -8.8524 2.6315 2.6315 2.8721 2.8721 4.4455 4.4455 4.5795 4.5795 5.2447 5.2447 5.4446 5.4446 6.1265 6.1265 6.2758 6.2758 6.3294 6.3294 6.6182 6.6182 7.8460 7.8460 9.3988 9.3988 13.2262 13.2262 18.1334 18.1334 k =-0.0561 0.1089 0.1542 ( 6189 PWs) bands (ev): -76.6626 -76.6626 -45.4583 -45.4583 -41.1176 -41.1176 -40.8052 -40.8052 -35.1202 -35.1202 -35.0249 -35.0249 -9.5306 -9.5306 -8.8609 -8.8609 2.6406 2.6406 2.8787 2.8787 4.4407 4.4407 4.5858 4.5858 5.2461 5.2461 5.4457 5.4457 6.1122 6.1122 6.2925 6.2925 6.3495 6.3495 6.6140 6.6140 7.8512 7.8512 9.4189 9.4189 13.2672 13.2672 18.0845 18.0845 k =-0.0607 0.1180 0.1671 ( 6185 PWs) bands (ev): -76.6625 -76.6625 -45.4586 -45.4586 -41.1174 -41.1174 -40.8065 -40.8065 -35.1191 -35.1191 -35.0248 -35.0248 -9.5348 -9.5348 -8.8700 -8.8700 2.6504 2.6504 2.8859 2.8859 4.4299 4.4299 4.5987 4.5987 5.2475 5.2475 5.4475 5.4475 6.0968 6.0968 6.3083 6.3083 6.3710 6.3710 6.6107 6.6107 7.8569 7.8569 9.4409 9.4409 13.3115 13.3115 18.0308 18.0308 k =-0.0654 0.1271 0.1799 ( 6189 PWs) bands (ev): -76.6623 -76.6623 -45.4589 -45.4589 -41.1173 -41.1173 -40.8078 -40.8078 -35.1179 -35.1179 -35.0247 -35.0247 -9.5392 -9.5392 -8.8797 -8.8797 2.6609 2.6609 2.8937 2.8937 4.4149 4.4149 4.6163 4.6163 5.2490 5.2490 5.4503 5.4503 6.0802 6.0802 6.3228 6.3228 6.3933 6.3933 6.6089 6.6089 7.8630 7.8630 9.4648 9.4648 13.3589 13.3589 17.9721 17.9721 k =-0.0701 0.1362 0.1928 ( 6189 PWs) bands (ev): -76.6622 -76.6622 -45.4593 -45.4593 -41.1171 -41.1171 -40.8092 -40.8092 -35.1166 -35.1166 -35.0247 -35.0247 -9.5439 -9.5439 -8.8900 -8.8900 2.6720 2.6720 2.9022 2.9022 4.3973 4.3973 4.6368 4.6368 5.2504 5.2504 5.4542 5.4542 6.0626 6.0626 6.3355 6.3355 6.4164 6.4164 6.6091 6.6091 7.8695 7.8695 9.4908 9.4908 13.4093 13.4093 17.9085 17.9085 k =-0.0747 0.1453 0.2056 ( 6195 PWs) bands (ev): -76.6621 -76.6621 -45.4596 -45.4596 -41.1169 -41.1169 -40.8107 -40.8107 -35.1153 -35.1153 -35.0246 -35.0246 -9.5488 -9.5488 -8.9007 -8.9007 2.6838 2.6838 2.9113 2.9113 4.3781 4.3781 4.6591 4.6591 5.2519 5.2519 5.4593 5.4593 6.0441 6.0441 6.3459 6.3459 6.4399 6.4399 6.6116 6.6116 7.8764 7.8764 9.5189 9.5189 13.4627 13.4627 17.8400 17.8400 k =-0.0794 0.1543 0.2185 ( 6195 PWs) bands (ev): -76.6620 -76.6620 -45.4600 -45.4600 -41.1167 -41.1167 -40.8123 -40.8123 -35.1138 -35.1138 -35.0246 -35.0246 -9.5539 -9.5539 -8.9120 -8.9120 2.6962 2.6962 2.9211 2.9211 4.3581 4.3581 4.6823 4.6823 5.2533 5.2533 5.4656 5.4656 6.0247 6.0247 6.3537 6.3537 6.4638 6.4638 6.6169 6.6169 7.8838 7.8838 9.5491 9.5491 13.5190 13.5190 17.7665 17.7666 k =-0.0841 0.1634 0.2313 ( 6199 PWs) bands (ev): -76.6618 -76.6618 -45.4604 -45.4604 -41.1166 -41.1166 -40.8139 -40.8139 -35.1123 -35.1123 -35.0245 -35.0245 -9.5591 -9.5591 -8.9238 -8.9238 2.7091 2.7091 2.9315 2.9315 4.3377 4.3377 4.7058 4.7058 5.2546 5.2546 5.4734 5.4734 6.0047 6.0047 6.3586 6.3586 6.4882 6.4882 6.6248 6.6248 7.8915 7.8915 9.5814 9.5814 13.5780 13.5780 17.6882 17.6882 k =-0.0888 0.1725 0.2442 ( 6195 PWs) bands (ev): -76.6617 -76.6617 -45.4608 -45.4608 -41.1163 -41.1163 -40.8155 -40.8155 -35.1108 -35.1108 -35.0245 -35.0245 -9.5645 -9.5645 -8.9359 -8.9359 2.7226 2.7226 2.9425 2.9425 4.3172 4.3172 4.7291 4.7291 5.2559 5.2559 5.4827 5.4827 5.9841 5.9841 6.3605 6.3605 6.5132 6.5132 6.6353 6.6353 7.8997 7.8997 9.6160 9.6160 13.6397 13.6397 17.6051 17.6051 k =-0.0934 0.1816 0.2570 ( 6205 PWs) bands (ev): -76.6615 -76.6615 -45.4612 -45.4612 -41.1161 -41.1161 -40.8173 -40.8173 -35.1091 -35.1091 -35.0245 -35.0245 -9.5700 -9.5700 -8.9485 -8.9485 2.7366 2.7366 2.9542 2.9542 4.2968 4.2968 4.7517 4.7517 5.2571 5.2571 5.4934 5.4934 5.9629 5.9629 6.3599 6.3599 6.5390 6.5390 6.6479 6.6479 7.9082 7.9082 9.6529 9.6529 13.7039 13.7039 17.5173 17.5173 k =-0.0981 0.1906 0.2699 ( 6213 PWs) bands (ev): -76.6614 -76.6614 -45.4616 -45.4616 -41.1159 -41.1159 -40.8190 -40.8190 -35.1075 -35.1075 -35.0245 -35.0245 -9.5756 -9.5756 -8.9613 -8.9613 2.7511 2.7511 2.9665 2.9665 4.2768 4.2768 4.7733 4.7733 5.2582 5.2582 5.5055 5.5055 5.9414 5.9414 6.3569 6.3569 6.5656 6.5656 6.6621 6.6621 7.9172 7.9172 9.6922 9.6922 13.7705 13.7705 17.4250 17.4250 k =-0.1028 0.1997 0.2827 ( 6211 PWs) bands (ev): -76.6612 -76.6612 -45.4621 -45.4621 -41.1157 -41.1157 -40.8208 -40.8208 -35.1057 -35.1057 -35.0245 -35.0245 -9.5813 -9.5813 -8.9745 -8.9745 2.7660 2.7660 2.9794 2.9794 4.2571 4.2571 4.7936 4.7936 5.2592 5.2592 5.5190 5.5190 5.9196 5.9196 6.3522 6.3522 6.5932 6.5932 6.6773 6.6773 7.9265 7.9265 9.7339 9.7339 13.8393 13.8393 17.3283 17.3283 k =-0.1074 0.2088 0.2956 ( 6211 PWs) bands (ev): -76.6611 -76.6611 -45.4625 -45.4625 -41.1155 -41.1155 -40.8226 -40.8226 -35.1039 -35.1039 -35.0246 -35.0246 -9.5870 -9.5870 -8.9880 -8.9880 2.7814 2.7814 2.9929 2.9929 4.2380 4.2380 4.8124 4.8124 5.2600 5.2600 5.5336 5.5336 5.8977 5.8977 6.3460 6.3460 6.6217 6.6217 6.6932 6.6932 7.9362 7.9362 9.7781 9.7781 13.9103 13.9103 17.2273 17.2273 k =-0.1121 0.2179 0.3084 ( 6213 PWs) bands (ev): -76.6609 -76.6609 -45.4629 -45.4629 -41.1153 -41.1153 -40.8244 -40.8244 -35.1021 -35.1021 -35.0246 -35.0246 -9.5927 -9.5927 -9.0016 -9.0016 2.7972 2.7972 3.0070 3.0070 4.2196 4.2196 4.8295 4.8295 5.2607 5.2607 5.5492 5.5492 5.8759 5.8759 6.3389 6.3389 6.6509 6.6509 6.7096 6.7096 7.9463 7.9463 9.8249 9.8249 13.9833 13.9833 17.1224 17.1224 k =-0.1168 0.2270 0.3213 ( 6205 PWs) bands (ev): -76.6607 -76.6607 -45.4634 -45.4634 -41.1150 -41.1150 -40.8263 -40.8263 -35.1002 -35.1002 -35.0247 -35.0247 -9.5985 -9.5985 -9.0155 -9.0155 2.8133 2.8133 3.0216 3.0216 4.2018 4.2018 4.8449 4.8449 5.2613 5.2613 5.5651 5.5651 5.8544 5.8544 6.3310 6.3310 6.6801 6.6801 6.7269 6.7269 7.9567 7.9567 9.8744 9.8744 14.0581 14.0581 17.0136 17.0136 k =-0.1215 0.2360 0.3341 ( 6213 PWs) bands (ev): -76.6606 -76.6606 -45.4639 -45.4639 -41.1148 -41.1148 -40.8282 -40.8282 -35.0983 -35.0983 -35.0248 -35.0248 -9.6042 -9.6042 -9.0295 -9.0295 2.8297 2.8297 3.0367 3.0367 4.1849 4.1849 4.8583 4.8583 5.2617 5.2617 5.5810 5.5810 5.8335 5.8335 6.3226 6.3226 6.7077 6.7077 6.7465 6.7465 7.9674 7.9674 9.9266 9.9266 14.1345 14.1345 16.9013 16.9013 k =-0.1261 0.2451 0.3470 ( 6205 PWs) bands (ev): -76.6604 -76.6604 -45.4643 -45.4643 -41.1146 -41.1146 -40.8300 -40.8300 -35.0964 -35.0964 -35.0250 -35.0250 -9.6098 -9.6098 -9.0436 -9.0436 2.8464 2.8464 3.0522 3.0522 4.1687 4.1687 4.8700 4.8700 5.2619 5.2619 5.5960 5.5960 5.8139 5.8139 6.3140 6.3140 6.7304 6.7304 6.7716 6.7716 7.9785 7.9785 9.9816 9.9816 14.2124 14.2124 16.7855 16.7855 k =-0.1308 0.2542 0.3598 ( 6205 PWs) bands (ev): -76.6602 -76.6602 -45.4648 -45.4648 -41.1144 -41.1144 -40.8319 -40.8319 -35.0944 -35.0944 -35.0251 -35.0251 -9.6153 -9.6153 -9.0578 -9.0578 2.8633 2.8633 3.0682 3.0682 4.1534 4.1534 4.8799 4.8799 5.2620 5.2620 5.6090 5.6090 5.7963 5.7963 6.3052 6.3052 6.7474 6.7474 6.8028 6.8028 7.9899 7.9899 10.0396 10.0396 14.2916 14.2916 16.6667 16.6667 k =-0.1355 0.2633 0.3727 ( 6209 PWs) bands (ev): -76.6601 -76.6601 -45.4652 -45.4652 -41.1141 -41.1141 -40.8338 -40.8338 -35.0924 -35.0924 -35.0253 -35.0253 -9.6208 -9.6208 -9.0720 -9.0720 2.8804 2.8804 3.0846 3.0846 4.1390 4.1390 4.8881 4.8881 5.2619 5.2619 5.6186 5.6186 5.7819 5.7819 6.2964 6.2964 6.7604 6.7604 6.8383 6.8383 8.0016 8.0016 10.1005 10.1005 14.3719 14.3719 16.5449 16.5449 k =-0.1401 0.2723 0.3855 ( 6209 PWs) bands (ev): -76.6599 -76.6599 -45.4657 -45.4657 -41.1139 -41.1139 -40.8356 -40.8356 -35.0904 -35.0904 -35.0256 -35.0256 -9.6261 -9.6261 -9.0861 -9.0861 2.8976 2.8976 3.1013 3.1013 4.1255 4.1255 4.8948 4.8948 5.2617 5.2617 5.6229 5.6229 5.7724 5.7724 6.2877 6.2877 6.7709 6.7709 6.8764 6.8764 8.0135 8.0135 10.1645 10.1645 14.4529 14.4529 16.4204 16.4204 k =-0.1448 0.2814 0.3984 ( 6201 PWs) bands (ev): -76.6598 -76.6598 -45.4661 -45.4661 -41.1137 -41.1137 -40.8374 -40.8374 -35.0884 -35.0884 -35.0258 -35.0258 -9.6312 -9.6312 -9.1003 -9.1003 2.9150 2.9150 3.1182 3.1182 4.1129 4.1129 4.9000 4.9000 5.2614 5.2614 5.6205 5.6205 5.7689 5.7689 6.2791 6.2791 6.7795 6.7795 6.9164 6.9164 8.0257 8.0257 10.2317 10.2317 14.5345 14.5345 16.2936 16.2936 k =-0.1495 0.2905 0.4112 ( 6199 PWs) bands (ev): -76.6596 -76.6596 -45.4666 -45.4666 -41.1135 -41.1135 -40.8392 -40.8392 -35.0863 -35.0863 -35.0262 -35.0262 -9.6361 -9.6361 -9.1143 -9.1143 2.9324 2.9324 3.1353 3.1353 4.1014 4.1014 4.9038 4.9038 5.2609 5.2609 5.6115 5.6115 5.7712 5.7712 6.2706 6.2706 6.7864 6.7864 6.9580 6.9580 8.0382 8.0382 10.3021 10.3021 14.6164 14.6164 16.1646 16.1646 k =-0.1542 0.2996 0.4241 ( 6199 PWs) bands (ev): -76.6594 -76.6594 -45.4670 -45.4670 -41.1133 -41.1133 -40.8410 -40.8410 -35.0842 -35.0842 -35.0265 -35.0265 -9.6408 -9.6408 -9.1281 -9.1281 2.9498 2.9498 3.1525 3.1525 4.0908 4.0908 4.9065 4.9065 5.2604 5.2604 5.5974 5.5974 5.7776 5.7776 6.2624 6.2624 6.7917 6.7917 7.0008 7.0008 8.0509 8.0509 10.3757 10.3757 14.6982 14.6982 16.0339 16.0339 k =-0.1588 0.3087 0.4370 ( 6205 PWs) bands (ev): -76.6593 -76.6593 -45.4674 -45.4674 -41.1131 -41.1131 -40.8427 -40.8427 -35.0822 -35.0822 -35.0269 -35.0269 -9.6453 -9.6453 -9.1418 -9.1418 2.9673 2.9673 3.1697 3.1697 4.0813 4.0813 4.9081 4.9081 5.2597 5.2597 5.5797 5.5797 5.7864 5.7864 6.2542 6.2542 6.7956 6.7956 7.0445 7.0445 8.0639 8.0639 10.4526 10.4526 14.7795 14.7795 15.9016 15.9016 k =-0.1635 0.3177 0.4498 ( 6213 PWs) bands (ev): -76.6592 -76.6592 -45.4679 -45.4679 -41.1128 -41.1128 -40.8443 -40.8443 -35.0801 -35.0801 -35.0274 -35.0274 -9.6495 -9.6495 -9.1553 -9.1553 2.9846 2.9846 3.1869 3.1869 4.0728 4.0728 4.9087 4.9087 5.2590 5.2590 5.5598 5.5598 5.7963 5.7963 6.2463 6.2463 6.7980 6.7980 7.0889 7.0889 8.0770 8.0770 10.5329 10.5329 14.8599 14.8599 15.7683 15.7683 k =-0.1682 0.3268 0.4627 ( 6213 PWs) bands (ev): -76.6590 -76.6590 -45.4683 -45.4683 -41.1127 -41.1127 -40.8460 -40.8460 -35.0780 -35.0780 -35.0279 -35.0279 -9.6534 -9.6534 -9.1686 -9.1686 3.0018 3.0018 3.2040 3.2040 4.0653 4.0653 4.9086 4.9086 5.2583 5.2583 5.5385 5.5385 5.8062 5.8062 6.2385 6.2385 6.7990 6.7990 7.1338 7.1338 8.0903 8.0903 10.6166 10.6166 14.9388 14.9388 15.6344 15.6344 k =-0.1728 0.3359 0.4755 ( 6213 PWs) bands (ev): -76.6589 -76.6589 -45.4686 -45.4686 -41.1125 -41.1125 -40.8475 -40.8475 -35.0760 -35.0760 -35.0284 -35.0284 -9.6570 -9.6570 -9.1815 -9.1815 3.0189 3.0189 3.2208 3.2208 4.0589 4.0589 4.9077 4.9077 5.2577 5.2577 5.5164 5.5164 5.8159 5.8159 6.2307 6.2307 6.7987 6.7987 7.1786 7.1786 8.1037 8.1037 10.7035 10.7035 15.0152 15.0152 15.5009 15.5009 k =-0.1775 0.3450 0.4884 ( 6215 PWs) bands (ev): -76.6587 -76.6587 -45.4690 -45.4690 -41.1123 -41.1123 -40.8490 -40.8490 -35.0739 -35.0739 -35.0290 -35.0290 -9.6603 -9.6603 -9.1942 -9.1942 3.0358 3.0358 3.2372 3.2372 4.0536 4.0536 4.9063 4.9063 5.2570 5.2570 5.4936 5.4936 5.8249 5.8249 6.2231 6.2231 6.7972 6.7972 7.2233 7.2233 8.1173 8.1173 10.7937 10.7937 15.0866 15.0866 15.3702 15.3702 k =-0.1822 0.3541 0.5012 ( 6207 PWs) bands (ev): -76.6586 -76.6586 -45.4694 -45.4694 -41.1121 -41.1121 -40.8505 -40.8505 -35.0719 -35.0719 -35.0297 -35.0297 -9.6632 -9.6632 -9.2065 -9.2065 3.0524 3.0524 3.2533 3.2533 4.0493 4.0493 4.9044 4.9044 5.2565 5.2565 5.4704 5.4704 5.8331 5.8331 6.2154 6.2154 6.7947 6.7947 7.2674 7.2674 8.1311 8.1311 10.8870 10.8870 15.1361 15.1361 15.2590 15.2590 k =-0.1869 0.3631 0.5141 ( 6217 PWs) bands (ev): -76.6585 -76.6585 -45.4697 -45.4697 -41.1119 -41.1119 -40.8518 -40.8518 -35.0699 -35.0699 -35.0304 -35.0304 -9.6657 -9.6657 -9.2184 -9.2184 3.0688 3.0688 3.2688 3.2688 4.0461 4.0461 4.9021 4.9021 5.2562 5.2562 5.4469 5.4469 5.8405 5.8405 6.2077 6.2077 6.7911 6.7911 7.3106 7.3106 8.1449 8.1449 10.9832 10.9832 15.0707 15.0707 15.2603 15.2603 k =-0.1915 0.3722 0.5269 ( 6217 PWs) bands (ev): -76.6584 -76.6584 -45.4700 -45.4700 -41.1118 -41.1118 -40.8531 -40.8531 -35.0678 -35.0678 -35.0311 -35.0311 -9.6678 -9.6678 -9.2299 -9.2299 3.0848 3.0848 3.2836 3.2836 4.0440 4.0440 4.8997 4.8997 5.2560 5.2560 5.4233 5.4233 5.8469 5.8469 6.1998 6.1998 6.7866 6.7866 7.3526 7.3526 8.1587 8.1587 11.0822 11.0822 14.9469 14.9469 15.3173 15.3173 k =-0.1962 0.3813 0.5398 ( 6217 PWs) bands (ev): -76.6583 -76.6583 -45.4703 -45.4703 -41.1116 -41.1116 -40.8543 -40.8543 -35.0659 -35.0659 -35.0319 -35.0319 -9.6695 -9.6695 -9.2410 -9.2410 3.1004 3.1004 3.2977 3.2977 4.0430 4.0430 4.8971 4.8971 5.2560 5.2560 5.3994 5.3994 5.8525 5.8525 6.1917 6.1917 6.7814 6.7814 7.3930 7.3930 8.1726 8.1726 11.1835 11.1835 14.8187 14.8187 15.3763 15.3763 k =-0.2009 0.3904 0.5526 ( 6209 PWs) bands (ev): -76.6582 -76.6582 -45.4706 -45.4706 -41.1115 -41.1115 -40.8554 -40.8554 -35.0639 -35.0639 -35.0328 -35.0328 -9.6708 -9.6708 -9.2517 -9.2517 3.1156 3.1156 3.3109 3.3109 4.0431 4.0431 4.8945 4.8945 5.2563 5.2563 5.3755 5.3755 5.8571 5.8571 6.1833 6.1833 6.7756 6.7756 7.4317 7.4317 8.1866 8.1866 11.2867 11.2867 14.6917 14.6917 15.4315 15.4315 k =-0.2055 0.3994 0.5655 ( 6209 PWs) bands (ev): -76.6581 -76.6581 -45.4709 -45.4709 -41.1114 -41.1114 -40.8564 -40.8564 -35.0620 -35.0620 -35.0337 -35.0337 -9.6716 -9.6716 -9.2618 -9.2618 3.1303 3.1303 3.3232 3.3232 4.0443 4.0443 4.8919 4.8919 5.2568 5.2568 5.3515 5.3515 5.8610 5.8610 6.1746 6.1746 6.7692 6.7692 7.4682 7.4682 8.2005 8.2005 11.3911 11.3911 14.5679 14.5679 15.4811 15.4811 k =-0.2102 0.4085 0.5783 ( 6215 PWs) bands (ev): -76.6580 -76.6580 -45.4711 -45.4711 -41.1113 -41.1113 -40.8574 -40.8574 -35.0601 -35.0601 -35.0347 -35.0347 -9.6720 -9.6720 -9.2714 -9.2714 3.1446 3.1446 3.3345 3.3345 4.0466 4.0466 4.8895 4.8895 5.2575 5.2575 5.3276 5.3276 5.8640 5.8640 6.1654 6.1654 6.7625 6.7625 7.5024 7.5024 8.2144 8.2144 11.4959 11.4959 14.4487 14.4487 15.5241 15.5241 k =-0.2149 0.4176 0.5912 ( 6219 PWs) bands (ev): -76.6579 -76.6579 -45.4713 -45.4713 -41.1112 -41.1112 -40.8582 -40.8582 -35.0582 -35.0582 -35.0357 -35.0357 -9.6719 -9.6719 -9.2805 -9.2805 3.1583 3.1583 3.3447 3.3447 4.0501 4.0501 4.8874 4.8874 5.2578 5.2578 5.3044 5.3044 5.8662 5.8662 6.1557 6.1557 6.7556 6.7556 7.5339 7.5339 8.2282 8.2282 11.6000 11.6000 14.3356 14.3356 15.5597 15.5597 k =-0.2196 0.4267 0.6040 ( 6219 PWs) bands (ev): -76.6579 -76.6579 -45.4715 -45.4715 -41.1111 -41.1111 -40.8589 -40.8589 -35.0564 -35.0564 -35.0368 -35.0368 -9.6714 -9.6714 -9.2891 -9.2891 3.1714 3.1714 3.3537 3.3537 4.0546 4.0546 4.8856 4.8856 5.2554 5.2554 5.2842 5.2842 5.8676 5.8676 6.1453 6.1453 6.7486 6.7486 7.5625 7.5625 8.2419 8.2419 11.7018 11.7018 14.2305 14.2305 15.5871 15.5871 k =-0.2242 0.4358 0.6169 ( 6213 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1110 -41.1110 -40.8596 -40.8596 -35.0546 -35.0546 -35.0379 -35.0379 -9.6703 -9.6703 -9.2971 -9.2971 3.1839 3.1839 3.3614 3.3614 4.0603 4.0603 4.8841 4.8841 5.2429 5.2429 5.2746 5.2746 5.8684 5.8684 6.1342 6.1342 6.7417 6.7417 7.5881 7.5881 8.2555 8.2555 11.7995 11.7995 14.1356 14.1356 15.6058 15.6058 k =-0.2289 0.4448 0.6297 ( 6227 PWs) bands (ev): -76.6578 -76.6578 -45.4718 -45.4718 -41.1109 -41.1109 -40.8601 -40.8601 -35.0529 -35.0529 -35.0391 -35.0391 -9.6688 -9.6688 -9.3045 -9.3045 3.1957 3.1957 3.3679 3.3679 4.0670 4.0670 4.8830 4.8830 5.2212 5.2212 5.2745 5.2745 5.8684 5.8684 6.1224 6.1224 6.7349 6.7349 7.6104 7.6104 8.2689 8.2689 11.8907 11.8907 14.0535 14.0535 15.6153 15.6153 k =-0.2336 0.4539 0.6426 ( 6227 PWs) bands (ev): -76.6577 -76.6577 -45.4719 -45.4719 -41.1109 -41.1109 -40.8606 -40.8606 -35.0512 -35.0512 -35.0404 -35.0404 -9.6668 -9.6668 -9.3114 -9.3114 3.2068 3.2068 3.3732 3.3732 4.0749 4.0749 4.8824 4.8824 5.1968 5.1968 5.2776 5.2776 5.8678 5.8678 6.1097 6.1097 6.7285 6.7285 7.6291 7.6291 8.2822 8.2822 11.9722 11.9722 13.9875 13.9875 15.6156 15.6156 k =-0.2382 0.4630 0.6554 ( 6227 PWs) bands (ev): -76.6577 -76.6577 -45.4720 -45.4720 -41.1109 -41.1109 -40.8609 -40.8609 -35.0496 -35.0496 -35.0417 -35.0417 -9.6642 -9.6642 -9.3176 -9.3176 3.2172 3.2172 3.3772 3.3772 4.0839 4.0839 4.8823 4.8823 5.1716 5.1716 5.2820 5.2820 5.8665 5.8665 6.0961 6.0961 6.7224 6.7224 7.6442 7.6442 8.2952 8.2952 12.0408 12.0408 13.9413 13.9413 15.6066 15.6066 k =-0.2429 0.4721 0.6683 ( 6215 PWs) bands (ev): -76.6577 -76.6577 -45.4720 -45.4720 -41.1108 -41.1108 -40.8611 -40.8611 -35.0480 -35.0480 -35.0431 -35.0431 -9.6612 -9.6612 -9.3233 -9.3233 3.2267 3.2267 3.3799 3.3799 4.0940 4.0940 4.8826 4.8826 5.1459 5.1459 5.2875 5.2875 5.8645 5.8645 6.0816 6.0816 6.7168 6.7168 7.6554 7.6554 8.3081 8.3081 12.0931 12.0931 13.9184 13.9184 15.5885 15.5885 k =-0.2476 0.4811 0.6811 ( 6219 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8612 -40.8612 -35.0464 -35.0464 -35.0445 -35.0445 -9.6576 -9.6576 -9.3283 -9.3283 3.2354 3.2354 3.3816 3.3816 4.1052 4.1052 4.8833 4.8833 5.1198 5.1198 5.2939 5.2939 5.8619 5.8619 6.0661 6.0661 6.7117 6.7117 7.6626 7.6626 8.3207 8.3207 12.1264 12.1264 13.9216 13.9216 15.5617 15.5617 k =-0.2523 0.4902 0.6940 ( 6219 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8612 -40.8612 -35.0460 -35.0460 -35.0449 -35.0449 -9.6535 -9.6535 -9.3327 -9.3327 3.2432 3.2432 3.3821 3.3821 4.1175 4.1175 4.8845 4.8845 5.0934 5.0934 5.3012 5.3012 5.8586 5.8586 6.0498 6.0498 6.7072 6.7072 7.6657 7.6657 8.3331 8.3331 12.1395 12.1395 13.9523 13.9523 15.5269 15.5269 k =-0.2569 0.4993 0.7068 ( 6219 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8611 -40.8611 -35.0475 -35.0475 -35.0435 -35.0435 -9.6490 -9.6490 -9.3364 -9.3364 3.2500 3.2500 3.3817 3.3817 4.1309 4.1309 4.8859 4.8859 5.0668 5.0668 5.3094 5.3094 5.8547 5.8547 6.0325 6.0325 6.7033 6.7033 7.6645 7.6645 8.3451 8.3451 12.1333 12.1333 14.0099 14.0099 15.4846 15.4846 k =-0.2616 0.5084 0.7197 ( 6223 PWs) bands (ev): -76.6577 -76.6577 -45.4720 -45.4720 -41.1109 -41.1109 -40.8609 -40.8609 -35.0491 -35.0491 -35.0421 -35.0421 -9.6439 -9.6439 -9.3396 -9.3396 3.2557 3.2557 3.3806 3.3806 4.1453 4.1453 4.8876 4.8876 5.0400 5.0400 5.3185 5.3185 5.8501 5.8501 6.0143 6.0143 6.6999 6.6999 7.6589 7.6589 8.3569 8.3569 12.1102 12.1102 14.0920 14.0920 15.4357 15.4357 k =-0.2663 0.5175 0.7325 ( 6213 PWs) bands (ev): -76.6577 -76.6577 -45.4719 -45.4719 -41.1109 -41.1109 -40.8606 -40.8606 -35.0508 -35.0508 -35.0408 -35.0408 -9.6384 -9.6384 -9.3421 -9.3421 3.2602 3.2602 3.3788 3.3788 4.1608 4.1608 4.8894 4.8894 5.0130 5.0130 5.3285 5.3285 5.8448 5.8448 5.9953 5.9953 6.6971 6.6971 7.6490 7.6490 8.3684 8.3684 12.0737 12.0737 14.1953 14.1953 15.3807 15.3807 k =-0.2709 0.5265 0.7454 ( 6213 PWs) bands (ev): -76.6578 -76.6578 -45.4718 -45.4718 -41.1110 -41.1110 -40.8602 -40.8602 -35.0524 -35.0524 -35.0395 -35.0395 -9.6324 -9.6324 -9.3440 -9.3440 3.2635 3.2635 3.3765 3.3765 4.1773 4.1773 4.8911 4.8911 4.9860 4.9860 5.3394 5.3394 5.8388 5.8388 5.9755 5.9755 6.6948 6.6948 7.6345 7.6345 8.3796 8.3796 12.0272 12.0272 14.3163 14.3163 15.3206 15.3206 k =-0.2756 0.5356 0.7582 ( 6221 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1110 -41.1110 -40.8596 -40.8596 -35.0542 -35.0542 -35.0383 -35.0383 -9.6259 -9.6259 -9.3453 -9.3453 3.2655 3.2655 3.3741 3.3741 4.1949 4.1949 4.8923 4.8923 4.9594 4.9594 5.3512 5.3512 5.8321 5.8321 5.9551 5.9551 6.6930 6.6930 7.6155 7.6155 8.3905 8.3905 11.9741 11.9741 14.4516 14.4516 15.2561 15.2561 k =-0.2756 0.5356 0.7582 ( 6221 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1110 -41.1110 -40.8596 -40.8596 -35.0542 -35.0542 -35.0383 -35.0383 -9.6259 -9.6259 -9.3453 -9.3453 3.2655 3.2655 3.3741 3.3741 4.1949 4.1949 4.8923 4.8923 4.9594 4.9594 5.3512 5.3512 5.8321 5.8321 5.9551 5.9551 6.6930 6.6930 7.6155 7.6155 8.3905 8.3905 11.9741 11.9741 14.4516 14.4516 15.2561 15.2561 k =-0.2698 0.5243 0.7683 ( 6221 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1110 -41.1110 -40.8596 -40.8596 -35.0542 -35.0542 -35.0383 -35.0383 -9.6257 -9.6257 -9.3453 -9.3453 3.2662 3.2662 3.3747 3.3747 4.1956 4.1956 4.8803 4.8803 4.9641 4.9641 5.3542 5.3542 5.8356 5.8356 5.9555 5.9555 6.6921 6.6921 7.6148 7.6148 8.3884 8.3884 11.9743 11.9743 14.4520 14.4520 15.2587 15.2587 k =-0.2640 0.5130 0.7784 ( 6221 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1110 -41.1110 -40.8596 -40.8596 -35.0541 -35.0541 -35.0383 -35.0383 -9.6252 -9.6252 -9.3455 -9.3455 3.2682 3.2682 3.3766 3.3766 4.1977 4.1977 4.8528 4.8528 4.9699 4.9699 5.3635 5.3635 5.8456 5.8456 5.9567 5.9567 6.6894 6.6894 7.6126 7.6126 8.3821 8.3821 11.9751 11.9751 14.4533 14.4533 15.2664 15.2664 k =-0.2582 0.5017 0.7885 ( 6218 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1111 -41.1111 -40.8596 -40.8596 -35.0541 -35.0541 -35.0384 -35.0384 -9.6244 -9.6244 -9.3458 -9.3458 3.2715 3.2715 3.3799 3.3799 4.2013 4.2013 4.8178 4.8178 4.9692 4.9692 5.3796 5.3796 5.8608 5.8608 5.9592 5.9592 6.6849 6.6849 7.6091 7.6091 8.3716 8.3716 11.9763 11.9763 14.4554 14.4554 15.2791 15.2791 k =-0.2523 0.4904 0.7986 ( 6222 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1111 -41.1111 -40.8596 -40.8596 -35.0541 -35.0541 -35.0384 -35.0384 -9.6232 -9.6232 -9.3462 -9.3462 3.2761 3.2761 3.3844 3.3844 4.2063 4.2063 4.7785 4.7785 4.9599 4.9599 5.4025 5.4025 5.8791 5.8791 5.9638 5.9638 6.6787 6.6787 7.6041 7.6041 8.3571 8.3571 11.9779 11.9779 14.4585 14.4585 15.2968 15.2968 k =-0.2465 0.4791 0.8087 ( 6231 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1111 -41.1111 -40.8596 -40.8596 -35.0540 -35.0540 -35.0384 -35.0384 -9.6217 -9.6217 -9.3467 -9.3467 3.2821 3.2821 3.3901 3.3901 4.2126 4.2126 4.7366 4.7366 4.9425 4.9425 5.4315 5.4315 5.8973 5.8973 5.9722 5.9722 6.6708 6.6708 7.5978 7.5978 8.3388 8.3388 11.9797 11.9797 14.4627 14.4627 15.3191 15.3191 k =-0.2407 0.4678 0.8188 ( 6235 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1112 -41.1112 -40.8596 -40.8596 -35.0539 -35.0539 -35.0385 -35.0385 -9.6200 -9.6200 -9.3473 -9.3473 3.2893 3.2893 3.3971 3.3971 4.2202 4.2202 4.6927 4.6927 4.9184 4.9184 5.4656 5.4656 5.9118 5.9118 5.9868 5.9868 6.6612 6.6612 7.5904 7.5904 8.3167 8.3167 11.9816 11.9816 14.4683 14.4683 15.3459 15.3459 k =-0.2349 0.4565 0.8289 ( 6234 PWs) bands (ev): -76.6578 -76.6578 -45.4718 -45.4718 -41.1112 -41.1112 -40.8596 -40.8596 -35.0538 -35.0538 -35.0385 -35.0385 -9.6179 -9.6179 -9.3480 -9.3480 3.2978 3.2978 3.4053 3.4053 4.2292 4.2292 4.6476 4.6476 4.8895 4.8895 5.5034 5.5034 5.9207 5.9207 6.0085 6.0085 6.6501 6.6501 7.5818 7.5818 8.2912 8.2912 11.9834 11.9834 14.4753 14.4753 15.3770 15.3770 k =-0.2291 0.4452 0.8390 ( 6236 PWs) bands (ev): -76.6578 -76.6578 -45.4718 -45.4718 -41.1113 -41.1113 -40.8596 -40.8596 -35.0538 -35.0538 -35.0386 -35.0386 -9.6155 -9.6155 -9.3489 -9.3489 3.3076 3.3076 3.4147 3.4147 4.2392 4.2392 4.6015 4.6015 4.8574 4.8574 5.5439 5.5439 5.9250 5.9250 6.0350 6.0350 6.6376 6.6376 7.5722 7.5722 8.2625 8.2625 11.9849 11.9849 14.4841 14.4841 15.4118 15.4118 k =-0.2233 0.4339 0.8491 ( 6232 PWs) bands (ev): -76.6578 -76.6578 -45.4718 -45.4718 -41.1113 -41.1113 -40.8596 -40.8596 -35.0536 -35.0536 -35.0387 -35.0387 -9.6129 -9.6129 -9.3498 -9.3498 3.3186 3.3186 3.4252 3.4252 4.2503 4.2503 4.5548 4.5548 4.8235 4.8235 5.5862 5.5862 5.9263 5.9263 6.0639 6.0639 6.6237 6.6237 7.5617 7.5617 8.2308 8.2308 11.9859 11.9859 14.4949 14.4949 15.4502 15.4502 k =-0.2174 0.4226 0.8592 ( 6226 PWs) bands (ev): -76.6578 -76.6578 -45.4718 -45.4718 -41.1114 -41.1114 -40.8597 -40.8597 -35.0535 -35.0535 -35.0388 -35.0388 -9.6100 -9.6100 -9.3508 -9.3508 3.3308 3.3308 3.4368 3.4368 4.2621 4.2621 4.5080 4.5080 4.7887 4.7887 5.6297 5.6297 5.9255 5.9255 6.0935 6.0935 6.6087 6.6087 7.5505 7.5505 8.1965 8.1965 11.9861 11.9861 14.5080 14.5080 15.4917 15.4917 k =-0.2116 0.4113 0.8693 ( 6234 PWs) bands (ev): -76.6578 -76.6578 -45.4719 -45.4719 -41.1115 -41.1115 -40.8597 -40.8597 -35.0534 -35.0534 -35.0389 -35.0389 -9.6068 -9.6068 -9.3519 -9.3519 3.3442 3.3442 3.4494 3.4494 4.2740 4.2740 4.4617 4.4617 4.7540 4.7540 5.6738 5.6738 5.9231 5.9231 6.1228 6.1228 6.5926 6.5926 7.5388 7.5388 8.1599 8.1599 11.9853 11.9853 14.5236 14.5236 15.5359 15.5359 k =-0.2058 0.4000 0.8794 ( 6236 PWs) bands (ev): -76.6578 -76.6578 -45.4719 -45.4719 -41.1116 -41.1116 -40.8597 -40.8597 -35.0533 -35.0533 -35.0390 -35.0390 -9.6035 -9.6035 -9.3530 -9.3530 3.3587 3.3587 3.4630 3.4630 4.2845 4.2845 4.4176 4.4176 4.7201 4.7201 5.7181 5.7181 5.9189 5.9189 6.1511 6.1511 6.5757 6.5757 7.5268 7.5268 8.1213 8.1213 11.9833 11.9833 14.5420 14.5420 15.5823 15.5823 k =-0.2000 0.3887 0.8895 ( 6234 PWs) bands (ev): -76.6578 -76.6578 -45.4719 -45.4719 -41.1116 -41.1116 -40.8597 -40.8597 -35.0531 -35.0531 -35.0391 -35.0391 -9.5999 -9.5999 -9.3542 -9.3542 3.3744 3.3744 3.4773 3.4773 4.2885 4.2885 4.3808 4.3808 4.6876 4.6876 5.7621 5.7621 5.9131 5.9131 6.1779 6.1779 6.5582 6.5582 7.5146 7.5146 8.0810 8.0810 11.9799 11.9799 14.5635 14.5635 15.6303 15.6303 k =-0.1942 0.3773 0.8996 ( 6232 PWs) bands (ev): -76.6578 -76.6578 -45.4720 -45.4720 -41.1117 -41.1117 -40.8597 -40.8597 -35.0529 -35.0529 -35.0392 -35.0392 -9.5961 -9.5961 -9.3555 -9.3555 3.3912 3.3912 3.4924 3.4924 4.2739 4.2739 4.3632 4.3632 4.6570 4.6571 5.8053 5.8053 5.9054 5.9054 6.2029 6.2029 6.5402 6.5402 7.5025 7.5025 8.0396 8.0396 11.9747 11.9747 14.5884 14.5884 15.6796 15.6796 k =-0.1884 0.3660 0.9097 ( 6224 PWs) bands (ev): -76.6578 -76.6578 -45.4720 -45.4720 -41.1118 -41.1118 -40.8597 -40.8597 -35.0528 -35.0528 -35.0393 -35.0393 -9.5922 -9.5922 -9.3568 -9.3568 3.4091 3.4091 3.5080 3.5080 4.2391 4.2391 4.3667 4.3667 4.6291 4.6291 5.8472 5.8472 5.8957 5.8957 6.2260 6.2260 6.5222 6.5222 7.4908 7.4908 7.9972 7.9972 11.9677 11.9677 14.6168 14.6168 15.7296 15.7296 k =-0.1825 0.3547 0.9198 ( 6222 PWs) bands (ev): -76.6578 -76.6578 -45.4720 -45.4720 -41.1119 -41.1119 -40.8597 -40.8597 -35.0526 -35.0526 -35.0394 -35.0394 -9.5881 -9.5881 -9.3582 -9.3582 3.4280 3.4280 3.5239 3.5239 4.1962 4.1962 4.3786 4.3786 4.6043 4.6043 5.8826 5.8826 5.8883 5.8883 6.2470 6.2470 6.5043 6.5043 7.4796 7.4796 7.9544 7.9544 11.9587 11.9587 14.6489 14.6489 15.7797 15.7797 k =-0.1767 0.3434 0.9299 ( 6228 PWs) bands (ev): -76.6578 -76.6578 -45.4721 -45.4721 -41.1120 -41.1120 -40.8597 -40.8597 -35.0524 -35.0524 -35.0396 -35.0396 -9.5839 -9.5839 -9.3596 -9.3596 3.4478 3.4478 3.5400 3.5400 4.1513 4.1513 4.3926 4.3926 4.5838 4.5838 5.8688 5.8688 5.9251 5.9251 6.2657 6.2657 6.4872 6.4872 7.4693 7.4693 7.9114 7.9114 11.9476 11.9476 14.6848 14.6848 15.8295 15.8295 k =-0.1709 0.3321 0.9400 ( 6230 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1121 -41.1121 -40.8597 -40.8597 -35.0522 -35.0522 -35.0398 -35.0398 -9.5796 -9.5796 -9.3610 -9.3610 3.4685 3.4685 3.5561 3.5561 4.1063 4.1063 4.4059 4.4059 4.5688 4.5688 5.8516 5.8516 5.9594 5.9594 6.2822 6.2822 6.4715 6.4715 7.4598 7.4598 7.8687 7.8687 11.9343 11.9343 14.7247 14.7247 15.8783 15.8783 k =-0.1651 0.3208 0.9501 ( 6236 PWs) bands (ev): -76.6577 -76.6577 -45.4722 -45.4722 -41.1122 -41.1122 -40.8597 -40.8597 -35.0520 -35.0520 -35.0399 -35.0399 -9.5752 -9.5752 -9.3625 -9.3625 3.4899 3.4899 3.5719 3.5719 4.0621 4.0621 4.4164 4.4164 4.5610 4.5610 5.8315 5.8315 5.9896 5.9896 6.2957 6.2957 6.4585 6.4585 7.4516 7.4516 7.8267 7.8267 11.9187 11.9187 14.7686 14.7686 15.9258 15.9258 k =-0.1593 0.3095 0.9602 ( 6234 PWs) bands (ev): -76.6577 -76.6577 -45.4722 -45.4722 -41.1123 -41.1123 -40.8597 -40.8597 -35.0517 -35.0517 -35.0401 -35.0401 -9.5708 -9.5708 -9.3639 -9.3639 3.5116 3.5116 3.5874 3.5874 4.0194 4.0194 4.4226 4.4226 4.5617 4.5617 5.8085 5.8085 6.0146 6.0146 6.3051 6.3051 6.4500 6.4500 7.4446 7.4446 7.7858 7.7858 11.9009 11.9009 14.8164 14.8164 15.9714 15.9714 k =-0.1535 0.2982 0.9703 ( 6222 PWs) bands (ev): -76.6577 -76.6577 -45.4722 -45.4722 -41.1125 -41.1125 -40.8597 -40.8597 -35.0515 -35.0515 -35.0403 -35.0403 -9.5664 -9.5664 -9.3653 -9.3653 3.5332 3.5332 3.6024 3.6024 3.9787 3.9787 4.4246 4.4246 4.5710 4.5710 5.7824 5.7824 6.0338 6.0338 6.3084 6.3084 6.4486 6.4486 7.4390 7.4390 7.7462 7.7462 11.8810 11.8810 14.8681 14.8681 16.0148 16.0148 k =-0.1476 0.2869 0.9804 ( 6226 PWs) bands (ev): -76.6577 -76.6577 -45.4723 -45.4723 -41.1126 -41.1126 -40.8598 -40.8598 -35.0513 -35.0513 -35.0404 -35.0404 -9.5619 -9.5619 -9.3667 -9.3667 3.5535 3.5535 3.6174 3.6174 3.9406 3.9406 4.4241 4.4241 4.5870 4.5870 5.7534 5.7534 6.0464 6.0464 6.3043 6.3043 6.4561 6.4561 7.4349 7.4349 7.7084 7.7084 11.8589 11.8589 14.9236 14.9236 16.0555 16.0555 k =-0.1418 0.2756 0.9905 ( 6224 PWs) bands (ev): -76.6577 -76.6577 -45.4723 -45.4723 -41.1127 -41.1127 -40.8598 -40.8598 -35.0510 -35.0510 -35.0406 -35.0406 -9.5575 -9.5575 -9.3681 -9.3681 3.5709 3.5709 3.6334 3.6334 3.9061 3.9061 4.4232 4.4232 4.6077 4.6077 5.7214 5.7214 6.0524 6.0524 6.2933 6.2933 6.4720 6.4720 7.4322 7.4322 7.6727 7.6727 11.8349 11.8349 14.9828 14.9828 16.0934 16.0934 k =-0.1360 0.2643 1.0006 ( 6226 PWs) bands (ev): -76.6577 -76.6577 -45.4724 -45.4724 -41.1128 -41.1128 -40.8598 -40.8598 -35.0508 -35.0508 -35.0408 -35.0408 -9.5532 -9.5532 -9.3695 -9.3695 3.5828 3.5828 3.6518 3.6518 3.8758 3.8758 4.4235 4.4235 4.6316 4.6316 5.6866 5.6866 6.0520 6.0520 6.2772 6.2772 6.4942 6.4942 7.4308 7.4308 7.6395 7.6395 11.8091 11.8091 15.0453 15.0453 16.1282 16.1282 k =-0.1302 0.2530 1.0107 ( 6233 PWs) bands (ev): -76.6577 -76.6577 -45.4724 -45.4724 -41.1129 -41.1129 -40.8598 -40.8598 -35.0505 -35.0505 -35.0410 -35.0410 -9.5489 -9.5489 -9.3708 -9.3708 3.5877 3.5877 3.6732 3.6732 3.8510 3.8510 4.4260 4.4260 4.6577 4.6577 5.6491 5.6491 6.0455 6.0455 6.2575 6.2575 6.5207 6.5207 7.4307 7.4307 7.6090 7.6090 11.7817 11.7817 15.1111 15.1111 16.1599 16.1599 k =-0.1244 0.2417 1.0208 ( 6231 PWs) bands (ev): -76.6577 -76.6577 -45.4724 -45.4724 -41.1130 -41.1130 -40.8598 -40.8598 -35.0502 -35.0502 -35.0413 -35.0413 -9.5447 -9.5447 -9.3720 -9.3720 3.5854 3.5854 3.6964 3.6964 3.8328 3.8328 4.4311 4.4311 4.6852 4.6852 5.6092 5.6092 6.0337 6.0337 6.2353 6.2353 6.5498 6.5498 7.4317 7.4317 7.5815 7.5815 11.7528 11.7528 15.1798 15.1798 16.1884 16.1884 k =-0.1186 0.2304 1.0309 ( 6227 PWs) bands (ev): -76.6577 -76.6577 -45.4725 -45.4725 -41.1131 -41.1131 -40.8598 -40.8598 -35.0500 -35.0500 -35.0415 -35.0415 -9.5407 -9.5407 -9.3732 -9.3732 3.5767 3.5767 3.7194 3.7194 3.8226 3.8226 4.4391 4.4391 4.7137 4.7137 5.5670 5.5670 6.0173 6.0173 6.2111 6.2111 6.5803 6.5803 7.4336 7.4336 7.5573 7.5573 11.7228 11.7228 15.2511 15.2511 16.2139 16.2139 k =-0.1127 0.2191 1.0410 ( 6219 PWs) bands (ev): -76.6577 -76.6577 -45.4725 -45.4725 -41.1132 -41.1132 -40.8598 -40.8598 -35.0497 -35.0497 -35.0417 -35.0417 -9.5368 -9.5368 -9.3743 -9.3743 3.5630 3.5630 3.7385 3.7385 3.8227 3.8227 4.4499 4.4499 4.7429 4.7429 5.5228 5.5228 5.9968 5.9968 6.1854 6.1854 6.6114 6.6114 7.4360 7.4360 7.5366 7.5366 11.6918 11.6918 15.3246 15.3246 16.2364 16.2364 k =-0.1069 0.2078 1.0511 ( 6217 PWs) bands (ev): -76.6577 -76.6577 -45.4726 -45.4726 -41.1133 -41.1133 -40.8598 -40.8598 -35.0494 -35.0494 -35.0419 -35.0419 -9.5332 -9.5332 -9.3753 -9.3753 3.5459 3.5459 3.7502 3.7502 3.8354 3.8354 4.4634 4.4634 4.7725 4.7725 5.4768 5.4768 5.9730 5.9730 6.1584 6.1584 6.6424 6.6424 7.4385 7.4385 7.5199 7.5199 11.6600 11.6600 15.4001 15.4001 16.2564 16.2564 k =-0.1011 0.1965 1.0612 ( 6219 PWs) bands (ev): -76.6577 -76.6577 -45.4726 -45.4726 -41.1134 -41.1134 -40.8598 -40.8598 -35.0491 -35.0491 -35.0422 -35.0422 -9.5297 -9.5297 -9.3762 -9.3762 3.5269 3.5269 3.7549 3.7549 3.8587 3.8587 4.4792 4.4792 4.8021 4.8021 5.4293 5.4293 5.9466 5.9466 6.1305 6.1305 6.6726 6.6726 7.4406 7.4406 7.5075 7.5075 11.6278 11.6278 15.4769 15.4769 16.2739 16.2739 k =-0.0953 0.1852 1.0713 ( 6217 PWs) bands (ev): -76.6577 -76.6577 -45.4726 -45.4726 -41.1135 -41.1135 -40.8598 -40.8598 -35.0488 -35.0488 -35.0424 -35.0424 -9.5264 -9.5264 -9.3771 -9.3771 3.5072 3.5072 3.7562 3.7562 3.8882 3.8882 4.4970 4.4970 4.8315 4.8315 5.3806 5.3806 5.9182 5.9182 6.1017 6.1017 6.7018 6.7018 7.4416 7.4416 7.5001 7.5001 11.5954 11.5954 15.5548 15.5548 16.2894 16.2894 k =-0.0895 0.1739 1.0814 ( 6215 PWs) bands (ev): -76.6577 -76.6577 -45.4727 -45.4727 -41.1135 -41.1135 -40.8598 -40.8598 -35.0485 -35.0485 -35.0427 -35.0427 -9.5234 -9.5234 -9.3778 -9.3778 3.4878 3.4878 3.7561 3.7561 3.9211 3.9211 4.5163 4.5163 4.8602 4.8602 5.3311 5.3311 5.8886 5.8886 6.0724 6.0724 6.7295 6.7295 7.4412 7.4412 7.4975 7.4975 11.5629 11.5629 15.6332 15.6332 16.3032 16.3032 k =-0.0836 0.1626 1.0915 ( 6211 PWs) bands (ev): -76.6577 -76.6577 -45.4727 -45.4727 -41.1136 -41.1136 -40.8599 -40.8599 -35.0482 -35.0482 -35.0429 -35.0429 -9.5207 -9.5207 -9.3784 -9.3784 3.4693 3.4693 3.7556 3.7556 3.9559 3.9559 4.5365 4.5365 4.8878 4.8878 5.2813 5.2813 5.8584 5.8584 6.0429 6.0429 6.7553 6.7553 7.4400 7.4400 7.4990 7.4990 11.5308 11.5308 15.7115 15.7115 16.3156 16.3156 k =-0.0778 0.1513 1.1016 ( 6213 PWs) bands (ev): -76.6577 -76.6577 -45.4727 -45.4727 -41.1137 -41.1137 -40.8599 -40.8599 -35.0480 -35.0480 -35.0432 -35.0432 -9.5183 -9.5183 -9.3789 -9.3789 3.4522 3.4522 3.7550 3.7550 3.9921 3.9921 4.5569 4.5569 4.9134 4.9134 5.2319 5.2319 5.8283 5.8283 6.0136 6.0136 6.7792 6.7792 7.4390 7.4390 7.5035 7.5035 11.4992 11.4992 15.7891 15.7891 16.3269 16.3269 k =-0.0720 0.1399 1.1117 ( 6219 PWs) bands (ev): -76.6577 -76.6577 -45.4727 -45.4727 -41.1137 -41.1137 -40.8599 -40.8599 -35.0477 -35.0477 -35.0434 -35.0434 -9.5161 -9.5161 -9.3792 -9.3792 3.4368 3.4368 3.7547 3.7547 4.0292 4.0292 4.5768 4.5768 4.9357 4.9357 5.1841 5.1841 5.7992 5.7992 5.9847 5.9847 6.8007 6.8007 7.4388 7.4388 7.5098 7.5098 11.4683 11.4683 15.8655 15.8655 16.3375 16.3375 k =-0.0662 0.1286 1.1218 ( 6213 PWs) bands (ev): -76.6577 -76.6577 -45.4728 -45.4728 -41.1138 -41.1138 -40.8599 -40.8599 -35.0474 -35.0474 -35.0437 -35.0437 -9.5143 -9.5143 -9.3795 -9.3795 3.4233 3.4233 3.7546 3.7546 4.0668 4.0668 4.5956 4.5956 4.9519 4.9519 5.1407 5.1407 5.7718 5.7718 5.9568 5.9568 6.8199 6.8199 7.4400 7.4400 7.5172 7.5172 11.4385 11.4385 15.9397 15.9397 16.3476 16.3476 k =-0.0662 0.1286 1.1218 ( 6213 PWs) bands (ev): -76.6577 -76.6577 -45.4728 -45.4728 -41.1138 -41.1138 -40.8599 -40.8599 -35.0474 -35.0474 -35.0437 -35.0437 -9.5143 -9.5143 -9.3795 -9.3795 3.4233 3.4233 3.7546 3.7546 4.0668 4.0668 4.5956 4.5956 4.9519 4.9519 5.1407 5.1407 5.7718 5.7718 5.9568 5.9568 6.8199 6.8199 7.4400 7.4400 7.5172 7.5172 11.4385 11.4385 15.9397 15.9397 16.3476 16.3476 k =-0.0588 0.1143 1.1218 ( 6213 PWs) bands (ev): -76.6576 -76.6576 -45.4729 -45.4729 -41.1138 -41.1138 -40.8602 -40.8602 -35.0468 -35.0468 -35.0440 -35.0440 -9.5154 -9.5154 -9.3809 -9.3809 3.4225 3.4225 3.7618 3.7618 4.1065 4.1065 4.5932 4.5932 4.9395 4.9395 5.1160 5.1160 5.7553 5.7553 5.9336 5.9336 6.8336 6.8336 7.4499 7.4499 7.5508 7.5508 11.3917 11.3917 15.9992 15.9992 16.3831 16.3831 k =-0.0515 0.1001 1.1218 ( 6211 PWs) bands (ev): -76.6576 -76.6576 -45.4729 -45.4729 -41.1138 -41.1138 -40.8605 -40.8605 -35.0462 -35.0462 -35.0442 -35.0442 -9.5164 -9.5164 -9.3822 -9.3822 3.4213 3.4213 3.7690 3.7690 4.1464 4.1464 4.5912 4.5912 4.9172 4.9172 5.1012 5.1012 5.7406 5.7406 5.9118 5.9118 6.8457 6.8457 7.4575 7.4575 7.5835 7.5835 11.3480 11.3480 16.0564 16.0564 16.4152 16.4152 k =-0.0441 0.0858 1.1218 ( 6209 PWs) bands (ev): -76.6576 -76.6576 -45.4730 -45.4730 -41.1138 -41.1138 -40.8608 -40.8608 -35.0458 -35.0458 -35.0444 -35.0444 -9.5172 -9.5172 -9.3833 -9.3833 3.4199 3.4199 3.7758 3.7758 4.1857 4.1857 4.5894 4.5894 4.8872 4.8872 5.0947 5.0947 5.7277 5.7277 5.8920 5.8920 6.8561 6.8561 7.4637 7.4637 7.6139 7.6139 11.3082 11.3082 16.1096 16.1096 16.4434 16.4434 k =-0.0368 0.0715 1.1218 ( 6207 PWs) bands (ev): -76.6576 -76.6576 -45.4731 -45.4731 -41.1138 -41.1138 -40.8610 -40.8610 -35.0454 -35.0454 -35.0446 -35.0446 -9.5180 -9.5180 -9.3842 -9.3842 3.4184 3.4184 3.7820 3.7820 4.2240 4.2240 4.5878 4.5878 4.8531 4.8531 5.0932 5.0932 5.7168 5.7168 5.8743 5.8743 6.8648 6.8648 7.4689 7.4689 7.6409 7.6409 11.2731 11.2731 16.1575 16.1575 16.4678 16.4678 k =-0.0294 0.0572 1.1218 ( 6215 PWs) bands (ev): -76.6575 -76.6575 -45.4731 -45.4731 -41.1138 -41.1138 -40.8612 -40.8612 -35.0450 -35.0450 -35.0447 -35.0447 -9.5185 -9.5185 -9.3850 -9.3850 3.4171 3.4171 3.7874 3.7874 4.2601 4.2601 4.5865 4.5865 4.8184 4.8184 5.0942 5.0942 5.7080 5.7080 5.8592 5.8592 6.8720 6.8720 7.4731 7.4731 7.6639 7.6639 11.2433 11.2433 16.1987 16.1987 16.4881 16.4881 k =-0.0221 0.0429 1.1218 ( 6205 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8613 -40.8613 -35.0448 -35.0448 -35.0448 -35.0448 -9.5190 -9.5190 -9.3856 -9.3856 3.4160 3.4160 3.7918 3.7918 4.2926 4.2926 4.5854 4.5854 4.7861 4.7861 5.0961 5.0961 5.7012 5.7012 5.8470 5.8470 6.8775 6.8775 7.4763 7.4763 7.6824 7.6824 11.2196 11.2196 16.2321 16.2321 16.5041 16.5041 k =-0.0147 0.0286 1.1218 ( 6203 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8614 -40.8614 -35.0449 -35.0449 -35.0446 -35.0446 -9.5193 -9.5193 -9.3860 -9.3860 3.4151 3.4151 3.7951 3.7951 4.3192 4.3192 4.5844 4.5844 4.7594 4.7594 5.0980 5.0980 5.6965 5.6965 5.8379 5.8379 6.8815 6.8815 7.4787 7.4787 7.6958 7.6958 11.2022 11.2022 16.2567 16.2567 16.5156 16.5156 k =-0.0074 0.0143 1.1218 ( 6205 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5195 -9.5195 -9.3862 -9.3862 3.4146 3.4146 3.7971 3.7971 4.3370 4.3370 4.5838 4.5838 4.7414 4.7414 5.0993 5.0993 5.6937 5.6937 5.8324 5.8324 6.8838 6.8838 7.4801 7.4801 7.7040 7.7040 11.1917 11.1917 16.2717 16.2717 16.5226 16.5226 k = 0.0000 0.0000 1.1218 ( 6206 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5196 -9.5196 -9.3863 -9.3863 3.4144 3.4144 3.7978 3.7978 4.3434 4.3434 4.5835 4.5835 4.7350 4.7350 5.0997 5.0997 5.6927 5.6927 5.8305 5.8305 6.8846 6.8846 7.4806 7.4806 7.7068 7.7068 11.1881 11.1881 16.2768 16.2768 16.5249 16.5249 k = 0.0000 0.0000 1.1218 ( 6206 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5196 -9.5196 -9.3863 -9.3863 3.4144 3.4144 3.7978 3.7978 4.3434 4.3434 4.5835 4.5835 4.7350 4.7350 5.0997 5.0997 5.6927 5.6927 5.8305 5.8305 6.8846 6.8846 7.4806 7.4806 7.7068 7.7068 11.1881 11.1881 16.2768 16.2768 16.5249 16.5249 k = 0.0147 0.0076 1.1218 ( 6204 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5196 -9.5196 -9.3863 -9.3863 3.4146 3.4146 3.7973 3.7973 4.3435 4.3435 4.5826 4.5826 4.7355 4.7355 5.1012 5.1012 5.6927 5.6927 5.8301 5.8301 6.8848 6.8848 7.4796 7.4796 7.7067 7.7067 11.1893 11.1893 16.2770 16.2770 16.5210 16.5210 k = 0.0294 0.0151 1.1218 ( 6200 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5196 -9.5196 -9.3863 -9.3863 3.4152 3.4152 3.7961 3.7961 4.3437 4.3437 4.5797 4.5797 4.7369 4.7369 5.1055 5.1055 5.6926 5.6926 5.8289 5.8289 6.8854 6.8854 7.4767 7.4767 7.7066 7.7066 11.1927 11.1927 16.2774 16.2774 16.5095 16.5095 k = 0.0441 0.0227 1.1218 ( 6202 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5196 -9.5196 -9.3863 -9.3863 3.4161 3.4161 3.7940 3.7940 4.3440 4.3440 4.5751 4.5751 4.7392 4.7392 5.1125 5.1125 5.6923 5.6923 5.8268 5.8268 6.8862 6.8862 7.4720 7.4720 7.7063 7.7063 11.1983 11.1983 16.2782 16.2782 16.4910 16.4910 k = 0.0588 0.0303 1.1218 ( 6204 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5196 -9.5196 -9.3863 -9.3863 3.4173 3.4173 3.7913 3.7913 4.3444 4.3444 4.5689 4.5689 4.7425 4.7425 5.1217 5.1217 5.6920 5.6920 5.8241 5.8241 6.8874 6.8874 7.4657 7.4657 7.7060 7.7060 11.2059 11.2059 16.2792 16.2792 16.4666 16.4666 k = 0.0735 0.0378 1.1218 ( 6206 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5196 -9.5196 -9.3863 -9.3863 3.4188 3.4188 3.7879 3.7879 4.3450 4.3450 4.5616 4.5616 4.7464 4.7464 5.1328 5.1328 5.6917 5.6917 5.8208 5.8208 6.8889 6.8889 7.4579 7.4579 7.7056 7.7056 11.2152 11.2152 16.2804 16.2804 16.4374 16.4374 k = 0.0882 0.0454 1.1218 ( 6206 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5196 -9.5196 -9.3863 -9.3863 3.4206 3.4206 3.7840 3.7840 4.3457 4.3457 4.5534 4.5534 4.7510 4.7510 5.1454 5.1454 5.6912 5.6912 5.8169 5.8169 6.8906 6.8906 7.4489 7.4489 7.7051 7.7051 11.2259 11.2259 16.2816 16.2816 16.4048 16.4048 k = 0.1029 0.0530 1.1218 ( 6208 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5196 -9.5196 -9.3863 -9.3863 3.4226 3.4226 3.7796 3.7796 4.3466 4.3466 4.5447 4.5447 4.7561 4.7561 5.1589 5.1589 5.6907 5.6907 5.8127 5.8127 6.8924 6.8924 7.4389 7.4389 7.7047 7.7047 11.2377 11.2377 16.2826 16.2826 16.3705 16.3705 k = 0.1176 0.0605 1.1218 ( 6210 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5196 -9.5196 -9.3863 -9.3863 3.4247 3.4247 3.7751 3.7751 4.3475 4.3475 4.5357 4.5357 4.7614 4.7614 5.1729 5.1729 5.6901 5.6901 5.8082 5.8082 6.8943 6.8943 7.4285 7.4285 7.7042 7.7042 11.2501 11.2501 16.2826 16.2826 16.3365 16.3365 k = 0.1324 0.0681 1.1218 ( 6208 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5197 -9.5197 -9.3863 -9.3863 3.4269 3.4269 3.7704 3.7704 4.3485 4.3485 4.5268 4.5268 4.7669 4.7669 5.1869 5.1869 5.6895 5.6895 5.8037 5.8037 6.8963 6.8963 7.4177 7.4177 7.7037 7.7037 11.2627 11.2627 16.2771 16.2771 16.3083 16.3083 k = 0.1471 0.0757 1.1218 ( 6210 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5197 -9.5197 -9.3862 -9.3862 3.4292 3.4292 3.7658 3.7658 4.3496 4.3496 4.5183 4.5183 4.7723 4.7723 5.2004 5.2004 5.6888 5.6888 5.7992 5.7992 6.8982 6.8982 7.4072 7.4072 7.7032 7.7032 11.2752 11.2752 16.2555 16.2555 16.2979 16.2979 k = 0.1618 0.0832 1.1218 ( 6214 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5197 -9.5197 -9.3862 -9.3862 3.4313 3.4313 3.7614 3.7614 4.3507 4.3507 4.5103 4.5103 4.7775 4.7775 5.2131 5.2131 5.6881 5.6881 5.7949 5.7949 6.9000 6.9000 7.3971 7.3971 7.7028 7.7028 11.2870 11.2870 16.2268 16.2268 16.2968 16.2968 k = 0.1765 0.0908 1.1218 ( 6216 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5197 -9.5197 -9.3862 -9.3862 3.4334 3.4334 3.7573 3.7573 4.3518 4.3518 4.5032 4.5032 4.7822 4.7822 5.2245 5.2245 5.6875 5.6875 5.7911 5.7911 6.9017 6.9017 7.3879 7.3879 7.7024 7.7024 11.2978 11.2978 16.1996 16.1996 16.2976 16.2976 k = 0.1912 0.0984 1.1218 ( 6216 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0445 -35.0445 -9.5197 -9.5197 -9.3862 -9.3862 3.4352 3.4352 3.7538 3.7538 4.3529 4.3529 4.4970 4.4970 4.7863 4.7863 5.2344 5.2344 5.6869 5.6869 5.7877 5.7877 6.9031 6.9031 7.3799 7.3799 7.7021 7.7021 11.3073 11.3073 16.1759 16.1759 16.2986 16.2986 k = 0.2059 0.1059 1.1218 ( 6218 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0449 -35.0449 -35.0446 -35.0446 -9.5197 -9.5197 -9.3862 -9.3862 3.4367 3.4367 3.7509 3.7509 4.3537 4.3537 4.4920 4.4920 4.7896 4.7896 5.2424 5.2424 5.6864 5.6864 5.7849 5.7849 6.9043 6.9043 7.3733 7.3733 7.7018 7.7018 11.3149 11.3149 16.1568 16.1568 16.2997 16.2997 k = 0.2206 0.1135 1.1218 ( 6212 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0448 -35.0448 -35.0446 -35.0446 -9.5197 -9.5197 -9.3862 -9.3862 3.4378 3.4378 3.7487 3.7487 4.3544 4.3544 4.4883 4.4883 4.7921 4.7921 5.2483 5.2483 5.6861 5.6861 5.7829 5.7829 6.9052 6.9052 7.3685 7.3685 7.7016 7.7016 11.3206 11.3206 16.1427 16.1427 16.3005 16.3005 k = 0.2353 0.1211 1.1218 ( 6216 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0448 -35.0448 -35.0446 -35.0446 -9.5197 -9.5197 -9.3862 -9.3862 3.4385 3.4385 3.7474 3.7474 4.3549 4.3549 4.4860 4.4860 4.7936 4.7936 5.2518 5.2518 5.6858 5.6858 5.7816 5.7816 6.9057 6.9057 7.3655 7.3655 7.7015 7.7015 11.3241 11.3241 16.1341 16.1341 16.3010 16.3010 k = 0.2500 0.1286 1.1218 ( 6216 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0448 -35.0448 -35.0446 -35.0446 -9.5197 -9.5197 -9.3862 -9.3862 3.4388 3.4388 3.7469 3.7469 4.3550 4.3550 4.4853 4.4853 4.7941 4.7941 5.2531 5.2531 5.6857 5.6857 5.7812 5.7812 6.9059 6.9059 7.3645 7.3645 7.7014 7.7014 11.3253 11.3253 16.1312 16.1312 16.3012 16.3012 k = 0.2500 0.1286 1.1218 ( 6216 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0448 -35.0448 -35.0446 -35.0446 -9.5197 -9.5197 -9.3862 -9.3862 3.4388 3.4388 3.7469 3.7469 4.3550 4.3550 4.4853 4.4853 4.7941 4.7941 5.2531 5.2531 5.6857 5.6857 5.7812 5.7812 6.9059 6.9059 7.3645 7.3645 7.7014 7.7014 11.3253 11.3253 16.1312 16.1312 16.3012 16.3012 k = 0.2440 0.1402 1.1115 ( 6214 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0448 -35.0448 -35.0446 -35.0446 -9.5199 -9.5199 -9.3861 -9.3861 3.4401 3.4401 3.7474 3.7474 4.3522 4.3522 4.4772 4.4772 4.8030 4.8030 5.2496 5.2496 5.6893 5.6893 5.7839 5.7839 6.9029 6.9029 7.3666 7.3666 7.7011 7.7011 11.3265 11.3265 16.1129 16.1129 16.3183 16.3183 k = 0.2381 0.1518 1.1012 ( 6220 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0448 -35.0448 -35.0446 -35.0446 -9.5205 -9.5205 -9.3859 -9.3859 3.4441 3.4441 3.7489 3.7489 4.3439 4.3439 4.4554 4.4554 4.8271 4.8271 5.2394 5.2394 5.6996 5.6996 5.7916 5.7916 6.8942 6.8942 7.3729 7.3729 7.7000 7.7000 11.3300 11.3300 16.0704 16.0704 16.3569 16.3569 k = 0.2321 0.1633 1.0908 ( 6220 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1137 -41.1137 -40.8615 -40.8615 -35.0449 -35.0449 -35.0446 -35.0446 -9.5215 -9.5215 -9.3855 -9.3855 3.4507 3.4507 3.7513 3.7513 4.3300 4.3300 4.4249 4.4249 4.8616 4.8616 5.2234 5.2234 5.7160 5.7160 5.8042 5.8042 6.8802 6.8802 7.3829 7.3829 7.6982 7.6982 11.3359 11.3359 16.0177 16.0177 16.4034 16.4034 k = 0.2262 0.1749 1.0805 ( 6224 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1137 -41.1137 -40.8615 -40.8615 -35.0449 -35.0449 -35.0446 -35.0446 -9.5228 -9.5228 -9.3850 -9.3850 3.4600 3.4600 3.7547 3.7547 4.3107 4.3107 4.3903 4.3903 4.9022 4.9022 5.2028 5.2028 5.7372 5.7372 5.8211 5.8211 6.8617 6.8617 7.3959 7.3959 7.6957 7.6957 11.3441 11.3441 15.9600 15.9600 16.4524 16.4524 k = 0.2202 0.1865 1.0702 ( 6226 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1137 -41.1137 -40.8615 -40.8615 -35.0449 -35.0449 -35.0446 -35.0446 -9.5245 -9.5245 -9.3843 -9.3843 3.4717 3.4717 3.7588 3.7588 4.2860 4.2860 4.3546 4.3546 4.9461 4.9461 5.1790 5.1790 5.7624 5.7624 5.8419 5.8419 6.8393 6.8393 7.4114 7.4114 7.6926 7.6926 11.3546 11.3546 15.8993 15.8993 16.5022 16.5022 k = 0.2143 0.1980 1.0598 ( 6226 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1136 -41.1136 -40.8615 -40.8615 -35.0449 -35.0449 -35.0446 -35.0446 -9.5266 -9.5266 -9.3834 -9.3834 3.4860 3.4860 3.7635 3.7635 4.2565 4.2565 4.3194 4.3194 4.9911 4.9911 5.1535 5.1535 5.7904 5.7904 5.8660 5.8660 6.8138 6.8138 7.4288 7.4288 7.6888 7.6888 11.3673 11.3673 15.8364 15.8364 16.5520 16.5520 k = 0.2083 0.2096 1.0495 ( 6230 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1136 -41.1136 -40.8615 -40.8615 -35.0449 -35.0449 -35.0446 -35.0446 -9.5290 -9.5290 -9.3825 -9.3825 3.5025 3.5025 3.7686 3.7686 4.2233 4.2233 4.2854 4.2854 5.0339 5.0339 5.1292 5.1292 5.8206 5.8206 5.8928 5.8928 6.7857 6.7857 7.4475 7.4475 7.6844 7.6844 11.3821 11.3821 15.7716 15.7716 16.6016 16.6016 k = 0.2024 0.2212 1.0392 ( 6228 PWs) bands (ev): -76.6575 -76.6575 -45.4731 -45.4731 -41.1135 -41.1135 -40.8615 -40.8615 -35.0449 -35.0449 -35.0446 -35.0446 -9.5318 -9.5318 -9.3814 -9.3814 3.5212 3.5212 3.7738 3.7738 4.1884 4.1884 4.2521 4.2521 5.0599 5.0599 5.1207 5.1207 5.8522 5.8522 5.9218 5.9218 6.7556 6.7556 7.4674 7.4674 7.6795 7.6795 11.3990 11.3990 15.7053 15.7053 16.6509 16.6509 k = 0.1964 0.2328 1.0288 ( 6226 PWs) bands (ev): -76.6575 -76.6575 -45.4731 -45.4731 -41.1135 -41.1135 -40.8615 -40.8615 -35.0449 -35.0449 -35.0447 -35.0447 -9.5348 -9.5348 -9.3801 -9.3801 3.5418 3.5418 3.7785 3.7785 4.1535 4.1535 4.2193 4.2193 5.0467 5.0467 5.1503 5.1503 5.8847 5.8847 5.9526 5.9526 6.7240 6.7240 7.4880 7.4880 7.6741 7.6741 11.4179 11.4179 15.6376 15.6376 16.6999 16.6999 k = 0.1905 0.2443 1.0185 ( 6218 PWs) bands (ev): -76.6575 -76.6575 -45.4731 -45.4731 -41.1134 -41.1134 -40.8615 -40.8615 -35.0449 -35.0449 -35.0447 -35.0447 -9.5382 -9.5382 -9.3788 -9.3788 3.5641 3.5641 3.7822 3.7822 4.1204 4.1204 4.1869 4.1869 5.0193 5.0193 5.1930 5.1930 5.9174 5.9174 5.9848 5.9848 6.6913 6.6913 7.5092 7.5092 7.6684 7.6684 11.4387 11.4387 15.5688 15.5688 16.7486 16.7486 k = 0.1845 0.2559 1.0082 ( 6214 PWs) bands (ev): -76.6575 -76.6575 -45.4731 -45.4731 -41.1133 -41.1133 -40.8615 -40.8615 -35.0450 -35.0450 -35.0447 -35.0447 -9.5418 -9.5418 -9.3773 -9.3773 3.5875 3.5875 3.7839 3.7839 4.0905 4.0905 4.1552 4.1552 4.9890 4.9890 5.2371 5.2371 5.9499 5.9499 6.0181 6.0181 6.6578 6.6578 7.5309 7.5309 7.6624 7.6624 11.4612 11.4612 15.4989 15.4989 16.7970 16.7970 k = 0.1786 0.2675 0.9978 ( 6212 PWs) bands (ev): -76.6575 -76.6575 -45.4730 -45.4730 -41.1132 -41.1132 -40.8614 -40.8614 -35.0450 -35.0450 -35.0447 -35.0447 -9.5457 -9.5457 -9.3758 -9.3758 3.6114 3.6114 3.7826 3.7826 4.0654 4.0654 4.1249 4.1249 4.9580 4.9580 5.2805 5.2805 5.9816 5.9816 6.0523 6.0523 6.6238 6.6238 7.5529 7.5529 7.6565 7.6565 11.4854 11.4854 15.4282 15.4282 16.8450 16.8450 k = 0.1726 0.2790 0.9875 ( 6214 PWs) bands (ev): -76.6575 -76.6575 -45.4730 -45.4730 -41.1131 -41.1131 -40.8614 -40.8614 -35.0450 -35.0450 -35.0447 -35.0447 -9.5499 -9.5499 -9.3741 -9.3741 3.6346 3.6346 3.7773 3.7773 4.0463 4.0463 4.0972 4.0972 4.9269 4.9269 5.3224 5.3224 6.0121 6.0121 6.0870 6.0870 6.5896 6.5896 7.5748 7.5748 7.6511 7.6511 11.5110 11.5110 15.3569 15.3569 16.8904 16.8904 k = 0.1667 0.2906 0.9772 ( 6220 PWs) bands (ev): -76.6575 -76.6575 -45.4729 -45.4729 -41.1130 -41.1130 -40.8614 -40.8614 -35.0450 -35.0450 -35.0448 -35.0448 -9.5542 -9.5542 -9.3723 -9.3723 3.6553 3.6553 3.7679 3.7679 4.0334 4.0334 4.0741 4.0741 4.8960 4.8960 5.3623 5.3623 6.0412 6.0412 6.1219 6.1219 6.5557 6.5557 7.5955 7.5955 7.6475 7.6475 11.5380 11.5380 15.2852 15.2852 16.8751 16.8751 k = 0.1607 0.3022 0.9668 ( 6218 PWs) bands (ev): -76.6576 -76.6576 -45.4729 -45.4729 -41.1129 -41.1129 -40.8614 -40.8614 -35.0450 -35.0450 -35.0448 -35.0448 -9.5588 -9.5588 -9.3705 -9.3705 3.6702 3.6702 3.7559 3.7559 4.0253 4.0253 4.0589 4.0589 4.8656 4.8656 5.3997 5.3997 6.0685 6.0685 6.1565 6.1565 6.5224 6.5224 7.6108 7.6108 7.6500 7.6500 11.5662 11.5662 15.2132 15.2132 16.8107 16.8107 k = 0.1548 0.3137 0.9565 ( 6222 PWs) bands (ev): -76.6576 -76.6576 -45.4729 -45.4729 -41.1128 -41.1128 -40.8614 -40.8614 -35.0451 -35.0451 -35.0448 -35.0448 -9.5635 -9.5635 -9.3686 -9.3686 3.6745 3.6745 3.7448 3.7448 4.0203 4.0203 4.0552 4.0552 4.8357 4.8357 5.4343 5.4343 6.0937 6.0937 6.1905 6.1905 6.4902 6.4902 7.6152 7.6152 7.6645 7.6645 11.5953 11.5953 15.1413 15.1413 16.7433 16.7433 k = 0.1488 0.3253 0.9461 ( 6224 PWs) bands (ev): -76.6576 -76.6576 -45.4728 -45.4728 -41.1127 -41.1127 -40.8614 -40.8614 -35.0451 -35.0451 -35.0449 -35.0449 -9.5683 -9.5683 -9.3666 -9.3666 3.6650 3.6650 3.7365 3.7365 4.0206 4.0206 4.0617 4.0617 4.8067 4.8067 5.4657 5.4657 6.1165 6.1165 6.2231 6.2231 6.4597 6.4597 7.6127 7.6127 7.6870 7.6870 11.6253 11.6253 15.0696 15.0696 16.6745 16.6745 k = 0.1429 0.3369 0.9358 ( 6218 PWs) bands (ev): -76.6576 -76.6576 -45.4728 -45.4728 -41.1126 -41.1126 -40.8614 -40.8614 -35.0451 -35.0451 -35.0449 -35.0449 -9.5732 -9.5732 -9.3646 -9.3646 3.6451 3.6451 3.7274 3.7274 4.0297 4.0297 4.0754 4.0754 4.7785 4.7785 5.4936 5.4936 6.1366 6.1366 6.2533 6.2533 6.4320 6.4320 7.6084 7.6084 7.7128 7.7128 11.6558 11.6558 14.9984 14.9984 16.6050 16.6050 k = 0.1369 0.3484 0.9255 ( 6218 PWs) bands (ev): -76.6576 -76.6576 -45.4727 -45.4727 -41.1125 -41.1125 -40.8614 -40.8614 -35.0451 -35.0451 -35.0449 -35.0449 -9.5782 -9.5782 -9.3626 -9.3626 3.6201 3.6201 3.7137 3.7137 4.0476 4.0476 4.0948 4.0948 4.7513 4.7513 5.5177 5.5177 6.1537 6.1537 6.2792 6.2792 6.4095 6.4095 7.6040 7.6040 7.7405 7.7405 11.6868 11.6868 14.9279 14.9279 16.5350 16.5350 k = 0.1310 0.3600 0.9151 ( 6222 PWs) bands (ev): -76.6576 -76.6576 -45.4727 -45.4727 -41.1124 -41.1124 -40.8614 -40.8614 -35.0452 -35.0452 -35.0449 -35.0449 -9.5833 -9.5833 -9.3605 -9.3605 3.5928 3.5928 3.6951 3.6951 4.0719 4.0719 4.1196 4.1196 4.7253 4.7253 5.5377 5.5377 6.1671 6.1671 6.2963 6.2963 6.3968 6.3968 7.5999 7.5999 7.7695 7.7695 11.7180 11.7180 14.8583 14.8583 16.4648 16.4648 k = 0.1250 0.3716 0.9048 ( 6226 PWs) bands (ev): -76.6576 -76.6576 -45.4727 -45.4727 -41.1123 -41.1123 -40.8614 -40.8614 -35.0452 -35.0452 -35.0450 -35.0450 -9.5884 -9.5884 -9.3584 -9.3584 3.5648 3.5648 3.6730 3.6730 4.0993 4.0993 4.1502 4.1502 4.7006 4.7006 5.5533 5.5533 6.1764 6.1764 6.2993 6.2993 6.3997 6.3997 7.5966 7.5966 7.7998 7.7998 11.7492 11.7492 14.7900 14.7900 16.3947 16.3947 k = 0.1190 0.3831 0.8945 ( 6232 PWs) bands (ev): -76.6576 -76.6576 -45.4726 -45.4726 -41.1122 -41.1122 -40.8614 -40.8614 -35.0452 -35.0452 -35.0450 -35.0450 -9.5935 -9.5935 -9.3564 -9.3564 3.5366 3.5366 3.6488 3.6488 4.1274 4.1274 4.1867 4.1867 4.6774 4.6774 5.5643 5.5643 6.1811 6.1811 6.2913 6.2913 6.4157 6.4157 7.5942 7.5942 7.8311 7.8311 11.7802 11.7802 14.7231 14.7231 16.3249 16.3249 k = 0.1131 0.3947 0.8841 ( 6228 PWs) bands (ev): -76.6576 -76.6576 -45.4726 -45.4726 -41.1121 -41.1121 -40.8613 -40.8613 -35.0453 -35.0453 -35.0450 -35.0450 -9.5985 -9.5985 -9.3543 -9.3543 3.5089 3.5089 3.6234 3.6234 4.1556 4.1556 4.2279 4.2279 4.6561 4.6561 5.5706 5.5706 6.1808 6.1808 6.2798 6.2798 6.4372 6.4372 7.5930 7.5930 7.8634 7.8634 11.8109 11.8109 14.6579 14.6579 16.2558 16.2558 k = 0.1071 0.4063 0.8738 ( 6228 PWs) bands (ev): -76.6576 -76.6576 -45.4725 -45.4725 -41.1120 -41.1120 -40.8613 -40.8613 -35.0453 -35.0453 -35.0451 -35.0451 -9.6035 -9.6035 -9.3522 -9.3522 3.4819 3.4819 3.5978 3.5978 4.1838 4.1838 4.2721 4.2721 4.6372 4.6372 5.5722 5.5722 6.1760 6.1760 6.2684 6.2684 6.4602 6.4602 7.5928 7.5928 7.8965 7.8965 11.8409 11.8409 14.5946 14.5946 16.1876 16.1876 k = 0.1012 0.4178 0.8635 ( 6220 PWs) bands (ev): -76.6576 -76.6576 -45.4725 -45.4725 -41.1119 -41.1119 -40.8613 -40.8613 -35.0453 -35.0453 -35.0451 -35.0451 -9.6084 -9.6084 -9.3502 -9.3502 3.4557 3.4557 3.5723 3.5723 4.2121 4.2121 4.3176 4.3176 4.6214 4.6214 5.5692 5.5692 6.1679 6.1679 6.2575 6.2575 6.4832 6.4832 7.5939 7.5939 7.9302 7.9302 11.8701 11.8701 14.5334 14.5334 16.1207 16.1207 k = 0.0952 0.4294 0.8531 ( 6220 PWs) bands (ev): -76.6576 -76.6576 -45.4724 -45.4724 -41.1118 -41.1118 -40.8613 -40.8613 -35.0453 -35.0453 -35.0451 -35.0451 -9.6131 -9.6131 -9.3483 -9.3483 3.4306 3.4306 3.5475 3.5475 4.2407 4.2407 4.3622 4.3622 4.6104 4.6104 5.5617 5.5617 6.1580 6.1580 6.2461 6.2461 6.5055 6.5055 7.5962 7.5962 7.9643 7.9643 11.8984 11.8984 14.4746 14.4746 16.0554 16.0554 k = 0.0893 0.4410 0.8428 ( 6210 PWs) bands (ev): -76.6576 -76.6576 -45.4724 -45.4724 -41.1117 -41.1117 -40.8613 -40.8613 -35.0453 -35.0453 -35.0451 -35.0451 -9.6177 -9.6177 -9.3463 -9.3463 3.4067 3.4067 3.5235 3.5235 4.2693 4.2693 4.4025 4.4025 4.6071 4.6071 5.5501 5.5501 6.1474 6.1474 6.2333 6.2333 6.5267 6.5267 7.5997 7.5997 7.9987 7.9987 11.9256 11.9256 14.4183 14.4183 15.9919 15.9919 k = 0.0833 0.4525 0.8325 ( 6210 PWs) bands (ev): -76.6576 -76.6576 -45.4724 -45.4724 -41.1116 -41.1116 -40.8613 -40.8613 -35.0454 -35.0454 -35.0452 -35.0452 -9.6222 -9.6222 -9.3445 -9.3445 3.3839 3.3839 3.5005 3.5005 4.2975 4.2975 4.4340 4.4340 4.6157 4.6157 5.5348 5.5348 6.1368 6.1368 6.2183 6.2183 6.5467 6.5467 7.6041 7.6041 8.0329 8.0329 11.9514 11.9514 14.3647 14.3647 15.9307 15.9307 k = 0.0774 0.4641 0.8221 ( 6208 PWs) bands (ev): -76.6576 -76.6576 -45.4723 -45.4723 -41.1115 -41.1115 -40.8613 -40.8613 -35.0454 -35.0454 -35.0452 -35.0452 -9.6265 -9.6265 -9.3427 -9.3427 3.3626 3.3626 3.4788 3.4788 4.3248 4.3248 4.4536 4.4536 4.6397 4.6397 5.5163 5.5163 6.1266 6.1266 6.2011 6.2011 6.5655 6.5655 7.6095 7.6095 8.0667 8.0667 11.9758 11.9758 14.3141 14.3141 15.8720 15.8720 k = 0.0714 0.4757 0.8118 ( 6206 PWs) bands (ev): -76.6576 -76.6576 -45.4723 -45.4723 -41.1114 -41.1114 -40.8613 -40.8613 -35.0454 -35.0454 -35.0452 -35.0452 -9.6305 -9.6305 -9.3410 -9.3410 3.3426 3.3426 3.4583 3.4583 4.3499 4.3499 4.4636 4.4636 4.6773 4.6773 5.4951 5.4951 6.1164 6.1164 6.1818 6.1818 6.5830 6.5830 7.6155 7.6155 8.0999 8.0999 11.9987 11.9987 14.2665 14.2665 15.8161 15.8161 k = 0.0655 0.4872 0.8015 ( 6204 PWs) bands (ev): -76.6576 -76.6576 -45.4723 -45.4723 -41.1113 -41.1113 -40.8613 -40.8613 -35.0454 -35.0454 -35.0452 -35.0452 -9.6343 -9.6343 -9.3395 -9.3395 3.3240 3.3240 3.4393 3.4393 4.3706 4.3706 4.4708 4.4708 4.7233 4.7233 5.4718 5.4718 6.1055 6.1055 6.1613 6.1613 6.5992 6.5992 7.6221 7.6221 8.1320 8.1320 12.0199 12.0199 14.2222 14.2222 15.7635 15.7635 k = 0.0595 0.4988 0.7911 ( 6210 PWs) bands (ev): -76.6576 -76.6576 -45.4722 -45.4722 -41.1112 -41.1112 -40.8613 -40.8613 -35.0455 -35.0455 -35.0453 -35.0453 -9.6378 -9.6378 -9.3380 -9.3380 3.3069 3.3069 3.4218 3.4218 4.3844 4.3844 4.4814 4.4814 4.7736 4.7736 5.4470 5.4470 6.0925 6.0925 6.1413 6.1413 6.6140 6.6140 7.6290 7.6290 8.1628 8.1628 12.0393 12.0393 14.1813 14.1813 15.7143 15.7143 k = 0.0536 0.5104 0.7808 ( 6208 PWs) bands (ev): -76.6576 -76.6576 -45.4722 -45.4722 -41.1111 -41.1111 -40.8613 -40.8613 -35.0455 -35.0455 -35.0453 -35.0453 -9.6411 -9.6411 -9.3366 -9.3366 3.2913 3.2913 3.4058 3.4058 4.3903 4.3903 4.4981 4.4981 4.8256 4.8256 5.4212 5.4212 6.0747 6.0747 6.1247 6.1247 6.6274 6.6274 7.6360 7.6360 8.1919 8.1919 12.0570 12.0570 14.1438 14.1438 15.6688 15.6688 k = 0.0476 0.5219 0.7705 ( 6208 PWs) bands (ev): -76.6576 -76.6576 -45.4722 -45.4722 -41.1111 -41.1111 -40.8613 -40.8613 -35.0455 -35.0455 -35.0453 -35.0453 -9.6441 -9.6441 -9.3354 -9.3354 3.2773 3.2773 3.3914 3.3914 4.3905 4.3905 4.5195 4.5195 4.8777 4.8777 5.3951 5.3951 6.0513 6.0513 6.1129 6.1129 6.6395 6.6395 7.6429 7.6429 8.2190 8.2190 12.0728 12.0728 14.1101 14.1101 15.6274 15.6274 k = 0.0417 0.5335 0.7601 ( 6206 PWs) bands (ev): -76.6576 -76.6576 -45.4722 -45.4722 -41.1110 -41.1110 -40.8612 -40.8612 -35.0455 -35.0455 -35.0453 -35.0453 -9.6467 -9.6467 -9.3342 -9.3342 3.2648 3.2648 3.3787 3.3787 4.3876 4.3876 4.5430 4.5430 4.9287 4.9287 5.3694 5.3694 6.0239 6.0239 6.1047 6.1047 6.6501 6.6501 7.6494 7.6494 8.2437 8.2437 12.0867 12.0867 14.0800 14.0800 15.5902 15.5902 k = 0.0357 0.5451 0.7498 ( 6210 PWs) bands (ev): -76.6576 -76.6576 -45.4721 -45.4721 -41.1110 -41.1110 -40.8612 -40.8612 -35.0455 -35.0455 -35.0453 -35.0453 -9.6491 -9.6491 -9.3333 -9.3333 3.2539 3.2539 3.3676 3.3676 4.3836 4.3836 4.5668 4.5668 4.9774 4.9774 5.3445 5.3445 5.9948 5.9948 6.0988 6.0988 6.6594 6.6594 7.6555 7.6555 8.2658 8.2658 12.0987 12.0987 14.0538 14.0538 15.5575 15.5575 k = 0.0298 0.5566 0.7395 ( 6216 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1109 -41.1109 -40.8612 -40.8612 -35.0455 -35.0455 -35.0453 -35.0453 -9.6511 -9.6511 -9.3324 -9.3324 3.2447 3.2447 3.3581 3.3581 4.3793 4.3793 4.5893 4.5893 5.0227 5.0227 5.3214 5.3214 5.9658 5.9658 6.0943 6.0943 6.6673 6.6673 7.6609 7.6609 8.2851 8.2851 12.1089 12.1089 14.0315 14.0315 15.5295 15.5295 k = 0.0238 0.5682 0.7291 ( 6216 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1109 -41.1109 -40.8612 -40.8612 -35.0455 -35.0455 -35.0454 -35.0454 -9.6527 -9.6527 -9.3317 -9.3317 3.2372 3.2372 3.3504 3.3504 4.3754 4.3754 4.6097 4.6097 5.0632 5.0632 5.3007 5.3007 5.9385 5.9385 6.0908 6.0908 6.6737 6.6737 7.6656 7.6656 8.3011 8.3011 12.1172 12.1172 14.0131 14.0131 15.5064 15.5064 k = 0.0179 0.5798 0.7188 ( 6212 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1109 -41.1109 -40.8612 -40.8612 -35.0455 -35.0455 -35.0454 -35.0454 -9.6540 -9.6540 -9.3312 -9.3312 3.2312 3.2312 3.3444 3.3444 4.3722 4.3722 4.6268 4.6268 5.0974 5.0974 5.2833 5.2833 5.9146 5.9146 6.0882 6.0882 6.6787 6.6787 7.6693 7.6693 8.3139 8.3139 12.1236 12.1236 13.9988 13.9988 15.4883 15.4883 k = 0.0119 0.5913 0.7084 ( 6214 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8612 -40.8612 -35.0456 -35.0456 -35.0454 -35.0454 -9.6549 -9.6549 -9.3308 -9.3308 3.2270 3.2270 3.3401 3.3401 4.3698 4.3698 4.6398 4.6398 5.1236 5.1236 5.2701 5.2701 5.8957 5.8957 6.0864 6.0864 6.6823 6.6823 7.6720 7.6720 8.3231 8.3231 12.1281 12.1281 13.9885 13.9885 15.4752 15.4752 k = 0.0060 0.6029 0.6981 ( 6222 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8612 -40.8612 -35.0456 -35.0456 -35.0454 -35.0454 -9.6555 -9.6555 -9.3306 -9.3306 3.2245 3.2245 3.3375 3.3375 4.3683 4.3683 4.6479 4.6479 5.1402 5.1402 5.2617 5.2617 5.8836 5.8836 6.0853 6.0853 6.6845 6.6845 7.6737 7.6737 8.3287 8.3287 12.1309 12.1309 13.9824 13.9824 15.4674 15.4674 k = 0.0000 0.6145 0.6878 ( 6218 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8612 -40.8612 -35.0456 -35.0456 -35.0454 -35.0454 -9.6557 -9.6557 -9.3305 -9.3305 3.2236 3.2236 3.3366 3.3366 4.3678 4.3678 4.6507 4.6507 5.1459 5.1459 5.2588 5.2588 5.8794 5.8794 6.0850 6.0850 6.6852 6.6852 7.6742 7.6742 8.3305 8.3305 12.1318 12.1318 13.9803 13.9803 15.4648 15.4648 k = 0.0000 0.6145 0.6878 ( 6218 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8612 -40.8612 -35.0456 -35.0456 -35.0454 -35.0454 -9.6557 -9.6557 -9.3305 -9.3305 3.2236 3.2236 3.3366 3.3366 4.3678 4.3678 4.6507 4.6507 5.1459 5.1459 5.2588 5.2588 5.8794 5.8794 6.0850 6.0850 6.6852 6.6852 7.6742 7.6742 8.3305 8.3305 12.1318 12.1318 13.9803 13.9803 15.4648 15.4648 k = 0.0153 0.6189 0.6839 ( 6220 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8612 -40.8612 -35.0459 -35.0459 -35.0450 -35.0450 -9.6555 -9.6555 -9.3306 -9.3306 3.2239 3.2239 3.3369 3.3369 4.3652 4.3652 4.6535 4.6535 5.1443 5.1443 5.2599 5.2599 5.8792 5.8792 6.0843 6.0843 6.6853 6.6853 7.6741 7.6741 8.3308 8.3308 12.1313 12.1313 13.9820 13.9820 15.4642 15.4642 k = 0.0306 0.6232 0.6799 ( 6222 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8612 -40.8612 -35.0464 -35.0464 -35.0446 -35.0446 -9.6552 -9.6552 -9.3308 -9.3308 3.2247 3.2247 3.3378 3.3378 4.3577 4.3577 4.6616 4.6616 5.1398 5.1398 5.2630 5.2630 5.8785 5.8785 6.0823 6.0823 6.6856 6.6856 7.6735 7.6735 8.3317 8.3317 12.1297 12.1297 13.9869 13.9869 15.4625 15.4625 k = 0.0459 0.6276 0.6760 ( 6218 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8612 -40.8612 -35.0468 -35.0468 -35.0442 -35.0442 -9.6545 -9.6545 -9.3312 -9.3312 3.2260 3.2260 3.3392 3.3392 4.3463 4.3463 4.6740 4.6740 5.1327 5.1327 5.2677 5.2677 5.8774 5.8774 6.0790 6.0790 6.6861 6.6861 7.6725 7.6725 8.3331 8.3331 12.1272 12.1272 13.9951 13.9951 15.4596 15.4596 k = 0.0612 0.6320 0.6721 ( 6215 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8611 -40.8611 -35.0472 -35.0472 -35.0438 -35.0438 -9.6537 -9.6537 -9.3318 -9.3318 3.2278 3.2278 3.3412 3.3412 4.3320 4.3320 4.6898 4.6898 5.1237 5.1237 5.2734 5.2734 5.8760 5.8760 6.0745 6.0745 6.6867 6.6867 7.6712 7.6712 8.3351 8.3351 12.1236 12.1236 14.0065 14.0065 15.4554 15.4554 k = 0.0766 0.6364 0.6682 ( 6208 PWs) bands (ev): -76.6577 -76.6577 -45.4721 -45.4721 -41.1108 -41.1108 -40.8611 -40.8611 -35.0477 -35.0477 -35.0433 -35.0433 -9.6526 -9.6526 -9.3325 -9.3325 3.2301 3.2301 3.3436 3.3436 4.3159 4.3159 4.7078 4.7078 5.1133 5.1133 5.2798 5.2798 5.8741 5.8741 6.0688 6.0688 6.6874 6.6874 7.6695 7.6695 8.3376 8.3376 12.1190 12.1190 14.0212 14.0212 15.4500 15.4500 k = 0.0919 0.6408 0.6643 ( 6211 PWs) bands (ev): -76.6577 -76.6577 -45.4720 -45.4720 -41.1108 -41.1108 -40.8610 -40.8610 -35.0482 -35.0482 -35.0429 -35.0429 -9.6512 -9.6512 -9.3333 -9.3333 3.2327 3.2327 3.3465 3.3465 4.2989 4.2989 4.7271 4.7271 5.1017 5.1017 5.2864 5.2864 5.8718 5.8718 6.0621 6.0621 6.6883 6.6883 7.6674 7.6674 8.3406 8.3406 12.1134 12.1134 14.0390 14.0390 15.4433 15.4433 k = 0.1072 0.6452 0.6604 ( 6213 PWs) bands (ev): -76.6577 -76.6577 -45.4720 -45.4720 -41.1108 -41.1108 -40.8610 -40.8610 -35.0486 -35.0486 -35.0425 -35.0425 -9.6497 -9.6497 -9.3343 -9.3343 3.2356 3.2356 3.3497 3.3497 4.2817 4.2817 4.7472 4.7472 5.0895 5.0895 5.2932 5.2932 5.8692 5.8692 6.0544 6.0544 6.6892 6.6892 7.6650 7.6650 8.3440 8.3440 12.1068 12.1068 14.0599 14.0599 15.4352 15.4352 k = 0.1225 0.6495 0.6565 ( 6220 PWs) bands (ev): -76.6577 -76.6577 -45.4720 -45.4720 -41.1109 -41.1109 -40.8609 -40.8609 -35.0491 -35.0491 -35.0421 -35.0421 -9.6480 -9.6480 -9.3354 -9.3354 3.2389 3.2389 3.3530 3.3530 4.2649 4.2649 4.7673 4.7673 5.0767 5.0767 5.2998 5.2998 5.8663 5.8663 6.0459 6.0459 6.6901 6.6901 7.6622 7.6622 8.3478 8.3478 12.0993 12.0993 14.0837 14.0837 15.4257 15.4257 k = 0.1378 0.6539 0.6525 ( 6218 PWs) bands (ev): -76.6577 -76.6577 -45.4720 -45.4720 -41.1109 -41.1109 -40.8608 -40.8608 -35.0496 -35.0496 -35.0417 -35.0417 -9.6461 -9.6461 -9.3365 -9.3365 3.2422 3.2422 3.3566 3.3566 4.2490 4.2490 4.7871 4.7871 5.0636 5.0636 5.3062 5.3062 5.8630 5.8630 6.0368 6.0368 6.6909 6.6909 7.6591 7.6591 8.3518 8.3518 12.0908 12.0908 14.1105 14.1105 15.4147 15.4147 k = 0.1531 0.6583 0.6486 ( 6216 PWs) bands (ev): -76.6577 -76.6577 -45.4720 -45.4720 -41.1109 -41.1109 -40.8607 -40.8607 -35.0501 -35.0501 -35.0413 -35.0413 -9.6440 -9.6440 -9.3377 -9.3377 3.2457 3.2457 3.3601 3.3601 4.2343 4.2343 4.8061 4.8061 5.0504 5.0504 5.3124 5.3124 5.8595 5.8595 6.0272 6.0272 6.6917 6.6917 7.6556 7.6556 8.3562 8.3562 12.0813 12.0813 14.1401 14.1401 15.4021 15.4021 k = 0.1684 0.6627 0.6447 ( 6211 PWs) bands (ev): -76.6577 -76.6577 -45.4719 -45.4719 -41.1109 -41.1109 -40.8606 -40.8606 -35.0506 -35.0506 -35.0409 -35.0409 -9.6419 -9.6419 -9.3389 -9.3389 3.2492 3.2492 3.3634 3.3634 4.2213 4.2213 4.8241 4.8241 5.0372 5.0372 5.3183 5.3183 5.8559 5.8559 6.0173 6.0173 6.6924 6.6924 7.6518 7.6518 8.3607 8.3607 12.0710 12.0710 14.1723 14.1723 15.3880 15.3880 k = 0.1837 0.6671 0.6408 ( 6211 PWs) bands (ev): -76.6577 -76.6577 -45.4719 -45.4719 -41.1109 -41.1109 -40.8605 -40.8605 -35.0511 -35.0511 -35.0406 -35.0406 -9.6396 -9.6396 -9.3401 -9.3401 3.2526 3.2526 3.3666 3.3666 4.2102 4.2102 4.8405 4.8405 5.0242 5.0242 5.3239 5.3239 5.8521 5.8521 6.0072 6.0072 6.6930 6.6930 7.6477 7.6477 8.3653 8.3653 12.0598 12.0598 14.2070 14.2070 15.3724 15.3724 k = 0.1991 0.6714 0.6369 ( 6216 PWs) bands (ev): -76.6577 -76.6577 -45.4719 -45.4719 -41.1109 -41.1109 -40.8604 -40.8604 -35.0516 -35.0516 -35.0402 -35.0402 -9.6373 -9.6373 -9.3413 -9.3413 3.2559 3.2559 3.3693 3.3693 4.2012 4.2012 4.8552 4.8552 5.0116 5.0116 5.3292 5.3292 5.8482 5.8482 5.9973 5.9973 6.6934 6.6934 7.6432 7.6432 8.3699 8.3699 12.0477 12.0477 14.2439 14.2439 15.3554 15.3554 k = 0.2144 0.6758 0.6330 ( 6214 PWs) bands (ev): -76.6577 -76.6577 -45.4718 -45.4718 -41.1109 -41.1109 -40.8603 -40.8603 -35.0521 -35.0521 -35.0398 -35.0398 -9.6349 -9.6349 -9.3424 -9.3424 3.2588 3.2588 3.3715 3.3715 4.1947 4.1947 4.8679 4.8679 4.9995 4.9995 5.3341 5.3341 5.8444 5.8444 5.9876 5.9876 6.6937 6.6937 7.6384 7.6384 8.3745 8.3745 12.0347 12.0347 14.2829 14.2829 15.3370 15.3370 k = 0.2297 0.6802 0.6291 ( 6212 PWs) bands (ev): -76.6578 -76.6578 -45.4718 -45.4718 -41.1110 -41.1110 -40.8601 -40.8601 -35.0526 -35.0526 -35.0394 -35.0394 -9.6325 -9.6325 -9.3433 -9.3433 3.2613 3.2613 3.3732 3.3732 4.1907 4.1907 4.8781 4.8781 4.9881 4.9881 5.3388 5.3388 5.8408 5.8408 5.9784 5.9784 6.6938 6.6938 7.6332 7.6332 8.3789 8.3789 12.0208 12.0208 14.3235 14.3235 15.3176 15.3176 k = 0.2450 0.6846 0.6251 ( 6219 PWs) bands (ev): -76.6578 -76.6578 -45.4718 -45.4718 -41.1110 -41.1110 -40.8600 -40.8600 -35.0531 -35.0531 -35.0390 -35.0390 -9.6302 -9.6302 -9.3442 -9.3442 3.2633 3.2633 3.3742 3.3742 4.1893 4.1893 4.8858 4.8858 4.9775 4.9775 5.3432 5.3432 5.8375 5.8375 5.9698 5.9698 6.6937 6.6937 7.6277 7.6277 8.3831 8.3831 12.0061 12.0061 14.3655 14.3655 15.2973 15.2973 k = 0.2603 0.6890 0.6212 ( 6219 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1110 -41.1110 -40.8598 -40.8598 -35.0536 -35.0536 -35.0387 -35.0387 -9.6280 -9.6280 -9.3448 -9.3448 3.2647 3.2647 3.3745 3.3745 4.1907 4.1907 4.8905 4.8905 4.9679 4.9679 5.3473 5.3473 5.8345 5.8345 5.9620 5.9620 6.6934 6.6934 7.6218 7.6218 8.3870 8.3870 11.9905 11.9905 14.4084 14.4084 15.2767 15.2767 k = 0.2756 0.6934 0.6173 ( 6221 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1110 -41.1110 -40.8596 -40.8596 -35.0542 -35.0542 -35.0383 -35.0383 -9.6259 -9.6259 -9.3453 -9.3453 3.2655 3.2655 3.3741 3.3741 4.1949 4.1949 4.8923 4.8923 4.9594 4.9594 5.3512 5.3512 5.8321 5.8321 5.9551 5.9551 6.6930 6.6930 7.6155 7.6155 8.3905 8.3905 11.9741 11.9741 14.4516 14.4516 15.2561 15.2561 k = 0.2756 0.6934 0.6173 ( 6221 PWs) bands (ev): -76.6578 -76.6578 -45.4717 -45.4717 -41.1110 -41.1110 -40.8596 -40.8596 -35.0542 -35.0542 -35.0383 -35.0383 -9.6259 -9.6259 -9.3453 -9.3453 3.2655 3.2655 3.3741 3.3741 4.1949 4.1949 4.8923 4.8923 4.9594 4.9594 5.3512 5.3512 5.8321 5.8321 5.9551 5.9551 6.6930 6.6930 7.6155 7.6155 8.3905 8.3905 11.9741 11.9741 14.4516 14.4516 15.2561 15.2561 k = 0.2803 0.6843 0.6045 ( 6217 PWs) bands (ev): -76.6579 -76.6579 -45.4715 -45.4715 -41.1111 -41.1111 -40.8590 -40.8590 -35.0559 -35.0559 -35.0372 -35.0372 -9.6189 -9.6189 -9.3459 -9.3459 3.2660 3.2660 3.3716 3.3716 4.2134 4.2134 4.8917 4.8917 4.9342 4.9342 5.3639 5.3639 5.8246 5.8246 5.9341 5.9341 6.6916 6.6916 7.5920 7.5920 8.4010 8.4010 11.9169 11.9169 14.5986 14.5986 15.1881 15.1881 k = 0.2850 0.6752 0.5916 ( 6217 PWs) bands (ev): -76.6579 -76.6579 -45.4713 -45.4713 -41.1112 -41.1112 -40.8582 -40.8582 -35.0577 -35.0577 -35.0361 -35.0361 -9.6115 -9.6115 -9.3460 -9.3460 3.2652 3.2652 3.3692 3.3692 4.2329 4.2329 4.8843 4.8843 4.9156 4.9156 5.3774 5.3774 5.8164 5.8164 5.9126 5.9126 6.6906 6.6906 7.5641 7.5641 8.4113 8.4113 11.8579 11.8579 14.7539 14.7539 15.1181 15.1181 k = 0.2896 0.6661 0.5787 ( 6225 PWs) bands (ev): -76.6580 -76.6580 -45.4711 -45.4711 -41.1113 -41.1113 -40.8574 -40.8574 -35.0596 -35.0596 -35.0350 -35.0350 -9.6036 -9.6036 -9.3455 -9.3455 3.2629 3.2629 3.3670 3.3670 4.2534 4.2534 4.8643 4.8643 4.9092 4.9092 5.3918 5.3918 5.8073 5.8073 5.8908 5.8908 6.6898 6.6898 7.5317 7.5317 8.4211 8.4211 11.7986 11.7986 14.9083 14.9083 15.0544 15.0544 k = 0.2943 0.6570 0.5659 ( 6213 PWs) bands (ev): -76.6581 -76.6581 -45.4709 -45.4709 -41.1114 -41.1114 -40.8565 -40.8565 -35.0615 -35.0615 -35.0340 -35.0340 -9.5954 -9.5954 -9.3444 -9.3444 3.2594 3.2594 3.3651 3.3651 4.2748 4.2748 4.8384 4.8384 4.9083 4.9083 5.4070 5.4070 5.7974 5.7974 5.8688 5.8688 6.6893 6.6893 7.4951 7.4951 8.4306 8.4306 11.7404 11.7404 14.9436 14.9436 15.1141 15.1141 k = 0.2990 0.6479 0.5530 ( 6209 PWs) bands (ev): -76.6582 -76.6582 -45.4706 -45.4706 -41.1116 -41.1116 -40.8555 -40.8555 -35.0634 -35.0634 -35.0331 -35.0331 -9.5867 -9.5867 -9.3427 -9.3427 3.2548 3.2548 3.3634 3.3634 4.2971 4.2971 4.8109 4.8109 4.9085 4.9085 5.4231 5.4231 5.7865 5.7865 5.8467 5.8467 6.6889 6.6889 7.4544 7.4544 8.4398 8.4398 11.6841 11.6841 14.8730 14.8730 15.2835 15.2835 k = 0.3037 0.6388 0.5401 ( 6211 PWs) bands (ev): -76.6583 -76.6583 -45.4704 -45.4704 -41.1117 -41.1117 -40.8543 -40.8543 -35.0653 -35.0653 -35.0323 -35.0323 -9.5777 -9.5777 -9.3405 -9.3405 3.2493 3.2493 3.3619 3.3619 4.3202 4.3202 4.7828 4.7828 4.9087 4.9087 5.4398 5.4398 5.7745 5.7745 5.8248 5.8248 6.6886 6.6886 7.4097 7.4097 8.4485 8.4485 11.6303 11.6303 14.7939 14.7939 15.4646 15.4646 k = 0.3083 0.6298 0.5273 ( 6211 PWs) bands (ev): -76.6584 -76.6584 -45.4701 -45.4701 -41.1118 -41.1118 -40.8532 -40.8532 -35.0673 -35.0673 -35.0315 -35.0315 -9.5683 -9.5683 -9.3378 -9.3378 3.2432 3.2432 3.3604 3.3604 4.3440 4.3440 4.7544 4.7544 4.9086 4.9086 5.4572 5.4572 5.7614 5.7614 5.8033 5.8033 6.6884 6.6884 7.3613 7.3613 8.4570 8.4570 11.5797 11.5797 14.7123 14.7123 15.6512 15.6512 k = 0.3130 0.6207 0.5144 ( 6215 PWs) bands (ev): -76.6585 -76.6585 -45.4697 -45.4697 -41.1120 -41.1120 -40.8519 -40.8519 -35.0693 -35.0693 -35.0307 -35.0307 -9.5586 -9.5586 -9.3345 -9.3345 3.2366 3.2366 3.3590 3.3590 4.3686 4.3686 4.7259 4.7259 4.9079 4.9079 5.4753 5.4753 5.7468 5.7468 5.7824 5.7824 6.6880 6.6880 7.3095 7.3095 8.4650 8.4650 11.5323 11.5323 14.6291 14.6291 15.8418 15.8418 k = 0.3177 0.6116 0.5016 ( 6217 PWs) bands (ev): -76.6586 -76.6586 -45.4694 -45.4694 -41.1122 -41.1122 -40.8505 -40.8505 -35.0713 -35.0713 -35.0300 -35.0300 -9.5486 -9.5486 -9.3308 -9.3308 3.2298 3.2298 3.3575 3.3575 4.3939 4.3939 4.6975 4.6975 4.9065 4.9065 5.4938 5.4938 5.7308 5.7308 5.7626 5.7626 6.6876 6.6876 7.2545 7.2545 8.4727 8.4727 11.4885 11.4885 14.5451 14.5451 16.0358 16.0358 k = 0.3224 0.6025 0.4887 ( 6213 PWs) bands (ev): -76.6587 -76.6587 -45.4690 -45.4690 -41.1123 -41.1123 -40.8491 -40.8491 -35.0733 -35.0733 -35.0294 -35.0294 -9.5383 -9.5383 -9.3266 -9.3266 3.2229 3.2229 3.3559 3.3559 4.4197 4.4197 4.6691 4.6691 4.9043 4.9043 5.5126 5.5126 5.7131 5.7131 5.7440 5.7440 6.6870 6.6870 7.1967 7.1967 8.4800 8.4800 11.4484 11.4484 14.4603 14.4603 16.2324 16.2324 k = 0.3270 0.5934 0.4758 ( 6217 PWs) bands (ev): -76.6589 -76.6589 -45.4687 -45.4687 -41.1125 -41.1125 -40.8476 -40.8476 -35.0753 -35.0753 -35.0288 -35.0288 -9.5277 -9.5277 -9.3219 -9.3219 3.2163 3.2163 3.3541 3.3541 4.4460 4.4460 4.6410 4.6410 4.9013 4.9013 5.5315 5.5315 5.6942 5.6942 5.7267 5.7267 6.6862 6.6862 7.1363 7.1363 8.4869 8.4869 11.4118 11.4118 14.3752 14.3752 16.4314 16.4314 k = 0.3317 0.5843 0.4630 ( 6227 PWs) bands (ev): -76.6590 -76.6590 -45.4683 -45.4683 -41.1127 -41.1127 -40.8460 -40.8460 -35.0774 -35.0774 -35.0282 -35.0282 -9.5170 -9.5170 -9.3169 -9.3169 3.2100 3.2100 3.3521 3.3521 4.4724 4.4724 4.6133 4.6133 4.8974 4.8974 5.5500 5.5500 5.6744 5.6744 5.7108 5.7108 6.6852 6.6852 7.0738 7.0738 8.4935 8.4935 11.3788 11.3788 14.2899 14.2899 16.6322 16.6322 k = 0.3364 0.5753 0.4501 ( 6227 PWs) bands (ev): -76.6591 -76.6591 -45.4679 -45.4679 -41.1129 -41.1129 -40.8444 -40.8444 -35.0795 -35.0795 -35.0277 -35.0277 -9.5060 -9.5060 -9.3114 -9.3114 3.2041 3.2041 3.3498 3.3498 4.4984 4.4984 4.5868 4.5868 4.8925 4.8925 5.5670 5.5670 5.6543 5.6543 5.6966 5.6966 6.6839 6.6839 7.0095 7.0095 8.4996 8.4996 11.3492 11.3492 14.2045 14.2045 16.8345 16.8345 k = 0.3411 0.5662 0.4373 ( 6235 PWs) bands (ev): -76.6593 -76.6593 -45.4675 -45.4675 -41.1131 -41.1131 -40.8427 -40.8427 -35.0815 -35.0815 -35.0273 -35.0273 -9.4948 -9.4948 -9.3056 -9.3056 3.1988 3.1988 3.3474 3.3474 4.5201 4.5201 4.5651 4.5651 4.8866 4.8866 5.5808 5.5808 5.6343 5.6343 5.6860 5.6860 6.6822 6.6822 6.9438 6.9438 8.5055 8.5055 11.3230 11.3230 14.1192 14.1192 17.0378 17.0378 k = 0.3457 0.5571 0.4244 ( 6239 PWs) bands (ev): -76.6594 -76.6594 -45.4670 -45.4670 -41.1133 -41.1133 -40.8410 -40.8410 -35.0836 -35.0836 -35.0269 -35.0269 -9.4835 -9.4835 -9.2995 -9.2995 3.1943 3.1943 3.3448 3.3448 4.5178 4.5178 4.5679 4.5679 4.8796 4.8796 5.5877 5.5877 5.6143 5.6143 5.6822 5.6822 6.6800 6.6800 6.8771 6.8771 8.5110 8.5110 11.2999 11.2999 14.0342 14.0342 17.2418 17.2418 k = 0.3504 0.5480 0.4115 ( 6239 PWs) bands (ev): -76.6596 -76.6596 -45.4666 -45.4666 -41.1136 -41.1136 -40.8393 -40.8393 -35.0856 -35.0856 -35.0265 -35.0265 -9.4721 -9.4721 -9.2930 -9.2930 3.1905 3.1905 3.3419 3.3419 4.4953 4.4953 4.5914 4.5914 4.8716 4.8716 5.5852 5.5852 5.5947 5.5947 5.6878 5.6878 6.6771 6.6771 6.8101 6.8101 8.5161 8.5161 11.2798 11.2798 13.9497 13.9497 17.4459 17.4459 k = 0.3551 0.5389 0.3987 ( 6243 PWs) bands (ev): -76.6598 -76.6598 -45.4662 -45.4662 -41.1138 -41.1138 -40.8375 -40.8375 -35.0877 -35.0877 -35.0262 -35.0262 -9.4606 -9.4606 -9.2863 -9.2863 3.1876 3.1876 3.3389 3.3389 4.4696 4.4696 4.6183 4.6183 4.8626 4.8626 5.5740 5.5740 5.5760 5.5760 5.7014 5.7014 6.6718 6.6718 6.7447 6.7447 8.5209 8.5209 11.2625 11.2625 13.8656 13.8656 17.6495 17.6495 k = 0.3598 0.5298 0.3858 ( 6239 PWs) bands (ev): -76.6599 -76.6599 -45.4657 -45.4657 -41.1140 -41.1140 -40.8357 -40.8357 -35.0897 -35.0897 -35.0260 -35.0260 -9.4490 -9.4490 -9.2793 -9.2793 3.1856 3.1856 3.3357 3.3357 4.4436 4.4436 4.6458 4.6458 4.8526 4.8526 5.5556 5.5556 5.5601 5.5601 5.7197 5.7197 6.6518 6.6518 6.6937 6.6937 8.5254 8.5254 11.2477 11.2477 13.7823 13.7823 17.8520 17.8520 k = 0.3644 0.5207 0.3730 ( 6231 PWs) bands (ev): -76.6601 -76.6601 -45.4653 -45.4653 -41.1142 -41.1142 -40.8338 -40.8338 -35.0917 -35.0917 -35.0257 -35.0257 -9.4375 -9.4375 -9.2721 -9.2721 3.1846 3.1846 3.3325 3.3325 4.4177 4.4177 4.6731 4.6731 4.8420 4.8420 5.5358 5.5358 5.5436 5.5436 5.7404 5.7404 6.5955 6.5955 6.6788 6.6788 8.5295 8.5295 11.2353 11.2353 13.6997 13.6997 18.0521 18.0521 k = 0.3691 0.5117 0.3601 ( 6219 PWs) bands (ev): -76.6602 -76.6602 -45.4648 -45.4648 -41.1145 -41.1145 -40.8320 -40.8320 -35.0937 -35.0937 -35.0255 -35.0255 -9.4259 -9.4259 -9.2648 -9.2648 3.1847 3.1847 3.3291 3.3291 4.3922 4.3922 4.6994 4.6994 4.8310 4.8310 5.5151 5.5151 5.5270 5.5270 5.7624 5.7624 6.5299 6.5299 6.6737 6.6737 8.5334 8.5334 11.2250 11.2250 13.6180 13.6180 18.2486 18.2486 k = 0.3738 0.5026 0.3472 ( 6223 PWs) bands (ev): -76.6604 -76.6604 -45.4644 -45.4644 -41.1147 -41.1147 -40.8301 -40.8301 -35.0956 -35.0956 -35.0253 -35.0253 -9.4144 -9.4144 -9.2573 -9.2573 3.1857 3.1857 3.3257 3.3257 4.3671 4.3671 4.7235 4.7235 4.8209 4.8209 5.4936 5.4936 5.5110 5.5110 5.7849 5.7849 6.4635 6.4635 6.6698 6.6698 8.5370 8.5370 11.2167 11.2167 13.5373 13.5373 18.4393 18.4393 k = 0.3785 0.4935 0.3344 ( 6223 PWs) bands (ev): -76.6606 -76.6606 -45.4639 -45.4639 -41.1149 -41.1149 -40.8282 -40.8282 -35.0975 -35.0975 -35.0252 -35.0252 -9.4030 -9.4030 -9.2497 -9.2497 3.1878 3.1878 3.3224 3.3224 4.3425 4.3425 4.7418 4.7418 4.8151 4.8151 5.4714 5.4714 5.4959 5.4959 5.8075 5.8075 6.3979 6.3979 6.6664 6.6664 8.5403 8.5403 11.2101 11.2101 13.4577 13.4577 18.6208 18.6208 k = 0.3831 0.4844 0.3215 ( 6227 PWs) bands (ev): -76.6607 -76.6607 -45.4634 -45.4634 -41.1152 -41.1152 -40.8264 -40.8264 -35.0994 -35.0994 -35.0251 -35.0251 -9.3917 -9.3917 -9.2420 -9.2420 3.1909 3.1909 3.3192 3.3192 4.3184 4.3184 4.7480 4.7480 4.8198 4.8198 5.4487 5.4487 5.4816 5.4816 5.8299 5.8299 6.3336 6.3336 6.6630 6.6630 8.5433 8.5433 11.2051 11.2051 13.3795 13.3795 18.7879 18.7879 k = 0.3878 0.4753 0.3087 ( 6227 PWs) bands (ev): -76.6609 -76.6609 -45.4630 -45.4630 -41.1154 -41.1154 -40.8245 -40.8245 -35.1013 -35.1013 -35.0250 -35.0250 -9.3805 -9.3805 -9.2343 -9.2343 3.1949 3.1949 3.3163 3.3163 4.2950 4.2950 4.7411 4.7411 4.8360 4.8360 5.4255 5.4255 5.4682 5.4682 5.8516 5.8516 6.2713 6.2713 6.6598 6.6598 8.5461 8.5461 11.2016 11.2016 13.3026 13.3026 18.9330 18.9330 k = 0.3925 0.4662 0.2958 ( 6219 PWs) bands (ev): -76.6611 -76.6611 -45.4625 -45.4625 -41.1156 -41.1156 -40.8227 -40.8227 -35.1031 -35.1031 -35.0250 -35.0250 -9.3695 -9.3695 -9.2266 -9.2266 3.1997 3.1997 3.3137 3.3137 4.2722 4.2722 4.7271 4.7271 4.8576 4.8576 5.4022 5.4022 5.4557 5.4557 5.8719 5.8719 6.2118 6.2118 6.6566 6.6566 8.5486 8.5486 11.1992 11.1992 13.2272 13.2272 19.0382 19.0382 k = 0.3972 0.4571 0.2829 ( 6219 PWs) bands (ev): -76.6612 -76.6612 -45.4621 -45.4621 -41.1158 -41.1158 -40.8209 -40.8209 -35.1049 -35.1049 -35.0249 -35.0249 -9.3587 -9.3587 -9.2189 -9.2189 3.2051 3.2051 3.3117 3.3117 4.2502 4.2502 4.7097 4.7097 4.8808 4.8808 5.3786 5.3786 5.4441 5.4441 5.8896 5.8896 6.1564 6.1564 6.6536 6.6536 8.5509 8.5509 11.1979 11.1979 13.1535 13.1535 19.0568 19.0568 k = 0.4018 0.4481 0.2701 ( 6231 PWs) bands (ev): -76.6614 -76.6614 -45.4617 -45.4617 -41.1161 -41.1161 -40.8191 -40.8191 -35.1066 -35.1066 -35.0249 -35.0249 -9.3482 -9.3482 -9.2112 -9.2112 3.2110 3.2110 3.3105 3.3105 4.2288 4.2288 4.6906 4.6906 4.9039 4.9039 5.3550 5.3550 5.4334 5.4334 5.9023 5.9023 6.1078 6.1078 6.6507 6.6507 8.5530 8.5530 11.1975 11.1975 13.0815 13.0815 19.0667 19.0667 k = 0.4065 0.4390 0.2572 ( 6233 PWs) bands (ev): -76.6615 -76.6615 -45.4612 -45.4612 -41.1163 -41.1163 -40.8173 -40.8173 -35.1083 -35.1083 -35.0249 -35.0249 -9.3379 -9.3379 -9.2037 -9.2037 3.2168 3.2168 3.3104 3.3104 4.2082 4.2082 4.6702 4.6702 4.9265 4.9265 5.3313 5.3313 5.4236 5.4236 5.9050 5.9050 6.0710 6.0710 6.6481 6.6481 8.5549 8.5549 11.1979 11.1979 13.0115 13.0115 19.0740 19.0740 k = 0.4112 0.4299 0.2444 ( 6233 PWs) bands (ev): -76.6617 -76.6617 -45.4608 -45.4608 -41.1165 -41.1165 -40.8156 -40.8156 -35.1099 -35.1099 -35.0250 -35.0250 -9.3279 -9.3279 -9.1963 -9.1963 3.2223 3.2223 3.3119 3.3119 4.1884 4.1884 4.6491 4.6491 4.9480 4.9480 5.3077 5.3077 5.4145 5.4145 5.8914 5.8914 6.0523 6.0523 6.6457 6.6457 8.5566 8.5566 11.1990 11.1990 12.9436 12.9436 19.0787 19.0787 k = 0.4159 0.4208 0.2315 ( 6233 PWs) bands (ev): -76.6618 -76.6618 -45.4604 -45.4604 -41.1167 -41.1167 -40.8140 -40.8140 -35.1114 -35.1114 -35.0250 -35.0250 -9.3182 -9.3182 -9.1890 -9.1890 3.2270 3.2270 3.3153 3.3153 4.1695 4.1695 4.6276 4.6276 4.9680 4.9680 5.2842 5.2842 5.4063 5.4063 5.8622 5.8622 6.0514 6.0514 6.6437 6.6437 8.5582 8.5582 11.2005 11.2005 12.8779 12.8779 19.0803 19.0803 k = 0.4205 0.4117 0.2186 ( 6233 PWs) bands (ev): -76.6620 -76.6620 -45.4600 -45.4600 -41.1169 -41.1169 -40.8123 -40.8123 -35.1129 -35.1129 -35.0251 -35.0251 -9.3089 -9.3089 -9.1820 -9.1820 3.2305 3.2305 3.3210 3.3210 4.1514 4.1514 4.6058 4.6058 4.9862 4.9862 5.2611 5.2611 5.3988 5.3988 5.8248 5.8248 6.0608 6.0608 6.6420 6.6420 8.5596 8.5596 11.2026 11.2026 12.8145 12.8145 19.0784 19.0784 k = 0.4252 0.4026 0.2058 ( 6225 PWs) bands (ev): -76.6621 -76.6621 -45.4597 -45.4597 -41.1171 -41.1171 -40.8108 -40.8108 -35.1143 -35.1143 -35.0251 -35.0251 -9.3000 -9.3000 -9.1751 -9.1751 3.2327 3.2327 3.3290 3.3290 4.1341 4.1341 4.5840 4.5840 5.0021 5.0021 5.2387 5.2387 5.3920 5.3920 5.7852 5.7852 6.0749 6.0749 6.6406 6.6406 8.5608 8.5608 11.2049 11.2049 12.7537 12.7537 19.0726 19.0726 k = 0.4299 0.3936 0.1929 ( 6233 PWs) bands (ev): -76.6622 -76.6622 -45.4593 -45.4593 -41.1173 -41.1173 -40.8093 -40.8093 -35.1157 -35.1157 -35.0252 -35.0252 -9.2915 -9.2915 -9.1685 -9.1685 3.2336 3.2336 3.3392 3.3392 4.1178 4.1178 4.5624 4.5624 5.0150 5.0150 5.2176 5.2176 5.3859 5.3859 5.7462 5.7462 6.0908 6.0908 6.6396 6.6396 8.5619 8.5619 11.2075 11.2075 12.6955 12.6955 19.0626 19.0626 k = 0.4346 0.3845 0.1800 ( 6227 PWs) bands (ev): -76.6623 -76.6623 -45.4590 -45.4590 -41.1174 -41.1174 -40.8079 -40.8079 -35.1169 -35.1169 -35.0252 -35.0252 -9.2834 -9.2834 -9.1622 -9.1622 3.2335 3.2335 3.3511 3.3511 4.1024 4.1024 4.5413 4.5413 5.0237 5.0237 5.1990 5.1990 5.3804 5.3804 5.7091 5.7091 6.1072 6.1072 6.6390 6.6390 8.5629 8.5629 11.2102 11.2102 12.6402 12.6402 19.0485 19.0485 k = 0.4392 0.3754 0.1672 ( 6223 PWs) bands (ev): -76.6625 -76.6625 -45.4586 -45.4586 -41.1176 -41.1176 -40.8066 -40.8066 -35.1181 -35.1181 -35.0253 -35.0253 -9.2758 -9.2758 -9.1562 -9.1562 3.2327 3.2327 3.3645 3.3645 4.0880 4.0880 4.5208 4.5208 5.0269 5.0269 5.1841 5.1841 5.3755 5.3755 5.6748 5.6748 6.1235 6.1235 6.6387 6.6387 8.5638 8.5638 11.2131 11.2131 12.5878 12.5878 19.0304 19.0304 k = 0.4439 0.3663 0.1543 ( 6225 PWs) bands (ev): -76.6626 -76.6626 -45.4583 -45.4583 -41.1178 -41.1178 -40.8053 -40.8053 -35.1193 -35.1193 -35.0254 -35.0254 -9.2686 -9.2686 -9.1506 -9.1506 3.2313 3.2313 3.3788 3.3788 4.0746 4.0746 4.5013 4.5013 5.0234 5.0234 5.1745 5.1745 5.3710 5.3710 5.6434 5.6434 6.1392 6.1392 6.6388 6.6388 8.5645 8.5645 11.2159 11.2159 12.5386 12.5386 19.0092 19.0092 k = 0.4486 0.3572 0.1415 ( 6219 PWs) bands (ev): -76.6627 -76.6627 -45.4580 -45.4580 -41.1179 -41.1179 -40.8041 -40.8041 -35.1203 -35.1203 -35.0255 -35.0255 -9.2619 -9.2619 -9.1452 -9.1452 3.2297 3.2297 3.3937 3.3937 4.0622 4.0622 4.4827 4.4827 5.0130 5.0130 5.1703 5.1703 5.3669 5.3669 5.6151 5.6151 6.1542 6.1542 6.6393 6.6393 8.5652 8.5652 11.2187 11.2187 12.4927 12.4927 18.9855 18.9855 k = 0.4533 0.3481 0.1286 ( 6222 PWs) bands (ev): -76.6628 -76.6628 -45.4578 -45.4578 -41.1180 -41.1180 -40.8030 -40.8030 -35.1213 -35.1213 -35.0255 -35.0255 -9.2558 -9.2558 -9.1403 -9.1403 3.2280 3.2280 3.4089 3.4089 4.0507 4.0507 4.4654 4.4654 4.9971 4.9971 5.1708 5.1708 5.3632 5.3632 5.5900 5.5900 6.1683 6.1683 6.6400 6.6400 8.5657 8.5657 11.2214 11.2214 12.4502 12.4502 18.9604 18.9604 k = 0.4579 0.3390 0.1157 ( 6230 PWs) bands (ev): -76.6629 -76.6629 -45.4575 -45.4575 -41.1182 -41.1182 -40.8020 -40.8020 -35.1221 -35.1221 -35.0256 -35.0256 -9.2502 -9.2502 -9.1358 -9.1358 3.2262 3.2262 3.4240 3.4240 4.0404 4.0404 4.4494 4.4494 4.9778 4.9778 5.1740 5.1740 5.3598 5.3598 5.5680 5.5680 6.1812 6.1812 6.6409 6.6409 8.5662 8.5662 11.2240 11.2240 12.4112 12.4112 18.9350 18.9350 k = 0.4626 0.3300 0.1029 ( 6232 PWs) bands (ev): -76.6629 -76.6629 -45.4573 -45.4573 -41.1183 -41.1183 -40.8011 -40.8011 -35.1229 -35.1229 -35.0257 -35.0257 -9.2451 -9.2451 -9.1317 -9.1317 3.2244 3.2244 3.4387 3.4387 4.0310 4.0310 4.4349 4.4349 4.9567 4.9567 5.1788 5.1788 5.3567 5.3567 5.5490 5.5490 6.1930 6.1930 6.6420 6.6420 8.5667 8.5667 11.2264 11.2264 12.3760 12.3760 18.9101 18.9101 k = 0.4673 0.3209 0.0900 ( 6228 PWs) bands (ev): -76.6630 -76.6630 -45.4571 -45.4571 -41.1184 -41.1184 -40.8003 -40.8003 -35.1236 -35.1236 -35.0258 -35.0258 -9.2406 -9.2406 -9.1280 -9.1280 3.2227 3.2227 3.4527 3.4527 4.0228 4.0228 4.4220 4.4220 4.9355 4.9355 5.1841 5.1841 5.3539 5.3539 5.5327 5.5327 6.2036 6.2036 6.6432 6.6432 8.5670 8.5670 11.2286 11.2286 12.3445 12.3445 18.8865 18.8865 k = 0.4720 0.3118 0.0772 ( 6228 PWs) bands (ev): -76.6631 -76.6631 -45.4570 -45.4570 -41.1185 -41.1185 -40.7996 -40.7996 -35.1242 -35.1242 -35.0258 -35.0258 -9.2366 -9.2366 -9.1248 -9.1248 3.2212 3.2212 3.4656 3.4656 4.0156 4.0156 4.4107 4.4107 4.9151 4.9151 5.1893 5.1893 5.3514 5.3514 5.5190 5.5190 6.2129 6.2129 6.6444 6.6444 8.5673 8.5673 11.2306 11.2306 12.3171 12.3171 18.8649 18.8649 k = 0.4766 0.3027 0.0643 ( 6232 PWs) bands (ev): -76.6631 -76.6631 -45.4568 -45.4568 -41.1185 -41.1185 -40.7990 -40.7990 -35.1248 -35.1248 -35.0259 -35.0259 -9.2333 -9.2333 -9.1221 -9.1221 3.2199 3.2199 3.4772 3.4772 4.0095 4.0095 4.4012 4.4012 4.8965 4.8965 5.1941 5.1941 5.3493 5.3493 5.5078 5.5078 6.2208 6.2208 6.6455 6.6455 8.5676 8.5676 11.2323 11.2323 12.2936 12.2936 18.8459 18.8459 k = 0.4813 0.2936 0.0514 ( 6232 PWs) bands (ev): -76.6632 -76.6632 -45.4567 -45.4567 -41.1186 -41.1186 -40.7985 -40.7985 -35.1252 -35.1252 -35.0259 -35.0259 -9.2305 -9.2305 -9.1198 -9.1198 3.2188 3.2188 3.4872 3.4872 4.0045 4.0045 4.3934 4.3934 4.8802 4.8802 5.1982 5.1982 5.3474 5.3474 5.4988 5.4988 6.2274 6.2274 6.6465 6.6465 8.5678 8.5678 11.2337 11.2337 12.2743 12.2743 18.8298 18.8298 k = 0.4860 0.2845 0.0386 ( 6236 PWs) bands (ev): -76.6632 -76.6632 -45.4566 -45.4566 -41.1186 -41.1186 -40.7981 -40.7981 -35.1255 -35.1255 -35.0259 -35.0259 -9.2284 -9.2284 -9.1181 -9.1181 3.2179 3.2179 3.4952 3.4952 4.0006 4.0006 4.3874 4.3874 4.8670 4.8670 5.2016 5.2016 5.3459 5.3459 5.4920 5.4920 6.2325 6.2325 6.6474 6.6474 8.5679 8.5679 11.2348 11.2348 12.2592 12.2592 18.8170 18.8170 k = 0.4907 0.2755 0.0257 ( 6240 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7979 -40.7979 -35.1258 -35.1258 -35.0260 -35.0260 -9.2268 -9.2268 -9.1168 -9.1168 3.2172 3.2172 3.5011 3.5011 3.9978 3.9978 4.3830 4.3830 4.8572 4.8572 5.2040 5.2040 5.3449 5.3449 5.4872 5.4872 6.2361 6.2361 6.6481 6.6481 8.5680 8.5680 11.2356 11.2356 12.2484 12.2484 18.8077 18.8077 k = 0.4953 0.2664 0.0129 ( 6250 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7977 -40.7977 -35.1259 -35.1259 -35.0260 -35.0260 -9.2259 -9.2259 -9.1160 -9.1160 3.2168 3.2168 3.5047 3.5047 3.9961 3.9961 4.3805 4.3805 4.8512 4.8512 5.2055 5.2055 5.3442 5.3442 5.4844 5.4844 6.2383 6.2383 6.6485 6.6485 8.5681 8.5681 11.2361 11.2361 12.2419 12.2419 18.8021 18.8021 k = 0.5000 0.2573 0.0000 ( 6250 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1259 -35.1259 -35.0260 -35.0260 -9.2256 -9.2256 -9.1158 -9.1158 3.2167 3.2167 3.5059 3.5059 3.9956 3.9956 4.3796 4.3796 4.8491 4.8491 5.2061 5.2061 5.3440 5.3440 5.4834 5.4834 6.2391 6.2391 6.6486 6.6486 8.5681 8.5681 11.2363 11.2363 12.2397 12.2397 18.8002 18.8002 k = 0.5000 0.2573 0.0000 ( 6250 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1259 -35.1259 -35.0260 -35.0260 -9.2256 -9.2256 -9.1158 -9.1158 3.2167 3.2167 3.5059 3.5059 3.9956 3.9956 4.3796 4.3796 4.8491 4.8491 5.2061 5.2061 5.3440 5.3440 5.4834 5.4834 6.2391 6.2391 6.6486 6.6486 8.5681 8.5681 11.2363 11.2363 12.2397 12.2397 18.8002 18.8002 k = 0.4853 0.2497 0.0000 ( 6246 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1259 -35.1259 -35.0260 -35.0260 -9.2278 -9.2278 -9.1135 -9.1135 3.2137 3.2137 3.5043 3.5043 3.9996 3.9996 4.3790 4.3790 4.8484 4.8484 5.2064 5.2064 5.3405 5.3405 5.4913 5.4913 6.2391 6.2391 6.6486 6.6486 8.5668 8.5668 11.2285 11.2285 12.2448 12.2448 18.7994 18.7994 k = 0.4706 0.2422 0.0000 ( 6240 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1260 -35.1260 -35.0260 -35.0260 -9.2340 -9.2340 -9.1072 -9.1072 3.2050 3.2050 3.4993 3.4993 4.0116 4.0116 4.3774 4.3774 4.8463 4.8463 5.2074 5.2074 5.3322 5.3322 5.5124 5.5124 6.2391 6.2391 6.6486 6.6486 8.5628 8.5628 11.2057 11.2057 12.2598 12.2598 18.7971 18.7971 k = 0.4559 0.2346 0.0000 ( 6240 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1260 -35.1260 -35.0260 -35.0260 -9.2430 -9.2430 -9.0978 -9.0978 3.1911 3.1911 3.4910 3.4910 4.0309 4.0309 4.3748 4.3748 4.8429 4.8429 5.2091 5.2091 5.3231 5.3231 5.5428 5.5428 6.2392 6.2392 6.6486 6.6486 8.5562 8.5562 11.1694 11.1694 12.2831 12.2831 18.7932 18.7932 k = 0.4412 0.2270 0.0000 ( 6240 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1260 -35.1260 -35.0260 -35.0260 -9.2539 -9.2539 -9.0865 -9.0865 3.1726 3.1726 3.4797 3.4797 4.0567 4.0567 4.3715 4.3715 4.8383 4.8383 5.2115 5.2115 5.3156 5.3156 5.5793 5.5793 6.2393 6.2393 6.6486 6.6486 8.5470 8.5470 11.1214 11.1214 12.3131 12.3131 18.7878 18.7878 k = 0.4265 0.2195 0.0000 ( 6240 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1260 -35.1260 -35.0260 -35.0260 -9.2659 -9.2659 -9.0739 -9.0739 3.1505 3.1505 3.4653 3.4653 4.0881 4.0881 4.3676 4.3676 4.8326 4.8326 5.2147 5.2147 5.3108 5.3108 5.6202 5.6202 6.2394 6.2394 6.6485 6.6485 8.5353 8.5353 11.0638 11.0638 12.3479 12.3479 18.7809 18.7809 k = 0.4118 0.2119 0.0000 ( 6242 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1260 -35.1260 -35.0259 -35.0259 -9.2785 -9.2785 -9.0606 -9.0606 3.1255 3.1255 3.4481 3.4481 4.1242 4.1242 4.3636 4.3636 4.8260 4.8260 5.2189 5.2189 5.3092 5.3092 5.6642 5.6642 6.2396 6.2396 6.6485 6.6485 8.5211 8.5211 10.9983 10.9983 12.3858 12.3858 18.7726 18.7726 k = 0.3971 0.2043 0.0000 ( 6246 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1261 -35.1261 -35.0259 -35.0259 -9.2915 -9.2915 -9.0468 -9.0468 3.0984 3.0984 3.4283 3.4283 4.1641 4.1641 4.3596 4.3596 4.8187 4.8187 5.2244 5.2244 5.3105 5.3105 5.7105 5.7105 6.2399 6.2399 6.6485 6.6485 8.5044 8.5044 10.9266 10.9266 12.4256 12.4256 18.7630 18.7630 k = 0.3824 0.1967 0.0000 ( 6242 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1261 -35.1261 -35.0259 -35.0259 -9.3046 -9.3046 -9.0329 -9.0329 3.0699 3.0699 3.4060 3.4060 4.2073 4.2073 4.3560 4.3560 4.8107 4.8107 5.2314 5.2314 5.3144 5.3144 5.7584 5.7584 6.2402 6.2402 6.6486 6.6486 8.4855 8.4855 10.8501 10.8501 12.4661 12.4661 18.7520 18.7520 k = 0.3676 0.1892 0.0000 ( 6236 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1261 -35.1261 -35.0259 -35.0259 -9.3176 -9.3176 -9.0188 -9.0188 3.0405 3.0405 3.3815 3.3815 4.2530 4.2530 4.3528 4.3528 4.8024 4.8024 5.2402 5.2402 5.3207 5.3207 5.8071 5.8071 6.2407 6.2407 6.6486 6.6486 8.4643 8.4643 10.7698 10.7698 12.5066 12.5066 18.7400 18.7400 k = 0.3529 0.1816 0.0000 ( 6232 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1262 -35.1262 -35.0259 -35.0259 -9.3306 -9.3306 -9.0048 -9.0048 3.0106 3.0106 3.3552 3.3552 4.3006 4.3006 4.3504 4.3504 4.7937 4.7937 5.2508 5.2508 5.3291 5.3291 5.8561 5.8561 6.2413 6.2413 6.6487 6.6487 8.4411 8.4411 10.6866 10.6866 12.5464 12.5464 18.7268 18.7268 k = 0.3382 0.1740 0.0000 ( 6224 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1262 -35.1262 -35.0258 -35.0258 -9.3433 -9.3433 -8.9909 -8.9909 2.9805 2.9805 3.3272 3.3272 4.3439 4.3439 4.3547 4.3547 4.7849 4.7849 5.2631 5.2631 5.3394 5.3394 5.9047 5.9047 6.2422 6.2422 6.6489 6.6489 8.4159 8.4159 10.6016 10.6016 12.5852 12.5852 18.7127 18.7127 k = 0.3235 0.1665 0.0000 ( 6206 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1262 -35.1262 -35.0258 -35.0258 -9.3558 -9.3558 -8.9772 -8.9772 2.9507 2.9507 3.2979 3.2979 4.3461 4.3461 4.4020 4.4020 4.7760 4.7760 5.2767 5.2767 5.3519 5.3519 5.9524 5.9524 6.2434 6.2434 6.6491 6.6491 8.3889 8.3889 10.5152 10.5152 12.6227 12.6227 18.6979 18.6979 k = 0.3088 0.1589 0.0000 ( 6214 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1263 -35.1263 -35.0258 -35.0258 -9.3680 -9.3680 -8.9637 -8.9637 2.9213 2.9213 3.2676 3.2676 4.3456 4.3456 4.4535 4.4535 4.7671 4.7671 5.2913 5.2913 5.3666 5.3666 5.9984 5.9984 6.2451 6.2451 6.6494 6.6494 8.3602 8.3602 10.4283 10.4283 12.6585 12.6585 18.6823 18.6823 k = 0.2941 0.1513 0.0000 ( 6200 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1263 -35.1263 -35.0258 -35.0258 -9.3798 -9.3798 -8.9505 -8.9505 2.8925 2.8925 3.2367 3.2367 4.3456 4.3456 4.5057 4.5057 4.7584 4.7584 5.3063 5.3063 5.3841 5.3841 6.0420 6.0420 6.2475 6.2475 6.6498 6.6498 8.3300 8.3300 10.3413 10.3413 12.6926 12.6926 18.6663 18.6663 k = 0.2794 0.1438 0.0000 ( 6202 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1264 -35.1264 -35.0257 -35.0257 -9.3912 -9.3912 -8.9377 -8.9377 2.8645 2.8645 3.2055 3.2055 4.3461 4.3461 4.5583 4.5583 4.7499 4.7499 5.3209 5.3209 5.4048 5.4048 6.0824 6.0824 6.2511 6.2511 6.6503 6.6503 8.2986 8.2986 10.2550 10.2550 12.7249 12.7249 18.6499 18.6499 k = 0.2647 0.1362 0.0000 ( 6190 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1264 -35.1264 -35.0257 -35.0257 -9.4022 -9.4022 -8.9253 -8.9253 2.8374 2.8374 3.1742 3.1742 4.3470 4.3470 4.6107 4.6107 4.7419 4.7419 5.3347 5.3347 5.4289 5.4289 6.1184 6.1184 6.2567 6.2567 6.6510 6.6510 8.2661 8.2661 10.1697 10.1697 12.7554 12.7554 18.6334 18.6334 k = 0.2500 0.1286 0.0000 ( 6194 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1264 -35.1264 -35.0257 -35.0257 -9.4127 -9.4127 -8.9134 -8.9134 2.8113 2.8113 3.1432 3.1432 4.3483 4.3483 4.6624 4.6624 4.7346 4.7346 5.3476 5.3476 5.4564 5.4564 6.1486 6.1486 6.2650 6.2650 6.6518 6.6518 8.2327 8.2327 10.0861 10.0861 12.7839 12.7839 18.6167 18.6167 k = 0.2353 0.1211 0.0000 ( 6192 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1265 -35.1265 -35.0257 -35.0257 -9.4228 -9.4228 -8.9019 -8.9019 2.7864 2.7864 3.1127 3.1127 4.3498 4.3498 4.7081 4.7081 4.7332 4.7332 5.3596 5.3596 5.4873 5.4873 6.1716 6.1716 6.2771 6.2771 6.6527 6.6527 8.1987 8.1987 10.0046 10.0046 12.8105 12.8105 18.6002 18.6002 k = 0.2206 0.1135 0.0000 ( 6196 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1266 -35.1266 -35.0256 -35.0256 -9.4324 -9.4324 -8.8909 -8.8909 2.7627 2.7627 3.0829 3.0829 4.3515 4.3515 4.7147 4.7147 4.7706 4.7706 5.3706 5.3706 5.5210 5.5210 6.1874 6.1874 6.2926 6.2926 6.6538 6.6538 8.1643 8.1643 9.9257 9.9257 12.8353 12.8353 18.5839 18.5839 k = 0.2059 0.1059 0.0000 ( 6203 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1266 -35.1266 -35.0256 -35.0256 -9.4414 -9.4414 -8.8805 -8.8805 2.7402 2.7402 3.0542 3.0542 4.3532 4.3532 4.7090 4.7090 4.8196 4.8196 5.3808 5.3808 5.5575 5.5575 6.1975 6.1975 6.3098 6.3098 6.6550 6.6550 8.1299 8.1299 9.8499 9.8499 12.8582 12.8582 18.5680 18.5680 k = 0.1912 0.0984 0.0000 ( 6207 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1267 -35.1267 -35.0256 -35.0256 -9.4499 -9.4499 -8.8706 -8.8706 2.7191 2.7191 3.0267 3.0267 4.3550 4.3550 4.7027 4.7027 4.8682 4.8682 5.3903 5.3903 5.5963 5.5963 6.2037 6.2037 6.3263 6.3263 6.6562 6.6562 8.0956 8.0956 9.7777 9.7777 12.8792 12.8792 18.5525 18.5525 k = 0.1765 0.0908 0.0000 ( 6205 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1267 -35.1267 -35.0256 -35.0256 -9.4579 -9.4579 -8.8614 -8.8614 2.6993 2.6993 3.0005 3.0005 4.3568 4.3568 4.6967 4.6967 4.9154 4.9154 5.3991 5.3991 5.6371 5.6371 6.2077 6.2077 6.3406 6.3406 6.6574 6.6574 8.0618 8.0618 9.7094 9.7094 12.8985 12.8985 18.5374 18.5374 k = 0.1618 0.0832 0.0000 ( 6213 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1267 -35.1267 -35.0256 -35.0256 -9.4652 -9.4652 -8.8528 -8.8528 2.6810 2.6810 2.9759 2.9759 4.3585 4.3585 4.6911 4.6911 4.9608 4.9608 5.4072 5.4072 5.6797 5.6797 6.2102 6.2102 6.3515 6.3515 6.6585 6.6585 8.0289 8.0289 9.6454 9.6454 12.9161 12.9161 18.5226 18.5226 k = 0.1471 0.0757 0.0000 ( 6213 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1268 -35.1268 -35.0255 -35.0255 -9.4720 -9.4720 -8.8449 -8.8449 2.6642 2.6642 2.9530 2.9530 4.3602 4.3602 4.6859 4.6859 5.0039 5.0039 5.4146 5.4146 5.7238 5.7238 6.2118 6.2118 6.3585 6.3585 6.6595 6.6595 7.9971 7.9971 9.5862 9.5862 12.9319 12.9319 18.5076 18.5076 k = 0.1324 0.0681 0.0000 ( 6209 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1268 -35.1268 -35.0255 -35.0255 -9.4782 -9.4782 -8.8376 -8.8376 2.6488 2.6488 2.9319 2.9319 4.3617 4.3617 4.6811 4.6811 5.0444 5.0444 5.4214 5.4214 5.7690 5.7690 6.2129 6.2129 6.3611 6.3611 6.6601 6.6601 7.9668 7.9668 9.5319 9.5319 12.9461 12.9461 18.4907 18.4907 k = 0.1176 0.0605 0.0000 ( 6219 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1269 -35.1269 -35.0255 -35.0255 -9.4837 -9.4837 -8.8310 -8.8310 2.6350 2.6350 2.9128 2.9128 4.3631 4.3631 4.6768 4.6768 5.0820 5.0820 5.4275 5.4275 5.8150 5.8150 6.2134 6.2134 6.3593 6.3593 6.6604 6.6604 7.9384 7.9384 9.4829 9.4829 12.9587 12.9587 18.4713 18.4713 k = 0.1029 0.0530 0.0000 ( 6225 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1269 -35.1269 -35.0255 -35.0255 -9.4886 -9.4886 -8.8252 -8.8252 2.6228 2.6228 2.8957 2.8957 4.3643 4.3643 4.6730 4.6730 5.1162 5.1162 5.4329 5.4329 5.8614 5.8614 6.2137 6.2137 6.3530 6.3530 6.6604 6.6604 7.9122 7.9122 9.4393 9.4393 12.9697 12.9697 18.4517 18.4517 k = 0.0882 0.0454 0.0000 ( 6217 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1269 -35.1269 -35.0255 -35.0255 -9.4929 -9.4929 -8.8201 -8.8201 2.6121 2.6121 2.8807 2.8807 4.3653 4.3653 4.6697 4.6697 5.1468 5.1468 5.4377 5.4377 5.9079 5.9079 6.2135 6.2135 6.3424 6.3424 6.6602 6.6602 7.8887 7.8887 9.4014 9.4014 12.9792 12.9792 18.4337 18.4337 k = 0.0735 0.0378 0.0000 ( 6219 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1269 -35.1269 -35.0255 -35.0255 -9.4965 -9.4965 -8.8158 -8.8158 2.6031 2.6031 2.8679 2.8679 4.3662 4.3662 4.6669 4.6669 5.1733 5.1733 5.4417 5.4417 5.9539 5.9539 6.2129 6.2129 6.3276 6.3276 6.6597 6.6597 7.8680 7.8680 9.3692 9.3692 12.9871 12.9871 18.4180 18.4180 k = 0.0588 0.0303 0.0000 ( 6217 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1270 -35.1270 -35.0255 -35.0255 -9.4995 -9.4995 -8.8122 -8.8122 2.5957 2.5957 2.8573 2.8573 4.3670 4.3670 4.6646 4.6646 5.1956 5.1956 5.4450 5.4450 5.9990 5.9990 6.2115 6.2115 6.3094 6.3094 6.6591 6.6591 7.8506 7.8506 9.3428 9.3428 12.9936 12.9936 18.4049 18.4049 k = 0.0441 0.0227 0.0000 ( 6217 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1270 -35.1270 -35.0255 -35.0255 -9.5018 -9.5018 -8.8094 -8.8094 2.5899 2.5899 2.8491 2.8491 4.3675 4.3675 4.6629 4.6629 5.2132 5.2132 5.4476 5.4476 6.0424 6.0424 6.2086 6.2086 6.2887 6.2887 6.6586 6.6586 7.8367 7.8367 9.3222 9.3222 12.9986 12.9986 18.3946 18.3946 k = 0.0294 0.0151 0.0000 ( 6213 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1270 -35.1270 -35.0254 -35.0254 -9.5035 -9.5035 -8.8075 -8.8075 2.5857 2.5857 2.8432 2.8432 4.3679 4.3679 4.6616 4.6616 5.2259 5.2259 5.4495 5.4495 6.0834 6.0834 6.2022 6.2022 6.2685 6.2685 6.6581 6.6581 7.8266 7.8266 9.3075 9.3075 13.0022 13.0022 18.3871 18.3871 k = 0.0147 0.0076 0.0000 ( 6217 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1270 -35.1270 -35.0255 -35.0255 -9.5045 -9.5045 -8.8063 -8.8063 2.5832 2.5832 2.8396 2.8396 4.3682 4.3682 4.6608 4.6608 5.2337 5.2337 5.4506 5.4506 6.1199 6.1199 6.1891 6.1891 6.2539 6.2539 6.6578 6.6578 7.8205 7.8205 9.2987 9.2987 13.0043 13.0043 18.3826 18.3826 k = 0.0000 0.0000 0.0000 ( 6219 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1270 -35.1270 -35.0255 -35.0255 -9.5048 -9.5048 -8.8059 -8.8059 2.5824 2.5824 2.8384 2.8384 4.3682 4.3682 4.6606 4.6606 5.2363 5.2363 5.4510 5.4510 6.1408 6.1408 6.1761 6.1761 6.2489 6.2489 6.6577 6.6577 7.8185 7.8185 9.2958 9.2958 13.0050 13.0050 18.3811 18.3811 k = 0.0000 0.0000 0.0000 ( 6219 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1270 -35.1270 -35.0255 -35.0255 -9.5048 -9.5048 -8.8059 -8.8059 2.5824 2.5824 2.8384 2.8384 4.3682 4.3682 4.6606 4.6606 5.2363 5.2363 5.4510 5.4510 6.1408 6.1408 6.1761 6.1761 6.2489 6.2489 6.6577 6.6577 7.8185 7.8185 9.2958 9.2958 13.0050 13.0050 18.3811 18.3811 k = 0.0059-0.0115 0.0103 ( 6221 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1270 -35.1270 -35.0255 -35.0255 -9.5045 -9.5045 -8.8060 -8.8060 2.5836 2.5836 2.8394 2.8394 4.3684 4.3684 4.6611 4.6611 5.2303 5.2303 5.4494 5.4494 6.1350 6.1350 6.1796 6.1796 6.2506 6.2506 6.6575 6.6575 7.8204 7.8204 9.3003 9.3003 13.0078 13.0078 18.3762 18.3762 k = 0.0119-0.0230 0.0206 ( 6209 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1185 -41.1185 -40.7976 -40.7976 -35.1269 -35.1269 -35.0256 -35.0256 -9.5036 -9.5036 -8.8066 -8.8066 2.5871 2.5871 2.8424 2.8424 4.3688 4.3688 4.6626 4.6626 5.2129 5.2129 5.4446 5.4446 6.1201 6.1201 6.1877 6.1877 6.2554 6.2554 6.6570 6.6570 7.8263 7.8263 9.3136 9.3136 13.0161 13.0161 18.3596 18.3596 k = 0.0178-0.0346 0.0309 ( 6211 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1267 -35.1267 -35.0257 -35.0257 -9.5021 -9.5021 -8.8076 -8.8076 2.5928 2.5928 2.8474 2.8474 4.3694 4.3694 4.6650 4.6650 5.1846 5.1846 5.4367 5.4367 6.0986 6.0986 6.1978 6.1978 6.2631 6.2631 6.6562 6.6562 7.8358 7.8358 9.3357 9.3357 13.0299 13.0299 18.3272 18.3272 k = 0.0237-0.0461 0.0412 ( 6211 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1264 -35.1264 -35.0260 -35.0260 -9.5000 -9.5000 -8.8090 -8.8090 2.6009 2.6009 2.8544 2.8544 4.3703 4.3703 4.6685 4.6685 5.1466 5.1466 5.4260 5.4260 6.0709 6.0709 6.2092 6.2092 6.2731 6.2731 6.6550 6.6550 7.8485 7.8485 9.3662 9.3662 13.0491 13.0491 18.2781 18.2781 k = 0.0297-0.0576 0.0515 ( 6215 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1186 -41.1186 -40.7976 -40.7976 -35.1261 -35.1261 -35.0263 -35.0263 -9.4973 -9.4973 -8.8107 -8.8107 2.6113 2.6113 2.8633 2.8633 4.3713 4.3713 4.6729 4.6729 5.1002 5.1002 5.4127 5.4127 6.0375 6.0375 6.2215 6.2215 6.2848 6.2848 6.6534 6.6534 7.8640 7.8640 9.4050 9.4050 13.0737 13.0737 18.2142 18.2142 k = 0.0356-0.0691 0.0618 ( 6215 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1257 -35.1257 -35.0267 -35.0267 -9.4940 -9.4940 -8.8128 -8.8128 2.6240 2.6240 2.8740 2.8740 4.3726 4.3726 4.6784 4.6784 5.0467 5.0467 5.3972 5.3972 5.9986 5.9986 6.2343 6.2343 6.2976 6.2976 6.6515 6.6515 7.8818 7.8818 9.4517 9.4517 13.1033 13.1033 18.1377 18.1377 k = 0.0415-0.0807 0.0721 ( 6207 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1252 -35.1252 -35.0271 -35.0271 -9.4901 -9.4901 -8.8153 -8.8153 2.6389 2.6389 2.8865 2.8865 4.3740 4.3740 4.6848 4.6848 4.9875 4.9875 5.3796 5.3796 5.9548 5.9548 6.2471 6.2471 6.3110 6.3110 6.6493 6.6493 7.9012 7.9012 9.5057 9.5057 13.1380 13.1380 18.0507 18.0507 k = 0.0474-0.0922 0.0824 ( 6211 PWs) bands (ev): -76.6632 -76.6632 -45.4566 -45.4566 -41.1188 -41.1188 -40.7976 -40.7976 -35.1247 -35.1247 -35.0276 -35.0276 -9.4857 -9.4857 -8.8181 -8.8181 2.6561 2.6561 2.9008 2.9008 4.3756 4.3756 4.6921 4.6921 4.9238 4.9238 5.3603 5.3603 5.9066 5.9066 6.2592 6.2592 6.3249 6.3249 6.6468 6.6468 7.9218 7.9218 9.5667 9.5667 13.1775 13.1775 17.9548 17.9548 k = 0.0534-0.1037 0.0927 ( 6213 PWs) bands (ev): -76.6632 -76.6632 -45.4566 -45.4566 -41.1189 -41.1189 -40.7976 -40.7976 -35.1241 -35.1241 -35.0282 -35.0282 -9.4807 -9.4807 -8.8213 -8.8213 2.6755 2.6755 2.9166 2.9166 4.3771 4.3771 4.7005 4.7005 4.8566 4.8566 5.3395 5.3395 5.8547 5.8547 6.2699 6.2699 6.3391 6.3391 6.6439 6.6439 7.9430 7.9430 9.6342 9.6342 13.2216 13.2216 17.8516 17.8516 k = 0.0593-0.1152 0.1030 ( 6205 PWs) bands (ev): -76.6632 -76.6632 -45.4566 -45.4566 -41.1189 -41.1189 -40.7976 -40.7976 -35.1234 -35.1234 -35.0288 -35.0288 -9.4752 -9.4752 -8.8248 -8.8248 2.6970 2.6970 2.9339 2.9339 4.3785 4.3785 4.7097 4.7097 4.7872 4.7872 5.3176 5.3176 5.7994 5.7994 6.2787 6.2787 6.3536 6.3536 6.6409 6.6409 7.9644 7.9644 9.7075 9.7075 13.2700 13.2700 17.7424 17.7424 k = 0.0652-0.1268 0.1133 ( 6205 PWs) bands (ev): -76.6632 -76.6632 -45.4567 -45.4567 -41.1190 -41.1190 -40.7976 -40.7976 -35.1227 -35.1227 -35.0295 -35.0295 -9.4692 -9.4692 -8.8286 -8.8286 2.7206 2.7206 2.9526 2.9526 4.3795 4.3795 4.7142 4.7142 4.7223 4.7223 5.2947 5.2947 5.7414 5.7414 6.2850 6.2850 6.3683 6.3683 6.6378 6.6378 7.9854 7.9854 9.7862 9.7862 13.3225 13.3225 17.6283 17.6283 k = 0.0712-0.1383 0.1236 ( 6211 PWs) bands (ev): -76.6632 -76.6632 -45.4567 -45.4567 -41.1191 -41.1191 -40.7977 -40.7977 -35.1219 -35.1219 -35.0303 -35.0303 -9.4627 -9.4627 -8.8328 -8.8328 2.7463 2.7463 2.9723 2.9723 4.3796 4.3796 4.6458 4.6458 4.7314 4.7314 5.2711 5.2711 5.6811 5.6811 6.2886 6.2886 6.3831 6.3831 6.6347 6.6347 8.0057 8.0057 9.8696 9.8696 13.3787 13.3787 17.5104 17.5104 k = 0.0771-0.1498 0.1339 ( 6203 PWs) bands (ev): -76.6632 -76.6632 -45.4567 -45.4567 -41.1192 -41.1192 -40.7977 -40.7977 -35.1210 -35.1210 -35.0311 -35.0311 -9.4558 -9.4558 -8.8372 -8.8372 2.7741 2.7741 2.9929 2.9929 4.3775 4.3775 4.5776 4.5776 4.7434 4.7434 5.2469 5.2469 5.6190 5.6190 6.2894 6.2894 6.3975 6.3975 6.6320 6.6320 8.0250 8.0250 9.9573 9.9573 13.4383 13.4383 17.3896 17.3896 k = 0.0830-0.1613 0.1442 ( 6207 PWs) bands (ev): -76.6632 -76.6632 -45.4568 -45.4568 -41.1193 -41.1193 -40.7977 -40.7977 -35.1201 -35.1201 -35.0320 -35.0320 -9.4484 -9.4484 -8.8419 -8.8419 2.8037 2.8037 3.0140 3.0140 4.3699 4.3699 4.5157 4.5157 4.7563 4.7563 5.2223 5.2223 5.5555 5.5555 6.2874 6.2874 6.4111 6.4111 6.6299 6.6299 8.0429 8.0429 10.0487 10.0487 13.5009 13.5009 17.2666 17.2666 k = 0.0890-0.1729 0.1544 ( 6207 PWs) bands (ev): -76.6632 -76.6632 -45.4568 -45.4568 -41.1194 -41.1194 -40.7977 -40.7977 -35.1191 -35.1191 -35.0330 -35.0330 -9.4406 -9.4406 -8.8469 -8.8469 2.8352 2.8352 3.0352 3.0352 4.3492 4.3492 4.4685 4.4685 4.7702 4.7702 5.1974 5.1974 5.4911 5.4911 6.2828 6.2828 6.4230 6.4230 6.6288 6.6288 8.0593 8.0593 10.1433 10.1433 13.5662 13.5662 17.1422 17.1422 k = 0.0949-0.1844 0.1647 ( 6211 PWs) bands (ev): -76.6632 -76.6632 -45.4568 -45.4568 -41.1195 -41.1195 -40.7977 -40.7977 -35.1180 -35.1180 -35.0340 -35.0340 -9.4325 -9.4325 -8.8521 -8.8521 2.8684 2.8684 3.0562 3.0562 4.3082 4.3082 4.4441 4.4441 4.7849 4.7849 5.1724 5.1724 5.4262 5.4262 6.2757 6.2757 6.4329 6.4329 6.6291 6.6291 8.0738 8.0738 10.2406 10.2406 13.6337 13.6337 17.0170 17.0170 k = 0.1008-0.1959 0.1750 ( 6203 PWs) bands (ev): -76.6632 -76.6632 -45.4569 -45.4569 -41.1196 -41.1196 -40.7977 -40.7977 -35.1169 -35.1169 -35.0350 -35.0350 -9.4239 -9.4239 -8.8576 -8.8576 2.9030 2.9030 3.0764 3.0764 4.2547 4.2547 4.4355 4.4355 4.8004 4.8004 5.1473 5.1473 5.3610 5.3610 6.2663 6.2663 6.4399 6.4399 6.6313 6.6313 8.0864 8.0864 10.3400 10.3400 13.7031 13.7031 16.8915 16.8915 k = 0.1067-0.2074 0.1853 ( 6203 PWs) bands (ev): -76.6632 -76.6632 -45.4569 -45.4569 -41.1197 -41.1197 -40.7977 -40.7977 -35.1157 -35.1157 -35.0361 -35.0361 -9.4151 -9.4151 -8.8633 -8.8633 2.9388 2.9388 3.0953 3.0953 4.1988 4.1988 4.4339 4.4339 4.8166 4.8166 5.1221 5.1221 5.2962 5.2962 6.2546 6.2546 6.4438 6.4438 6.6357 6.6357 8.0968 8.0968 10.4412 10.4412 13.7738 13.7738 16.7662 16.7662 k = 0.1127-0.2190 0.1956 ( 6203 PWs) bands (ev): -76.6632 -76.6632 -45.4570 -45.4570 -41.1198 -41.1198 -40.7978 -40.7978 -35.1145 -35.1145 -35.0373 -35.0373 -9.4060 -9.4060 -8.8692 -8.8692 2.9753 2.9753 3.1122 3.1122 4.1454 4.1454 4.4352 4.4352 4.8336 4.8336 5.0967 5.0967 5.2321 5.2321 6.2409 6.2409 6.4444 6.4444 6.6423 6.6423 8.1049 8.1049 10.5437 10.5437 13.8454 13.8454 16.6415 16.6415 k = 0.1186-0.2305 0.2059 ( 6203 PWs) bands (ev): -76.6632 -76.6632 -45.4570 -45.4570 -41.1199 -41.1199 -40.7978 -40.7978 -35.1132 -35.1132 -35.0385 -35.0385 -9.3966 -9.3966 -8.8752 -8.8752 3.0112 3.0112 3.1272 3.1272 4.0974 4.0974 4.4381 4.4381 4.8512 4.8512 5.0709 5.0709 5.1695 5.1695 6.2251 6.2251 6.4418 6.4418 6.6508 6.6508 8.1107 8.1107 10.6469 10.6469 13.9175 13.9175 16.5179 16.5179 k = 0.1245-0.2420 0.2162 ( 6203 PWs) bands (ev): -76.6632 -76.6632 -45.4571 -45.4571 -41.1201 -41.1201 -40.7978 -40.7978 -35.1119 -35.1119 -35.0398 -35.0398 -9.3871 -9.3871 -8.8814 -8.8814 3.0440 3.0440 3.1416 3.1416 4.0566 4.0566 4.4419 4.4419 4.8693 4.8693 5.0433 5.0433 5.1103 5.1103 6.2073 6.2073 6.4364 6.4364 6.6610 6.6610 8.1141 8.1141 10.7506 10.7506 13.9895 13.9895 16.3957 16.3957 k = 0.1305-0.2535 0.2265 ( 6207 PWs) bands (ev): -76.6632 -76.6632 -45.4571 -45.4571 -41.1202 -41.1202 -40.7978 -40.7978 -35.1105 -35.1105 -35.0411 -35.0411 -9.3773 -9.3773 -8.8878 -8.8878 3.0680 3.0680 3.1597 3.1597 4.0244 4.0244 4.4464 4.4464 4.8875 4.8875 5.0100 5.0100 5.0591 5.0591 6.1877 6.1877 6.4287 6.4287 6.6722 6.6722 8.1149 8.1149 10.8542 10.8542 14.0610 14.0610 16.2754 16.2754 k = 0.1364-0.2651 0.2368 ( 6201 PWs) bands (ev): -76.6632 -76.6632 -45.4572 -45.4572 -41.1203 -41.1203 -40.7978 -40.7978 -35.1090 -35.1090 -35.0425 -35.0425 -9.3674 -9.3674 -8.8943 -8.8943 3.0768 3.0768 3.1871 3.1871 4.0018 4.0018 4.4516 4.4516 4.9039 4.9039 4.9669 4.9669 5.0223 5.0223 6.1664 6.1664 6.4191 6.4191 6.6841 6.6841 8.1131 8.1131 10.9574 10.9574 14.1314 14.1314 16.1572 16.1572 k = 0.1423-0.2766 0.2471 ( 6191 PWs) bands (ev): -76.6631 -76.6631 -45.4572 -45.4572 -41.1204 -41.1204 -40.7979 -40.7979 -35.1076 -35.1076 -35.0439 -35.0439 -9.3574 -9.3574 -8.9009 -8.9009 3.0704 3.0704 3.2230 3.2230 3.9893 3.9893 4.4572 4.4572 4.8974 4.8974 4.9394 4.9394 4.9959 4.9959 6.1434 6.1434 6.4080 6.4080 6.6962 6.6962 8.1087 8.1087 11.0597 11.0597 14.2003 14.2003 16.0415 16.0415 k = 0.1483-0.2881 0.2574 ( 6189 PWs) bands (ev): -76.6631 -76.6631 -45.4573 -45.4573 -41.1205 -41.1205 -40.7979 -40.7979 -35.1060 -35.1060 -35.0454 -35.0454 -9.3473 -9.3473 -8.9076 -8.9076 3.0526 3.0526 3.2637 3.2637 3.9868 3.9868 4.4635 4.4635 4.8504 4.8504 4.9481 4.9481 4.9775 4.9775 6.1188 6.1188 6.3957 6.3957 6.7083 6.7083 8.1017 8.1017 11.1607 11.1607 14.2671 14.2671 15.9287 15.9287 k = 0.1542-0.2996 0.2677 ( 6193 PWs) bands (ev): -76.6631 -76.6631 -45.4573 -45.4573 -41.1206 -41.1206 -40.7979 -40.7979 -35.1045 -35.1045 -35.0469 -35.0469 -9.3372 -9.3372 -8.9143 -8.9143 3.0264 3.0264 3.3065 3.3065 3.9932 3.9932 4.4703 4.4703 4.7995 4.7995 4.9416 4.9416 4.9822 4.9822 6.0926 6.0926 6.3824 6.3824 6.7200 6.7200 8.0920 8.0920 11.2600 11.2600 14.3314 14.3314 15.8191 15.8191 k = 0.1601-0.3112 0.2780 ( 6205 PWs) bands (ev): -76.6631 -76.6631 -45.4573 -45.4573 -41.1207 -41.1207 -40.7979 -40.7979 -35.1029 -35.1029 -35.0484 -35.0484 -9.3271 -9.3271 -8.9211 -8.9211 2.9939 2.9939 3.3500 3.3500 4.0076 4.0076 4.4779 4.4779 4.7508 4.7508 4.9235 4.9235 5.0011 5.0011 6.0651 6.0651 6.3685 6.3685 6.7313 6.7313 8.0796 8.0796 11.3571 11.3571 14.3927 14.3927 15.7131 15.7131 k = 0.1660-0.3227 0.2883 ( 6207 PWs) bands (ev): -76.6631 -76.6631 -45.4574 -45.4574 -41.1208 -41.1208 -40.7979 -40.7979 -35.1012 -35.1012 -35.0500 -35.0500 -9.3170 -9.3170 -8.9279 -8.9279 2.9569 2.9569 3.3931 3.3931 4.0283 4.0283 4.4862 4.4862 4.7057 4.7057 4.9045 4.9045 5.0225 5.0225 6.0362 6.0362 6.3540 6.3540 6.7420 6.7420 8.0646 8.0646 11.4515 11.4515 14.4506 14.4506 15.6112 15.6112 k = 0.1720-0.3342 0.2986 ( 6211 PWs) bands (ev): -76.6631 -76.6631 -45.4574 -45.4574 -41.1209 -41.1209 -40.7979 -40.7979 -35.0996 -35.0996 -35.0517 -35.0517 -9.3070 -9.3070 -8.9348 -8.9348 2.9166 2.9166 3.4348 3.4348 4.0540 4.0540 4.4954 4.4954 4.6654 4.6654 4.8861 4.8861 5.0448 5.0448 6.0061 6.0061 6.3392 6.3392 6.7519 6.7519 8.0469 8.0469 11.5429 11.5429 14.5046 14.5046 15.5137 15.5137 k = 0.1779-0.3457 0.3089 ( 6223 PWs) bands (ev): -76.6631 -76.6631 -45.4575 -45.4575 -41.1210 -41.1210 -40.7979 -40.7979 -35.0979 -35.0979 -35.0533 -35.0533 -9.2971 -9.2971 -8.9416 -8.9416 2.8745 2.8745 3.4742 3.4742 4.0832 4.0832 4.5055 4.5055 4.6312 4.6312 4.8684 4.8684 5.0675 5.0675 5.9748 5.9748 6.3242 6.3242 6.7609 6.7609 8.0266 8.0266 11.6306 11.6306 14.5544 14.5544 15.4212 15.4212 k = 0.1838-0.3573 0.3192 ( 6219 PWs) bands (ev): -76.6631 -76.6631 -45.4575 -45.4575 -41.1211 -41.1211 -40.7980 -40.7980 -35.0961 -35.0961 -35.0550 -35.0550 -9.2874 -9.2874 -8.9484 -8.9484 2.8315 2.8315 3.5102 3.5102 4.1147 4.1147 4.5163 4.5163 4.6046 4.6046 4.8517 4.8517 5.0906 5.0906 5.9427 5.9427 6.3091 6.3091 6.7690 6.7690 8.0036 8.0036 11.7140 11.7140 14.5996 14.5996 15.3342 15.3342 k = 0.1898-0.3688 0.3295 ( 6219 PWs) bands (ev): -76.6631 -76.6631 -45.4575 -45.4575 -41.1212 -41.1212 -40.7980 -40.7980 -35.0944 -35.0944 -35.0567 -35.0567 -9.2779 -9.2779 -8.9552 -8.9552 2.7883 2.7883 3.5418 3.5418 4.1470 4.1470 4.5267 4.5267 4.5881 4.5881 4.8359 4.8359 5.1139 5.1139 5.9098 5.9098 6.2940 6.2940 6.7761 6.7761 7.9781 7.9781 11.7927 11.7927 14.6399 14.6399 15.2533 15.2533 k = 0.1957-0.3803 0.3398 ( 6211 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1213 -41.1213 -40.7980 -40.7980 -35.0926 -35.0926 -35.0584 -35.0584 -9.2686 -9.2686 -8.9620 -8.9620 2.7458 2.7458 3.5677 3.5677 4.1791 4.1791 4.5349 4.5349 4.5852 4.5852 4.8212 4.8212 5.1372 5.1372 5.8762 5.8762 6.2791 6.2791 6.7823 6.7823 7.9501 7.9501 11.8660 11.8660 14.6751 14.6751 15.1791 15.1791 k = 0.2016-0.3918 0.3501 ( 6205 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1213 -41.1213 -40.7980 -40.7980 -35.0908 -35.0908 -35.0602 -35.0602 -9.2596 -9.2596 -8.9686 -8.9686 2.7043 2.7043 3.5870 3.5870 4.2099 4.2099 4.5419 4.5419 4.5959 4.5959 4.8078 4.8078 5.1604 5.1604 5.8423 5.8423 6.2645 6.2645 6.7873 6.7873 7.9197 7.9197 11.9332 11.9332 14.7048 14.7048 15.1123 15.1123 k = 0.2076-0.4034 0.3604 ( 6201 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1214 -41.1214 -40.7980 -40.7980 -35.0889 -35.0889 -35.0620 -35.0620 -9.2508 -9.2508 -8.9752 -8.9752 2.6643 2.6643 3.5991 3.5991 4.2386 4.2386 4.5530 4.5530 4.6154 4.6154 4.7959 4.7959 5.1834 5.1834 5.8083 5.8083 6.2504 6.2504 6.7913 6.7913 7.8868 7.8868 11.9937 11.9937 14.7288 14.7288 15.0537 15.0537 k = 0.2135-0.4149 0.3707 ( 6205 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1215 -41.1215 -40.7980 -40.7980 -35.0871 -35.0871 -35.0638 -35.0638 -9.2424 -9.2424 -8.9817 -8.9817 2.6261 2.6261 3.6039 3.6039 4.2645 4.2645 4.5717 4.5717 4.6398 4.6398 4.7860 4.7860 5.2062 5.2062 5.7745 5.7745 6.2367 6.2367 6.7941 6.7941 7.8517 7.8517 12.0469 12.0469 14.7470 14.7470 15.0040 15.0040 k = 0.2194-0.4264 0.3810 ( 6215 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1215 -41.1215 -40.7980 -40.7980 -35.0853 -35.0853 -35.0656 -35.0656 -9.2343 -9.2343 -8.9881 -8.9881 2.5901 2.5901 3.6017 3.6017 4.2871 4.2871 4.5992 4.5992 4.6662 4.6662 4.7796 4.7796 5.2285 5.2285 5.7413 5.7413 6.2237 6.2237 6.7958 6.7958 7.8143 7.8143 12.0922 12.0922 14.7593 14.7593 14.9639 14.9639 k = 0.2254-0.4379 0.3913 ( 6205 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0834 -35.0834 -35.0675 -35.0675 -9.2266 -9.2266 -8.9944 -8.9944 2.5565 2.5565 3.5934 3.5934 4.3063 4.3063 4.6350 4.6350 4.6904 4.6904 4.7796 4.7796 5.2502 5.2502 5.7091 5.7091 6.2115 6.2115 6.7964 6.7964 7.7748 7.7748 12.1290 12.1290 14.7659 14.7659 14.9336 14.9336 k = 0.2313-0.4495 0.4016 ( 6207 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0815 -35.0815 -35.0693 -35.0693 -9.2193 -9.2193 -9.0006 -9.0006 2.5254 2.5254 3.5798 3.5798 4.3223 4.3223 4.6766 4.6766 4.7078 4.7078 4.7912 4.7912 5.2712 5.2712 5.6786 5.6786 6.2003 6.2003 6.7959 6.7959 7.7333 7.7333 12.1571 12.1571 14.7675 14.7675 14.9129 14.9129 k = 0.2372-0.4610 0.4119 ( 6203 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0796 -35.0796 -35.0712 -35.0712 -9.2124 -9.2124 -9.0066 -9.0066 2.4970 2.4970 3.5622 3.5622 4.3355 4.3355 4.7034 4.7034 4.7353 4.7353 4.8156 4.8156 5.2913 5.2913 5.6506 5.6506 6.1901 6.1901 6.7943 6.7943 7.6899 7.6899 12.1762 12.1762 14.7652 14.7652 14.9009 14.9009 k = 0.2431-0.4725 0.4222 ( 6201 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0777 -35.0777 -35.0730 -35.0730 -9.2060 -9.2060 -9.0125 -9.0125 2.4715 2.4715 3.5415 3.5415 4.3461 4.3461 4.7044 4.7044 4.7859 4.7859 4.8483 4.8483 5.3104 5.3104 5.6259 5.6259 6.1813 6.1813 6.7915 6.7915 7.6448 7.6448 12.1863 12.1863 14.7597 14.7597 14.8973 14.8973 k = 0.2491-0.4840 0.4325 ( 6197 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0759 -35.0759 -35.0749 -35.0749 -9.2000 -9.2000 -9.0182 -9.0182 2.4489 2.4489 3.5187 3.5187 4.3548 4.3548 4.7008 4.7008 4.8357 4.8357 4.8890 4.8890 5.3283 5.3283 5.6058 5.6058 6.1738 6.1738 6.7877 6.7877 7.5981 7.5981 12.1876 12.1876 14.7506 14.7506 14.9024 14.9024 k = 0.2550-0.4956 0.4428 ( 6189 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0768 -35.0768 -35.0740 -35.0740 -9.1944 -9.1944 -9.0238 -9.0238 2.4294 2.4294 3.4945 3.4945 4.3617 4.3617 4.6961 4.6961 4.8735 4.8735 4.9431 4.9431 5.3449 5.3449 5.5914 5.5914 6.1678 6.1678 6.7828 6.7828 7.5500 7.5500 12.1805 12.1805 14.7370 14.7370 14.9169 14.9169 k = 0.2609-0.5071 0.4530 ( 6185 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0786 -35.0786 -35.0721 -35.0721 -9.1894 -9.1894 -9.0292 -9.0292 2.4129 2.4129 3.4695 3.4695 4.3673 4.3673 4.6914 4.6914 4.8980 4.8980 5.0081 5.0081 5.3599 5.3599 5.5841 5.5841 6.1636 6.1636 6.7768 6.7768 7.5007 7.5007 12.1658 12.1658 14.7181 14.7181 14.9412 14.9412 k = 0.2669-0.5186 0.4633 ( 6195 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0805 -35.0805 -35.0702 -35.0702 -9.1849 -9.1849 -9.0344 -9.0344 2.3996 2.3996 3.4442 3.4442 4.3718 4.3718 4.6869 4.6869 4.9124 4.9124 5.0786 5.0786 5.3733 5.3733 5.5849 5.5849 6.1611 6.1611 6.7698 6.7698 7.4504 7.4504 12.1440 12.1440 14.6937 14.6937 14.9750 14.9750 k = 0.2728-0.5301 0.4736 ( 6198 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0824 -35.0824 -35.0684 -35.0684 -9.1808 -9.1808 -9.0395 -9.0395 2.3895 2.3895 3.4191 3.4191 4.3753 4.3753 4.6827 4.6827 4.9175 4.9175 5.1519 5.1519 5.3850 5.3850 5.5942 5.5942 6.1606 6.1606 6.7618 6.7618 7.3994 7.3994 12.1160 12.1160 14.6641 14.6641 15.0177 15.0177 k = 0.2787-0.5417 0.4839 ( 6190 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0842 -35.0842 -35.0665 -35.0665 -9.1773 -9.1773 -9.0444 -9.0444 2.3826 2.3826 3.3944 3.3944 4.3780 4.3780 4.6791 4.6791 4.9141 4.9141 5.2266 5.2266 5.3950 5.3950 5.6119 5.6119 6.1620 6.1620 6.7528 6.7528 7.3480 7.3480 12.0828 12.0828 14.6296 14.6296 15.0683 15.0683 k = 0.2847-0.5532 0.4942 ( 6190 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1215 -41.1215 -40.7980 -40.7980 -35.0861 -35.0861 -35.0647 -35.0647 -9.1742 -9.1742 -9.0491 -9.0491 2.3790 2.3790 3.3704 3.3704 4.3800 4.3800 4.6759 4.6759 4.9032 4.9032 5.3012 5.3012 5.4037 5.4037 5.6372 5.6372 6.1654 6.1654 6.7428 6.7428 7.2966 7.2966 12.0451 12.0451 14.5904 14.5904 15.1260 15.1260 k = 0.2906-0.5647 0.5045 ( 6190 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1215 -41.1215 -40.7980 -40.7980 -35.0879 -35.0879 -35.0629 -35.0629 -9.1716 -9.1716 -9.0536 -9.0536 2.3786 2.3786 3.3473 3.3473 4.3814 4.3814 4.6731 4.6731 4.8860 4.8860 5.3713 5.3713 5.4143 5.4143 5.6692 5.6692 6.1708 6.1708 6.7320 6.7320 7.2456 7.2456 12.0039 12.0039 14.5469 14.5469 15.1901 15.1901 k = 0.2906-0.5647 0.5045 ( 6190 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1215 -41.1215 -40.7980 -40.7980 -35.0879 -35.0879 -35.0629 -35.0629 -9.1716 -9.1716 -9.0536 -9.0536 2.3786 2.3786 3.3473 3.3473 4.3814 4.3814 4.6731 4.6731 4.8860 4.8860 5.3713 5.3713 5.4143 5.4143 5.6692 5.6692 6.1708 6.1708 6.7320 6.7320 7.2456 7.2456 12.0039 12.0039 14.5469 14.5469 15.1901 15.1901 k = 0.3016-0.5538 0.5008 ( 6189 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1215 -41.1215 -40.7980 -40.7980 -35.0873 -35.0873 -35.0635 -35.0635 -9.1727 -9.1727 -9.0518 -9.0518 2.3792 2.3792 3.3548 3.3548 4.3810 4.3810 4.6741 4.6741 4.8919 4.8919 5.3468 5.3468 5.4093 5.4093 5.6575 5.6575 6.1687 6.1687 6.7361 6.7361 7.2649 7.2649 12.0192 12.0192 14.5593 14.5593 15.1704 15.1704 k = 0.3126-0.5429 0.4971 ( 6192 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1215 -41.1215 -40.7980 -40.7980 -35.0866 -35.0866 -35.0642 -35.0642 -9.1741 -9.1741 -9.0497 -9.0497 2.3818 2.3818 3.3613 3.3613 4.3805 4.3805 4.6753 4.6753 4.8950 4.8950 5.3202 5.3202 5.4051 5.4051 5.6474 5.6474 6.1670 6.1670 6.7404 6.7404 7.2861 7.2861 12.0343 12.0343 14.5630 14.5630 15.1604 15.1604 k = 0.3236-0.5319 0.4934 ( 6186 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1215 -41.1215 -40.7980 -40.7980 -35.0859 -35.0859 -35.0648 -35.0648 -9.1759 -9.1759 -9.0473 -9.0473 2.3861 2.3861 3.3666 3.3666 4.3799 4.3799 4.6767 4.6767 4.8954 4.8954 5.2934 5.2934 5.4008 5.4008 5.6385 5.6385 6.1657 6.1657 6.7447 6.7447 7.3086 7.3086 12.0492 12.0492 14.5575 14.5575 15.1605 15.1605 k = 0.3347-0.5210 0.4897 ( 6180 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1215 -41.1215 -40.7980 -40.7980 -35.0853 -35.0853 -35.0655 -35.0655 -9.1778 -9.1778 -9.0447 -9.0447 2.3922 2.3922 3.3707 3.3707 4.3792 4.3792 4.6783 4.6783 4.8927 4.8927 5.2678 5.2678 5.3964 5.3964 5.6306 5.6306 6.1646 6.1646 6.7491 6.7491 7.3321 7.3321 12.0638 12.0638 14.5435 14.5435 15.1702 15.1702 k = 0.3457-0.5101 0.4860 ( 6183 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0846 -35.0846 -35.0661 -35.0661 -9.1799 -9.1799 -9.0421 -9.0421 2.3999 2.3999 3.3734 3.3734 4.3785 4.3785 4.6799 4.6799 4.8871 4.8871 5.2442 5.2442 5.3916 5.3916 5.6236 5.6236 6.1637 6.1637 6.7535 6.7535 7.3562 7.3562 12.0780 12.0780 14.5224 14.5224 15.1879 15.1879 k = 0.3567-0.4992 0.4823 ( 6180 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0840 -35.0840 -35.0668 -35.0668 -9.1820 -9.1820 -9.0394 -9.0394 2.4088 2.4088 3.3749 3.3749 4.3778 4.3778 4.6816 4.6816 4.8787 4.8787 5.2232 5.2232 5.3867 5.3867 5.6173 5.6173 6.1630 6.1630 6.7578 6.7578 7.3804 7.3804 12.0919 12.0919 14.4962 14.4962 15.2117 15.2117 k = 0.3677-0.4883 0.4786 ( 6184 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0833 -35.0833 -35.0675 -35.0675 -9.1841 -9.1841 -9.0368 -9.0368 2.4189 2.4189 3.3751 3.3751 4.3769 4.3769 4.6832 4.6832 4.8678 4.8678 5.2053 5.2053 5.3816 5.3816 5.6116 5.6116 6.1625 6.1625 6.7621 6.7621 7.4043 7.4043 12.1052 12.1052 14.4668 14.4668 15.2397 15.2397 k = 0.3788-0.4773 0.4749 ( 6186 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0826 -35.0826 -35.0681 -35.0681 -9.1862 -9.1862 -9.0343 -9.0343 2.4300 2.4300 3.3740 3.3740 4.3760 4.3760 4.6847 4.6847 4.8550 4.8550 5.1903 5.1903 5.3764 5.3764 5.6064 5.6064 6.1621 6.1621 6.7662 6.7662 7.4277 7.4277 12.1179 12.1179 14.4357 14.4357 15.2701 15.2701 k = 0.3898-0.4664 0.4712 ( 6187 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0820 -35.0820 -35.0688 -35.0688 -9.1882 -9.1882 -9.0319 -9.0319 2.4417 2.4417 3.3719 3.3719 4.3750 4.3750 4.6860 4.6860 4.8410 4.8410 5.1782 5.1782 5.3713 5.3713 5.6017 5.6017 6.1618 6.1618 6.7702 6.7702 7.4501 7.4501 12.1299 12.1299 14.4042 14.4042 15.3017 15.3017 k = 0.4008-0.4555 0.4674 ( 6183 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0813 -35.0813 -35.0694 -35.0694 -9.1901 -9.1901 -9.0297 -9.0297 2.4538 2.4538 3.3687 3.3687 4.3740 4.3740 4.6871 4.6871 4.8265 4.8265 5.1685 5.1685 5.3663 5.3663 5.5975 5.5975 6.1616 6.1616 6.7739 6.7739 7.4713 7.4713 12.1412 12.1412 14.3734 14.3734 15.3332 15.3332 k = 0.4118-0.4446 0.4637 ( 6190 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0807 -35.0807 -35.0701 -35.0701 -9.1918 -9.1918 -9.0276 -9.0276 2.4659 2.4659 3.3647 3.3647 4.3730 4.3730 4.6878 4.6878 4.8123 4.8123 5.1609 5.1609 5.3616 5.3616 5.5936 5.5936 6.1614 6.1614 6.7773 6.7773 7.4911 7.4911 12.1515 12.1515 14.3442 14.3442 15.3638 15.3638 k = 0.4228-0.4336 0.4600 ( 6192 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0800 -35.0800 -35.0708 -35.0708 -9.1934 -9.1934 -9.0257 -9.0257 2.4778 2.4778 3.3602 3.3602 4.3719 4.3719 4.6881 4.6881 4.7991 4.7991 5.1550 5.1550 5.3572 5.3572 5.5902 5.5902 6.1613 6.1613 6.7805 6.7805 7.5091 7.5091 12.1610 12.1610 14.3170 14.3170 15.3926 15.3926 k = 0.4339-0.4227 0.4563 ( 6192 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0793 -35.0793 -35.0714 -35.0714 -9.1948 -9.1948 -9.0241 -9.0241 2.4891 2.4891 3.3553 3.3553 4.3709 4.3709 4.6878 4.6878 4.7875 4.7875 5.1504 5.1504 5.3532 5.3532 5.5873 5.5873 6.1612 6.1612 6.7833 6.7833 7.5252 7.5252 12.1693 12.1693 14.2926 14.2926 15.4189 15.4189 k = 0.4449-0.4118 0.4526 ( 6186 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0787 -35.0787 -35.0721 -35.0721 -9.1960 -9.1960 -9.0227 -9.0227 2.4995 2.4995 3.3504 3.3504 4.3700 4.3700 4.6870 4.6870 4.7776 4.7776 5.1469 5.1469 5.3497 5.3497 5.5847 5.5847 6.1612 6.1612 6.7857 6.7857 7.5392 7.5392 12.1765 12.1765 14.2713 14.2713 15.4423 15.4423 k = 0.4559-0.4009 0.4489 ( 6186 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0780 -35.0780 -35.0727 -35.0727 -9.1970 -9.1970 -9.0215 -9.0215 2.5086 2.5086 3.3459 3.3459 4.3691 4.3691 4.6859 4.6859 4.7699 4.7699 5.1443 5.1443 5.3467 5.3467 5.5827 5.5827 6.1611 6.1611 6.7878 6.7878 7.5508 7.5508 12.1826 12.1826 14.2534 14.2534 15.4621 15.4621 k = 0.4669-0.3900 0.4452 ( 6185 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0774 -35.0774 -35.0734 -35.0734 -9.1978 -9.1978 -9.0206 -9.0206 2.5160 2.5160 3.3420 3.3420 4.3684 4.3684 4.6846 4.6846 4.7641 4.7641 5.1424 5.1424 5.3444 5.3444 5.5810 5.5810 6.1611 6.1611 6.7894 6.7894 7.5600 7.5600 12.1873 12.1873 14.2392 14.2392 15.4779 15.4779 k = 0.4780-0.3790 0.4415 ( 6179 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0767 -35.0767 -35.0741 -35.0741 -9.1983 -9.1983 -9.0200 -9.0200 2.5216 2.5216 3.3389 3.3389 4.3679 4.3679 4.6833 4.6833 4.7603 4.7603 5.1412 5.1412 5.3426 5.3426 5.5799 5.5799 6.1611 6.1611 6.7905 6.7905 7.5666 7.5666 12.1907 12.1907 14.2289 14.2289 15.4895 15.4895 k = 0.4890-0.3681 0.4378 ( 6177 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0760 -35.0760 -35.0747 -35.0747 -9.1987 -9.1987 -9.0196 -9.0196 2.5250 2.5250 3.3370 3.3370 4.3676 4.3676 4.6824 4.6824 4.7580 4.7580 5.1404 5.1404 5.3416 5.3416 5.5792 5.5792 6.1611 6.1611 6.7912 6.7912 7.5707 7.5707 12.1928 12.1928 14.2227 14.2227 15.4965 15.4965 k = 0.5000-0.3572 0.4341 ( 6176 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0755 -35.0755 -35.0753 -35.0753 -9.1988 -9.1988 -9.0194 -9.0194 2.5262 2.5262 3.3364 3.3364 4.3675 4.3675 4.6821 4.6821 4.7573 4.7573 5.1402 5.1402 5.3412 5.3412 5.5789 5.5789 6.1611 6.1611 6.7915 6.7915 7.5720 7.5720 12.1935 12.1935 14.2206 14.2206 15.4989 15.4989 k = 0.5000-0.3572 0.4341 ( 6176 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7980 -40.7980 -35.0755 -35.0755 -35.0753 -35.0753 -9.1988 -9.1988 -9.0194 -9.0194 2.5262 2.5262 3.3364 3.3364 4.3675 4.3675 4.6821 4.6821 4.7573 4.7573 5.1402 5.1402 5.3412 5.3412 5.5789 5.5789 6.1611 6.1611 6.7915 6.7915 7.5720 7.5720 12.1935 12.1935 14.2206 14.2206 15.4989 15.4989 k = 0.4953-0.3480 0.4470 ( 6172 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1216 -41.1216 -40.7981 -40.7981 -35.0754 -35.0754 -35.0752 -35.0752 -9.1991 -9.1991 -9.0198 -9.0198 2.5269 2.5269 3.3367 3.3367 4.3684 4.3684 4.6803 4.6803 4.7563 4.7563 5.1428 5.1428 5.3422 5.3422 5.5792 5.5792 6.1602 6.1602 6.7913 6.7913 7.5721 7.5721 12.1934 12.1934 14.2221 14.2221 15.5005 15.5005 k = 0.4906-0.3389 0.4600 ( 6184 PWs) bands (ev): -76.6631 -76.6631 -45.4578 -45.4578 -41.1216 -41.1216 -40.7983 -40.7983 -35.0754 -35.0754 -35.0752 -35.0752 -9.1999 -9.1999 -9.0207 -9.0207 2.5291 2.5291 3.3379 3.3379 4.3713 4.3713 4.6748 4.6748 4.7534 4.7534 5.1505 5.1505 5.3451 5.3451 5.5798 5.5798 6.1577 6.1577 6.7907 6.7907 7.5723 7.5723 12.1932 12.1932 14.2264 14.2264 15.5053 15.5053 k = 0.4858-0.3297 0.4730 ( 6184 PWs) bands (ev): -76.6630 -76.6630 -45.4578 -45.4578 -41.1216 -41.1216 -40.7986 -40.7986 -35.0752 -35.0752 -35.0750 -35.0750 -9.2014 -9.2014 -9.0224 -9.0224 2.5328 2.5328 3.3397 3.3397 4.3758 4.3758 4.6655 4.6655 4.7498 4.7498 5.1625 5.1625 5.3498 5.3498 5.5810 5.5810 6.1536 6.1536 6.7898 6.7898 7.5726 7.5726 12.1928 12.1928 14.2337 14.2337 15.5134 15.5134 k = 0.4811-0.3205 0.4860 ( 6194 PWs) bands (ev): -76.6630 -76.6630 -45.4579 -45.4579 -41.1215 -41.1215 -40.7989 -40.7989 -35.0751 -35.0751 -35.0749 -35.0749 -9.2033 -9.2033 -9.0247 -9.0247 2.5380 2.5380 3.3423 3.3423 4.3819 4.3819 4.6525 4.6525 4.7463 4.7463 5.1780 5.1780 5.3562 5.3562 5.5826 5.5826 6.1479 6.1479 6.7885 6.7885 7.5730 7.5730 12.1923 12.1923 14.2438 14.2438 15.5246 15.5246 k = 0.4764-0.3114 0.4990 ( 6196 PWs) bands (ev): -76.6630 -76.6630 -45.4580 -45.4580 -41.1215 -41.1215 -40.7994 -40.7994 -35.0748 -35.0748 -35.0746 -35.0746 -9.2059 -9.2059 -9.0276 -9.0276 2.5446 2.5446 3.3457 3.3457 4.3891 4.3891 4.6364 4.6364 4.7439 4.7439 5.1961 5.1961 5.3642 5.3642 5.5847 5.5847 6.1405 6.1405 6.7870 6.7870 7.5736 7.5736 12.1916 12.1916 14.2567 14.2567 15.5390 15.5390 k = 0.4717-0.3022 0.5119 ( 6194 PWs) bands (ev): -76.6629 -76.6629 -45.4582 -45.4582 -41.1214 -41.1214 -40.8001 -40.8001 -35.0745 -35.0745 -35.0743 -35.0743 -9.2089 -9.2089 -9.0311 -9.0311 2.5527 2.5527 3.3497 3.3497 4.3968 4.3968 4.6179 4.6179 4.7433 4.7433 5.2158 5.2158 5.3735 5.3735 5.5873 5.5873 6.1316 6.1316 6.7853 6.7853 7.5742 7.5742 12.1907 12.1907 14.2724 14.2724 15.5565 15.5565 k = 0.4670-0.2930 0.5249 ( 6190 PWs) bands (ev): -76.6629 -76.6629 -45.4584 -45.4584 -41.1213 -41.1213 -40.8008 -40.8008 -35.0742 -35.0742 -35.0740 -35.0740 -9.2125 -9.2125 -9.0353 -9.0353 2.5621 2.5621 3.3545 3.3545 4.4045 4.4045 4.5979 4.5979 4.7451 4.7451 5.2366 5.2366 5.3840 5.3840 5.5905 5.5905 6.1212 6.1212 6.7835 6.7835 7.5750 7.5750 12.1895 12.1895 14.2908 14.2908 15.5771 15.5771 k = 0.4623-0.2839 0.5379 ( 6192 PWs) bands (ev): -76.6628 -76.6628 -45.4586 -45.4586 -41.1212 -41.1212 -40.8016 -40.8016 -35.0738 -35.0738 -35.0736 -35.0736 -9.2167 -9.2167 -9.0401 -9.0401 2.5729 2.5729 3.3601 3.3601 4.4111 4.4111 4.5775 4.5775 4.7498 4.7498 5.2577 5.2577 5.3954 5.3954 5.5941 5.5941 6.1094 6.1094 6.7816 6.7816 7.5758 7.5758 12.1882 12.1882 14.3119 14.3119 15.6008 15.6008 k = 0.4575-0.2747 0.5509 ( 6182 PWs) bands (ev): -76.6627 -76.6627 -45.4588 -45.4588 -41.1211 -41.1211 -40.8025 -40.8025 -35.0734 -35.0734 -35.0732 -35.0732 -9.2213 -9.2213 -9.0454 -9.0454 2.5851 2.5851 3.3663 3.3663 4.4154 4.4154 4.5577 4.5577 4.7582 4.7582 5.2786 5.2786 5.4075 5.4075 5.5984 5.5984 6.0963 6.0963 6.7798 6.7798 7.5767 7.5767 12.1865 12.1865 14.3356 14.3356 15.6275 15.6275 k = 0.4528-0.2655 0.5638 ( 6180 PWs) bands (ev): -76.6626 -76.6626 -45.4590 -45.4590 -41.1210 -41.1210 -40.8035 -40.8035 -35.0729 -35.0729 -35.0727 -35.0727 -9.2264 -9.2264 -9.0513 -9.0513 2.5985 2.5985 3.3732 3.3732 4.4163 4.4163 4.5397 4.5397 4.7709 4.7709 5.2990 5.2990 5.4201 5.4201 5.6033 5.6033 6.0818 6.0818 6.7781 6.7781 7.5776 7.5776 12.1845 12.1845 14.3618 14.3618 15.6572 15.6572 k = 0.4481-0.2564 0.5768 ( 6180 PWs) bands (ev): -76.6625 -76.6625 -45.4593 -45.4593 -41.1208 -41.1208 -40.8046 -40.8046 -35.0723 -35.0723 -35.0721 -35.0721 -9.2320 -9.2320 -9.0578 -9.0578 2.6132 2.6132 3.3808 3.3808 4.4123 4.4123 4.5245 4.5245 4.7884 4.7884 5.3184 5.3184 5.4330 5.4330 5.6088 5.6088 6.0662 6.0662 6.7767 6.7767 7.5786 7.5786 12.1822 12.1822 14.3904 14.3904 15.6897 15.6897 k = 0.4434-0.2472 0.5898 ( 6178 PWs) bands (ev): -76.6624 -76.6624 -45.4596 -45.4596 -41.1207 -41.1207 -40.8058 -40.8058 -35.0718 -35.0718 -35.0716 -35.0716 -9.2380 -9.2380 -9.0648 -9.0648 2.6291 2.6291 3.3891 3.3891 4.4032 4.4032 4.5127 4.5127 4.8108 4.8108 5.3367 5.3367 5.4459 5.4459 5.6149 5.6149 6.0496 6.0496 6.7756 6.7756 7.5795 7.5795 12.1794 12.1794 14.4213 14.4213 15.7251 15.7251 k = 0.4387-0.2380 0.6028 ( 6184 PWs) bands (ev): -76.6623 -76.6623 -45.4599 -45.4599 -41.1205 -41.1205 -40.8071 -40.8071 -35.0712 -35.0712 -35.0710 -35.0710 -9.2445 -9.2445 -9.0722 -9.0722 2.6461 2.6461 3.3980 3.3980 4.3894 4.3894 4.5037 4.5037 4.8384 4.8384 5.3535 5.3535 5.4586 5.4586 5.6218 5.6218 6.0319 6.0319 6.7749 6.7749 7.5804 7.5804 12.1762 12.1762 14.4544 14.4544 15.7633 15.7633 k = 0.4340-0.2289 0.6157 ( 6184 PWs) bands (ev): -76.6622 -76.6622 -45.4602 -45.4602 -41.1204 -41.1204 -40.8085 -40.8085 -35.0705 -35.0705 -35.0703 -35.0703 -9.2514 -9.2514 -9.0801 -9.0801 2.6643 2.6643 3.4076 3.4076 4.3724 4.3724 4.4967 4.4967 4.8707 4.8707 5.3688 5.3688 5.4710 5.4710 5.6293 5.6293 6.0135 6.0135 6.7748 6.7748 7.5812 7.5812 12.1724 12.1724 14.4896 14.4896 15.8041 15.8041 k = 0.4292-0.2197 0.6287 ( 6188 PWs) bands (ev): -76.6621 -76.6621 -45.4605 -45.4605 -41.1202 -41.1202 -40.8099 -40.8099 -35.0698 -35.0698 -35.0696 -35.0696 -9.2586 -9.2586 -9.0885 -9.0885 2.6834 2.6834 3.4177 3.4177 4.3535 4.3535 4.4907 4.4907 4.9075 4.9075 5.3824 5.3824 5.4827 5.4827 5.6376 5.6376 5.9945 5.9945 6.7752 6.7752 7.5820 7.5820 12.1681 12.1681 14.5268 14.5268 15.8476 15.8476 k = 0.4245-0.2105 0.6417 ( 6192 PWs) bands (ev): -76.6619 -76.6619 -45.4609 -45.4609 -41.1200 -41.1200 -40.8114 -40.8114 -35.0691 -35.0691 -35.0689 -35.0689 -9.2662 -9.2662 -9.0972 -9.0972 2.7036 2.7036 3.4285 3.4285 4.3337 4.3337 4.4851 4.4851 4.9483 4.9483 5.3943 5.3943 5.4937 5.4937 5.6465 5.6465 5.9751 5.9751 6.7763 6.7763 7.5827 7.5827 12.1631 12.1631 14.5659 14.5659 15.8937 15.8937 k = 0.4198-0.2014 0.6547 ( 6200 PWs) bands (ev): -76.6618 -76.6618 -45.4613 -45.4613 -41.1198 -41.1198 -40.8130 -40.8130 -35.0684 -35.0684 -35.0681 -35.0681 -9.2741 -9.2741 -9.1064 -9.1064 2.7247 2.7247 3.4398 3.4398 4.3137 4.3137 4.4798 4.4798 4.9925 4.9925 5.4045 5.4045 5.5038 5.5038 5.6561 5.6561 5.9555 5.9555 6.7781 6.7781 7.5833 7.5833 12.1574 12.1574 14.6067 14.6067 15.9422 15.9422 k = 0.4151-0.1922 0.6677 ( 6198 PWs) bands (ev): -76.6616 -76.6616 -45.4617 -45.4617 -41.1196 -41.1196 -40.8146 -40.8146 -35.0676 -35.0676 -35.0674 -35.0674 -9.2824 -9.2824 -9.1158 -9.1158 2.7467 2.7467 3.4516 3.4516 4.2940 4.2940 4.4745 4.4745 5.0394 5.0394 5.4132 5.4132 5.5128 5.5128 5.6663 5.6663 5.9361 5.9361 6.7805 6.7805 7.5837 7.5837 12.1510 12.1510 14.6491 14.6491 15.9931 15.9931 k = 0.4104-0.1830 0.6806 ( 6196 PWs) bands (ev): -76.6615 -76.6615 -45.4621 -45.4621 -41.1194 -41.1194 -40.8163 -40.8163 -35.0668 -35.0668 -35.0666 -35.0666 -9.2909 -9.2909 -9.1256 -9.1256 2.7695 2.7695 3.4640 3.4640 4.2748 4.2748 4.4694 4.4694 5.0884 5.0884 5.4205 5.4205 5.5208 5.5208 5.6769 5.6769 5.9173 5.9173 6.7838 6.7838 7.5839 7.5839 12.1436 12.1436 14.6931 14.6931 16.0462 16.0462 k = 0.4057-0.1739 0.6936 ( 6198 PWs) bands (ev): -76.6613 -76.6613 -45.4625 -45.4625 -41.1192 -41.1192 -40.8180 -40.8180 -35.0659 -35.0659 -35.0657 -35.0657 -9.2996 -9.2996 -9.1356 -9.1356 2.7930 2.7930 3.4767 3.4767 4.2564 4.2564 4.4645 4.4645 5.1384 5.1384 5.4268 5.4268 5.5276 5.5276 5.6877 5.6877 5.8996 5.8996 6.7876 6.7876 7.5840 7.5840 12.1353 12.1353 14.7384 14.7384 16.1016 16.1016 k = 0.4009-0.1647 0.7066 ( 6196 PWs) bands (ev): -76.6612 -76.6612 -45.4629 -45.4629 -41.1190 -41.1190 -40.8198 -40.8198 -35.0651 -35.0651 -35.0649 -35.0649 -9.3085 -9.3085 -9.1459 -9.1459 2.8172 2.8172 3.4899 3.4899 4.2389 4.2389 4.4598 4.4598 5.1878 5.1878 5.4329 5.4329 5.5331 5.5331 5.6987 5.6987 5.8840 5.8840 6.7922 6.7922 7.5839 7.5839 12.1260 12.1260 14.7850 14.7850 16.1589 16.1589 k = 0.3962-0.1555 0.7196 ( 6194 PWs) bands (ev): -76.6610 -76.6610 -45.4634 -45.4634 -41.1187 -41.1187 -40.8216 -40.8216 -35.0642 -35.0642 -35.0640 -35.0640 -9.3177 -9.3177 -9.1563 -9.1563 2.8420 2.8420 3.5035 3.5035 4.2225 4.2225 4.4555 4.4555 5.2346 5.2346 5.4401 5.4401 5.5374 5.5374 5.7094 5.7094 5.8717 5.8717 6.7974 6.7974 7.5835 7.5835 12.1155 12.1155 14.8327 14.8327 16.2182 16.2182 k = 0.3915-0.1464 0.7325 ( 6198 PWs) bands (ev): -76.6609 -76.6609 -45.4638 -45.4638 -41.1185 -41.1185 -40.8234 -40.8234 -35.0633 -35.0633 -35.0631 -35.0631 -9.3269 -9.3269 -9.1670 -9.1670 2.8673 2.8673 3.5174 3.5174 4.2072 4.2072 4.4515 4.4515 5.2751 5.2751 5.4505 5.4505 5.5402 5.5402 5.7194 5.7194 5.8644 5.8644 6.8031 6.8031 7.5829 7.5829 12.1038 12.1038 14.8814 14.8814 16.2793 16.2793 k = 0.3868-0.1372 0.7455 ( 6198 PWs) bands (ev): -76.6607 -76.6607 -45.4643 -45.4643 -41.1183 -41.1183 -40.8253 -40.8253 -35.0624 -35.0624 -35.0622 -35.0622 -9.3363 -9.3363 -9.1777 -9.1777 2.8931 2.8931 3.5315 3.5315 4.1931 4.1931 4.4480 4.4480 5.3052 5.3052 5.4666 5.4666 5.5415 5.5415 5.7280 5.7280 5.8644 5.8644 6.8093 6.8093 7.5821 7.5821 12.0909 12.0909 14.9309 14.9309 16.3420 16.3420 k = 0.3821-0.1280 0.7585 ( 6206 PWs) bands (ev): -76.6605 -76.6605 -45.4647 -45.4647 -41.1180 -41.1180 -40.8271 -40.8271 -35.0616 -35.0616 -35.0613 -35.0613 -9.3458 -9.3458 -9.1885 -9.1885 2.9192 2.9192 3.5457 3.5457 4.1803 4.1803 4.4449 4.4449 5.3223 5.3223 5.4884 5.4884 5.5415 5.5415 5.7350 5.7350 5.8744 5.8744 6.8159 6.8159 7.5810 7.5810 12.0765 12.0765 14.9813 14.9813 16.4062 16.4062 k = 0.3774-0.1189 0.7715 ( 6202 PWs) bands (ev): -76.6604 -76.6604 -45.4652 -45.4652 -41.1178 -41.1178 -40.8290 -40.8290 -35.0606 -35.0606 -35.0604 -35.0604 -9.3553 -9.3553 -9.1994 -9.1994 2.9456 2.9456 3.5601 3.5601 4.1689 4.1689 4.4423 4.4423 5.3280 5.3280 5.5100 5.5100 5.5423 5.5423 5.7407 5.7407 5.8962 5.8962 6.8229 6.8229 7.5798 7.5798 12.0607 12.0607 15.0322 15.0322 16.4717 16.4717 k = 0.3726-0.1097 0.7844 ( 6202 PWs) bands (ev): -76.6602 -76.6602 -45.4656 -45.4656 -41.1176 -41.1176 -40.8309 -40.8309 -35.0597 -35.0597 -35.0595 -35.0595 -9.3648 -9.3648 -9.2102 -9.2102 2.9723 2.9723 3.5745 3.5745 4.1590 4.1590 4.4402 4.4402 5.3255 5.3255 5.5184 5.5184 5.5522 5.5522 5.7460 5.7460 5.9305 5.9305 6.8300 6.8300 7.5783 7.5783 12.0432 12.0432 15.0837 15.0837 16.5382 16.5382 k = 0.3679-0.1005 0.7974 ( 6208 PWs) bands (ev): -76.6601 -76.6601 -45.4661 -45.4661 -41.1173 -41.1173 -40.8328 -40.8328 -35.0588 -35.0588 -35.0586 -35.0586 -9.3743 -9.3743 -9.2211 -9.2211 2.9990 2.9990 3.5888 3.5888 4.1506 4.1506 4.4386 4.4386 5.3175 5.3175 5.5132 5.5132 5.5686 5.5686 5.7516 5.7516 5.9765 5.9765 6.8374 6.8374 7.5766 7.5766 12.0242 12.0242 15.1356 15.1356 16.6055 16.6055 k = 0.3632-0.0914 0.8104 ( 6206 PWs) bands (ev): -76.6599 -76.6599 -45.4666 -45.4666 -41.1171 -41.1171 -40.8346 -40.8346 -35.0579 -35.0579 -35.0577 -35.0577 -9.3837 -9.3837 -9.2318 -9.2318 3.0258 3.0258 3.6029 3.6029 4.1438 4.1438 4.4375 4.4375 5.3056 5.3056 5.5029 5.5029 5.5832 5.5832 5.7575 5.7575 6.0326 6.0326 6.8449 6.8449 7.5747 7.5747 12.0035 12.0035 15.1877 15.1877 16.6734 16.6734 k = 0.3585-0.0822 0.8234 ( 6204 PWs) bands (ev): -76.6597 -76.6597 -45.4670 -45.4670 -41.1169 -41.1169 -40.8365 -40.8365 -35.0570 -35.0570 -35.0568 -35.0568 -9.3930 -9.3930 -9.2425 -9.2425 3.0526 3.0526 3.6167 3.6167 4.1387 4.1387 4.4369 4.4369 5.2906 5.2906 5.4901 5.4901 5.5948 5.5948 5.7636 5.7636 6.0966 6.0966 6.8524 6.8524 7.5726 7.5726 11.9809 11.9809 15.2401 15.2401 16.7415 16.7415 k = 0.3538-0.0730 0.8364 ( 6204 PWs) bands (ev): -76.6596 -76.6596 -45.4675 -45.4675 -41.1167 -41.1167 -40.8383 -40.8383 -35.0561 -35.0561 -35.0559 -35.0559 -9.4023 -9.4023 -9.2530 -9.2530 3.0792 3.0792 3.6301 3.6301 4.1354 4.1354 4.4367 4.4367 5.2731 5.2731 5.4756 5.4756 5.6041 5.6041 5.7695 5.7695 6.1666 6.1666 6.8599 6.8599 7.5705 7.5705 11.9566 11.9566 15.2926 15.2926 16.8094 16.8094 k = 0.3491-0.0639 0.8493 ( 6202 PWs) bands (ev): -76.6594 -76.6594 -45.4679 -45.4679 -41.1164 -41.1164 -40.8401 -40.8401 -35.0553 -35.0553 -35.0550 -35.0550 -9.4113 -9.4113 -9.2633 -9.2633 3.1056 3.1056 3.6430 3.6430 4.1338 4.1338 4.4370 4.4370 5.2535 5.2535 5.4601 5.4601 5.6117 5.6117 5.7750 5.7750 6.2408 6.2408 6.8675 6.8675 7.5682 7.5682 11.9305 11.9305 15.3450 15.3450 16.8768 16.8768 k = 0.3443-0.0547 0.8623 ( 6204 PWs) bands (ev): -76.6593 -76.6593 -45.4683 -45.4683 -41.1162 -41.1162 -40.8419 -40.8419 -35.0544 -35.0544 -35.0542 -35.0542 -9.4202 -9.4202 -9.2734 -9.2734 3.1316 3.1316 3.6553 3.6553 4.1341 4.1341 4.4377 4.4377 5.2322 5.2322 5.4442 5.4442 5.6183 5.6183 5.7799 5.7799 6.3179 6.3179 6.8752 6.8752 7.5660 7.5660 11.9026 11.9026 15.3974 15.3974 16.9430 16.9430 k = 0.3396-0.0455 0.8753 ( 6196 PWs) bands (ev): -76.6591 -76.6591 -45.4688 -45.4688 -41.1160 -41.1160 -40.8436 -40.8436 -35.0536 -35.0536 -35.0533 -35.0533 -9.4289 -9.4289 -9.2833 -9.2833 3.1572 3.1572 3.6668 3.6668 4.1363 4.1363 4.4388 4.4388 5.2094 5.2094 5.4281 5.4281 5.6241 5.6241 5.7841 5.7841 6.3967 6.3967 6.8830 6.8830 7.5638 7.5638 11.8729 11.8729 15.4495 15.4495 17.0068 17.0068 k = 0.3349-0.0364 0.8883 ( 6198 PWs) bands (ev): -76.6590 -76.6590 -45.4692 -45.4692 -41.1158 -41.1158 -40.8452 -40.8452 -35.0528 -35.0528 -35.0525 -35.0525 -9.4373 -9.4373 -9.2929 -9.2929 3.1823 3.1823 3.6775 3.6775 4.1405 4.1405 4.4403 4.4403 5.1852 5.1852 5.4122 5.4122 5.6295 5.6295 5.7876 5.7876 6.4760 6.4760 6.8912 6.8912 7.5618 7.5618 11.8415 11.8415 15.5012 15.5012 17.0589 17.0589 k = 0.3302-0.0272 0.9012 ( 6200 PWs) bands (ev): -76.6588 -76.6588 -45.4696 -45.4696 -41.1156 -41.1156 -40.8468 -40.8468 -35.0520 -35.0520 -35.0517 -35.0517 -9.4455 -9.4455 -9.3021 -9.3021 3.2068 3.2068 3.6873 3.6873 4.1465 4.1465 4.4421 4.4421 5.1600 5.1600 5.3966 5.3966 5.6346 5.6346 5.7905 5.7905 6.5547 6.5547 6.9003 6.9003 7.5600 7.5600 11.8084 11.8084 15.5525 15.5525 17.0118 17.0118 k = 0.3255-0.0180 0.9142 ( 6200 PWs) bands (ev): -76.6587 -76.6587 -45.4700 -45.4700 -41.1154 -41.1154 -40.8484 -40.8484 -35.0512 -35.0512 -35.0510 -35.0510 -9.4533 -9.4533 -9.3110 -9.3110 3.2305 3.2305 3.6963 3.6963 4.1544 4.1544 4.4442 4.4442 5.1340 5.1340 5.3815 5.3815 5.6393 5.6393 5.7926 5.7926 6.6311 6.6311 6.9109 6.9109 7.5586 7.5586 11.7739 11.7739 15.6032 15.6032 16.9366 16.9366 k = 0.3208-0.0089 0.9272 ( 6192 PWs) bands (ev): -76.6585 -76.6585 -45.4703 -45.4703 -41.1152 -41.1152 -40.8499 -40.8499 -35.0505 -35.0505 -35.0503 -35.0503 -9.4608 -9.4608 -9.3196 -9.3196 3.2534 3.2534 3.7043 3.7043 4.1641 4.1641 4.4465 4.4465 5.1073 5.1073 5.3669 5.3669 5.6439 5.6439 5.7941 5.7941 6.7028 6.7028 6.9248 6.9248 7.5577 7.5577 11.7382 11.7382 15.6531 15.6531 16.8630 16.8630 k = 0.3160 0.0003 0.9402 ( 6196 PWs) bands (ev): -76.6584 -76.6584 -45.4707 -45.4707 -41.1151 -41.1151 -40.8513 -40.8513 -35.0498 -35.0498 -35.0496 -35.0496 -9.4680 -9.4680 -9.3277 -9.3277 3.2754 3.2754 3.7114 3.7114 4.1754 4.1754 4.4491 4.4491 5.0801 5.0801 5.3531 5.3531 5.6483 5.6483 5.7950 5.7950 6.7660 6.7660 6.9453 6.9453 7.5576 7.5576 11.7014 11.7014 15.7022 15.7022 16.7927 16.7927 k = 0.3113 0.0095 0.9531 ( 6194 PWs) bands (ev): -76.6583 -76.6583 -45.4710 -45.4710 -41.1149 -41.1149 -40.8526 -40.8526 -35.0492 -35.0492 -35.0489 -35.0489 -9.4748 -9.4748 -9.3353 -9.3353 3.2964 3.2964 3.7176 3.7176 4.1882 4.1882 4.4519 4.4519 5.0527 5.0527 5.3399 5.3399 5.6525 5.6525 5.7953 5.7953 6.8148 6.8148 6.9771 6.9771 7.5585 7.5585 11.6639 11.6639 15.7502 15.7502 16.7262 16.7262 k = 0.3066 0.0186 0.9661 ( 6204 PWs) bands (ev): -76.6582 -76.6582 -45.4713 -45.4713 -41.1147 -41.1147 -40.8539 -40.8539 -35.0486 -35.0486 -35.0483 -35.0483 -9.4811 -9.4811 -9.3426 -9.3426 3.3162 3.3162 3.7230 3.7230 4.2024 4.2024 4.4548 4.4548 5.0251 5.0251 5.3276 5.3276 5.6566 5.6566 5.7952 5.7952 6.8467 6.8467 7.0221 7.0221 7.5607 7.5607 11.6260 11.6260 15.7969 15.7969 16.6641 16.6641 k = 0.3019 0.0278 0.9791 ( 6214 PWs) bands (ev): -76.6581 -76.6581 -45.4716 -45.4716 -41.1146 -41.1146 -40.8551 -40.8551 -35.0480 -35.0480 -35.0477 -35.0477 -9.4871 -9.4871 -9.3493 -9.3493 3.3349 3.3349 3.7277 3.7277 4.2177 4.2177 4.4578 4.4578 4.9978 4.9978 5.3161 5.3161 5.6605 5.6605 5.7945 5.7945 6.8657 6.8657 7.0752 7.0752 7.5645 7.5645 11.5881 11.5881 15.8420 15.8420 16.6064 16.6064 k = 0.2972 0.0370 0.9921 ( 6218 PWs) bands (ev): -76.6580 -76.6580 -45.4719 -45.4719 -41.1144 -41.1144 -40.8561 -40.8561 -35.0475 -35.0475 -35.0472 -35.0472 -9.4926 -9.4926 -9.3555 -9.3555 3.3522 3.3522 3.7316 3.7316 4.2338 4.2338 4.4608 4.4608 4.9707 4.9707 5.3054 5.3054 5.6642 5.6642 5.7935 5.7935 6.8775 6.8775 7.1299 7.1299 7.5706 7.5706 11.5508 11.5508 15.8854 15.8854 16.5535 16.5535 k = 0.2925 0.0461 1.0051 ( 6214 PWs) bands (ev): -76.6579 -76.6579 -45.4721 -45.4721 -41.1143 -41.1143 -40.8571 -40.8571 -35.0470 -35.0470 -35.0467 -35.0467 -9.4976 -9.4976 -9.3612 -9.3612 3.3681 3.3681 3.7350 3.7350 4.2504 4.2504 4.4639 4.4639 4.9442 4.9442 5.2957 5.2957 5.6678 5.6678 5.7922 5.7922 6.8854 6.8854 7.1815 7.1815 7.5793 7.5793 11.5144 11.5144 15.9266 15.9266 16.5055 16.5055 k = 0.2877 0.0553 1.0180 ( 6212 PWs) bands (ev): -76.6578 -76.6578 -45.4724 -45.4724 -41.1142 -41.1142 -40.8580 -40.8580 -35.0465 -35.0465 -35.0463 -35.0463 -9.5022 -9.5022 -9.3664 -9.3664 3.3826 3.3826 3.7378 3.7378 4.2673 4.2673 4.4671 4.4671 4.9185 4.9185 5.2868 5.2868 5.6711 5.6711 5.7907 5.7907 6.8911 6.8911 7.2276 7.2276 7.5910 7.5910 11.4796 11.4796 15.9653 15.9653 16.4625 16.4625 k = 0.2830 0.0645 1.0310 ( 6216 PWs) bands (ev): -76.6577 -76.6577 -45.4726 -45.4726 -41.1141 -41.1141 -40.8588 -40.8588 -35.0462 -35.0462 -35.0459 -35.0459 -9.5062 -9.5062 -9.3710 -9.3710 3.3955 3.3955 3.7401 3.7401 4.2839 4.2839 4.4702 4.4702 4.8940 4.8940 5.2790 5.2790 5.6742 5.6742 5.7891 5.7891 6.8953 6.8953 7.2665 7.2665 7.6057 7.6057 11.4470 11.4470 16.0011 16.0011 16.4245 16.4245 k = 0.2783 0.0736 1.0440 ( 6216 PWs) bands (ev): -76.6577 -76.6577 -45.4727 -45.4727 -41.1140 -41.1140 -40.8595 -40.8595 -35.0458 -35.0458 -35.0455 -35.0455 -9.5098 -9.5098 -9.3750 -9.3750 3.4069 3.4069 3.7421 3.7421 4.3000 4.3000 4.4732 4.4732 4.8710 4.8710 5.2722 5.2722 5.6770 5.6770 5.7874 5.7874 6.8985 6.8985 7.2978 7.2978 7.6231 7.6231 11.4171 11.4171 16.0335 16.0335 16.3916 16.3916 k = 0.2736 0.0828 1.0570 ( 6218 PWs) bands (ev): -76.6576 -76.6576 -45.4729 -45.4729 -41.1140 -41.1140 -40.8601 -40.8601 -35.0455 -35.0455 -35.0452 -35.0452 -9.5128 -9.5128 -9.3784 -9.3784 3.4166 3.4166 3.7436 3.7436 4.3150 4.3150 4.4761 4.4761 4.8499 4.8499 5.2663 5.2663 5.6795 5.6795 5.7858 5.7858 6.9010 6.9010 7.3217 7.3217 7.6419 7.6419 11.3905 11.3905 16.0620 16.0620 16.3638 16.3638 k = 0.2689 0.0920 1.0699 ( 6218 PWs) bands (ev): -76.6576 -76.6576 -45.4730 -45.4730 -41.1139 -41.1139 -40.8606 -40.8606 -35.0453 -35.0453 -35.0450 -35.0450 -9.5153 -9.5153 -9.3812 -9.3812 3.4245 3.4245 3.7448 3.7448 4.3283 4.3283 4.4789 4.4789 4.8313 4.8313 5.2616 5.2616 5.6817 5.6817 5.7843 5.7843 6.9028 6.9028 7.3391 7.3391 7.6604 7.6604 11.3678 11.3678 16.0862 16.0862 16.3411 16.3411 k = 0.2642 0.1011 1.0829 ( 6216 PWs) bands (ev): -76.6576 -76.6576 -45.4731 -45.4731 -41.1138 -41.1138 -40.8610 -40.8610 -35.0451 -35.0451 -35.0448 -35.0448 -9.5172 -9.5172 -9.3834 -9.3834 3.4308 3.4308 3.7457 3.7457 4.3395 4.3395 4.4814 4.4814 4.8159 4.8159 5.2578 5.2578 5.6834 5.6834 5.7830 5.7830 6.9042 6.9042 7.3512 7.3512 7.6770 7.6770 11.3496 11.3496 16.1056 16.1056 16.3236 16.3236 k = 0.2594 0.1103 1.0959 ( 6212 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8613 -40.8613 -35.0450 -35.0450 -35.0447 -35.0447 -9.5186 -9.5186 -9.3849 -9.3849 3.4352 3.4352 3.7464 3.7464 4.3479 4.3479 4.4834 4.4834 4.8041 4.8041 5.2552 5.2552 5.6847 5.6847 5.7820 5.7820 6.9052 6.9052 7.3590 7.3590 7.6900 7.6900 11.3362 11.3362 16.1197 16.1197 16.3111 16.3111 k = 0.2547 0.1195 1.1089 ( 6216 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8614 -40.8614 -35.0449 -35.0449 -35.0446 -35.0446 -9.5194 -9.5194 -9.3859 -9.3859 3.4379 3.4379 3.7468 3.7468 4.3532 4.3532 4.4847 4.4847 4.7967 4.7967 5.2536 5.2536 5.6855 5.6855 5.7814 5.7814 6.9057 6.9057 7.3633 7.3633 7.6984 7.6984 11.3281 11.3281 16.1283 16.1283 16.3036 16.3036 k = 0.2500 0.1286 1.1218 ( 6216 PWs) bands (ev): -76.6575 -76.6575 -45.4732 -45.4732 -41.1138 -41.1138 -40.8615 -40.8615 -35.0448 -35.0448 -35.0446 -35.0446 -9.5197 -9.5197 -9.3862 -9.3862 3.4388 3.4388 3.7469 3.7469 4.3550 4.3550 4.4853 4.4853 4.7941 4.7941 5.2531 5.2531 5.6857 5.6857 5.7812 5.7812 6.9059 6.9059 7.3645 7.3645 7.7014 7.7014 11.3253 11.3253 16.1312 16.1312 16.3012 16.3012 k = 0.0662-0.1286 1.1218 ( 6213 PWs) bands (ev): -76.6577 -76.6577 -45.4728 -45.4728 -41.1138 -41.1138 -40.8599 -40.8599 -35.0474 -35.0474 -35.0437 -35.0437 -9.5143 -9.5143 -9.3795 -9.3795 3.4233 3.4233 3.7546 3.7546 4.0668 4.0668 4.5956 4.5956 4.9519 4.9519 5.1407 5.1407 5.7718 5.7718 5.9568 5.9568 6.8199 6.8199 7.4400 7.4400 7.5172 7.5172 11.4385 11.4385 15.9397 15.9397 16.3476 16.3476 k = 0.0709-0.1377 1.1090 ( 6221 PWs) bands (ev): -76.6577 -76.6577 -45.4726 -45.4726 -41.1139 -41.1139 -40.8592 -40.8592 -35.0480 -35.0480 -35.0437 -35.0437 -9.5100 -9.5100 -9.3769 -9.3769 3.4075 3.4075 3.7437 3.7437 4.0495 4.0495 4.6230 4.6230 4.9784 4.9784 5.1393 5.1393 5.7666 5.7666 5.9616 5.9616 6.8183 6.8183 7.4173 7.4173 7.4760 7.4760 11.4810 11.4810 15.9355 15.9355 16.2980 16.2980 k = 0.0755-0.1468 1.0961 ( 6221 PWs) bands (ev): -76.6578 -76.6578 -45.4724 -45.4724 -41.1140 -41.1140 -40.8585 -40.8585 -35.0488 -35.0488 -35.0437 -35.0437 -9.5053 -9.5053 -9.3738 -9.3738 3.3896 3.3896 3.7343 3.7343 4.0316 4.0316 4.6509 4.6509 5.0031 5.0031 5.1400 5.1400 5.7612 5.7612 5.9663 5.9663 6.8161 6.8161 7.3756 7.3756 7.4490 7.4490 11.5247 11.5247 15.9354 15.9354 16.2469 16.2469 k = 0.0802-0.1559 1.0833 ( 6219 PWs) bands (ev): -76.6579 -76.6579 -45.4722 -45.4722 -41.1141 -41.1141 -40.8577 -40.8577 -35.0495 -35.0495 -35.0437 -35.0437 -9.5000 -9.5000 -9.3700 -9.3700 3.3696 3.3696 3.7265 3.7265 4.0132 4.0132 4.6793 4.6793 5.0251 5.0251 5.1437 5.1437 5.7556 5.7556 5.9708 5.9708 6.8130 6.8130 7.3181 7.3181 7.4338 7.4338 11.5690 11.5690 15.9390 15.9390 16.1949 16.1949 k = 0.0849-0.1650 1.0704 ( 6221 PWs) bands (ev): -76.6579 -76.6579 -45.4720 -45.4720 -41.1142 -41.1142 -40.8567 -40.8567 -35.0504 -35.0504 -35.0438 -35.0438 -9.4943 -9.4943 -9.3657 -9.3657 3.3475 3.3475 3.7204 3.7204 3.9943 3.9943 4.7077 4.7077 5.0430 5.0430 5.1518 5.1518 5.7498 5.7498 5.9751 5.9751 6.8088 6.8088 7.2533 7.2533 7.4229 7.4229 11.6132 11.6132 15.9459 15.9459 16.1424 16.1424 k = 0.0896-0.1741 1.0575 ( 6221 PWs) bands (ev): -76.6580 -76.6580 -45.4717 -45.4717 -41.1143 -41.1143 -40.8557 -40.8557 -35.0512 -35.0512 -35.0439 -35.0439 -9.4881 -9.4881 -9.3609 -9.3609 3.3236 3.3236 3.7162 3.7162 3.9750 3.9750 4.7361 4.7361 5.0560 5.0560 5.1653 5.1653 5.7439 5.7439 5.9791 5.9791 6.8030 6.8030 7.1846 7.1846 7.4136 7.4136 11.6567 11.6567 15.9551 15.9551 16.0901 16.0901 k = 0.0942-0.1832 1.0447 ( 6219 PWs) bands (ev): -76.6581 -76.6581 -45.4714 -45.4714 -41.1145 -41.1145 -40.8546 -40.8546 -35.0521 -35.0521 -35.0441 -35.0441 -9.4814 -9.4814 -9.3556 -9.3556 3.2980 3.2980 3.7136 3.7136 3.9553 3.9553 4.7642 4.7642 5.0644 5.0644 5.1838 5.1838 5.7378 5.7378 5.9826 5.9826 6.7949 6.7949 7.1143 7.1143 7.4054 7.4054 11.6990 11.6990 15.9643 15.9643 16.0401 16.0401 k = 0.0989-0.1922 1.0318 ( 6227 PWs) bands (ev): -76.6582 -76.6582 -45.4711 -45.4711 -41.1146 -41.1146 -40.8534 -40.8534 -35.0531 -35.0531 -35.0444 -35.0444 -9.4744 -9.4744 -9.3498 -9.3498 3.2710 3.2710 3.7127 3.7127 3.9354 3.9354 4.7918 4.7918 5.0694 5.0694 5.2061 5.2061 5.7315 5.7315 5.9857 5.9857 6.7831 6.7831 7.0445 7.0445 7.3978 7.3978 11.7397 11.7397 15.9592 15.9592 16.0061 16.0061 k = 0.1036-0.2013 1.0190 ( 6219 PWs) bands (ev): -76.6584 -76.6584 -45.4708 -45.4708 -41.1148 -41.1148 -40.8521 -40.8521 -35.0540 -35.0540 -35.0446 -35.0446 -9.4669 -9.4669 -9.3434 -9.3434 3.2428 3.2428 3.7132 3.7132 3.9153 3.9153 4.8187 4.8187 5.0726 5.0726 5.2309 5.2309 5.7249 5.7249 5.9882 5.9882 6.7646 6.7646 6.9789 6.9789 7.3908 7.3908 11.7785 11.7785 15.9184 15.9184 16.0088 16.0088 k = 0.1083-0.2104 1.0061 ( 6219 PWs) bands (ev): -76.6585 -76.6585 -45.4705 -45.4705 -41.1149 -41.1149 -40.8508 -40.8508 -35.0550 -35.0550 -35.0449 -35.0449 -9.4591 -9.4591 -9.3367 -9.3367 3.2136 3.2136 3.7152 3.7152 3.8952 3.8952 4.8448 4.8448 5.0749 5.0749 5.2573 5.2573 5.7181 5.7181 5.9901 5.9901 6.7346 6.7346 6.9231 6.9231 7.3842 7.3842 11.8149 11.8149 15.8677 15.8677 16.0218 16.0218 k = 0.1129-0.2195 0.9932 ( 6217 PWs) bands (ev): -76.6586 -76.6586 -45.4701 -45.4701 -41.1151 -41.1151 -40.8494 -40.8494 -35.0561 -35.0561 -35.0453 -35.0453 -9.4509 -9.4509 -9.3295 -9.3295 3.1836 3.1836 3.7183 3.7183 3.8751 3.8751 4.8697 4.8697 5.0772 5.0772 5.2845 5.2845 5.7109 5.7109 5.9912 5.9912 6.6885 6.6885 6.8821 6.8821 7.3780 7.3780 11.8488 11.8488 15.8157 15.8157 16.0355 16.0355 k = 0.1176-0.2286 0.9804 ( 6218 PWs) bands (ev): -76.6587 -76.6587 -45.4698 -45.4698 -41.1153 -41.1153 -40.8479 -40.8479 -35.0571 -35.0571 -35.0457 -35.0457 -9.4424 -9.4424 -9.3219 -9.3219 3.1530 3.1530 3.7223 3.7223 3.8553 3.8553 4.8932 4.8932 5.0798 5.0798 5.3123 5.3123 5.7032 5.7032 5.9915 5.9915 6.6276 6.6276 6.8552 6.8552 7.3722 7.3722 11.8801 11.8801 15.7634 15.7634 16.0478 16.0478 k = 0.1223-0.2377 0.9675 ( 6213 PWs) bands (ev): -76.6589 -76.6589 -45.4694 -45.4694 -41.1155 -41.1155 -40.8463 -40.8463 -35.0582 -35.0582 -35.0461 -35.0461 -9.4336 -9.4336 -9.3139 -9.3139 3.1219 3.1219 3.7269 3.7269 3.8363 3.8363 4.9151 4.9151 5.0832 5.0832 5.3403 5.3403 5.6949 5.6949 5.9910 5.9910 6.5578 6.5578 6.8372 6.8372 7.3667 7.3667 11.9087 11.9087 15.7114 15.7114 16.0573 16.0573 k = 0.1270-0.2467 0.9547 ( 6215 PWs) bands (ev): -76.6590 -76.6590 -45.4690 -45.4690 -41.1157 -41.1157 -40.8447 -40.8447 -35.0593 -35.0593 -35.0466 -35.0466 -9.4245 -9.4245 -9.3055 -9.3055 3.0904 3.0904 3.7312 3.7312 3.8188 3.8188 4.9350 4.9350 5.0877 5.0877 5.3683 5.3683 5.6859 5.6859 5.9895 5.9895 6.4839 6.4839 6.8239 6.8239 7.3615 7.3615 11.9345 11.9345 15.6598 15.6598 16.0632 16.0632 k = 0.1316-0.2558 0.9418 ( 6211 PWs) bands (ev): -76.6592 -76.6592 -45.4686 -45.4686 -41.1159 -41.1159 -40.8430 -40.8430 -35.0604 -35.0604 -35.0471 -35.0471 -9.4152 -9.4152 -9.2969 -9.2969 3.0588 3.0588 3.7335 3.7335 3.8046 3.8046 4.9526 4.9526 5.0936 5.0936 5.3962 5.3962 5.6759 5.6759 5.9869 5.9869 6.4091 6.4091 6.8130 6.8130 7.3565 7.3565 11.9575 11.9575 15.6086 15.6086 16.0646 16.0646 k = 0.1363-0.2649 0.9289 ( 6211 PWs) bands (ev): -76.6593 -76.6593 -45.4681 -45.4681 -41.1161 -41.1161 -40.8413 -40.8413 -35.0616 -35.0616 -35.0476 -35.0476 -9.4057 -9.4057 -9.2880 -9.2880 3.0272 3.0272 3.7308 3.7308 3.7966 3.7966 4.9678 4.9678 5.1009 5.1009 5.4237 5.4237 5.6646 5.6646 5.9832 5.9832 6.3353 6.3353 6.8033 6.8033 7.3518 7.3518 11.9779 11.9779 15.5580 15.5580 16.0609 16.0609 k = 0.1410-0.2740 0.9161 ( 6213 PWs) bands (ev): -76.6595 -76.6595 -45.4677 -45.4677 -41.1163 -41.1163 -40.8396 -40.8396 -35.0627 -35.0627 -35.0481 -35.0481 -9.3960 -9.3960 -9.2788 -9.2788 2.9956 2.9956 3.7212 3.7212 3.7968 3.7968 4.9807 4.9807 5.1095 5.1095 5.4506 5.4506 5.6517 5.6517 5.9782 5.9782 6.2642 6.2642 6.7943 6.7943 7.3472 7.3472 11.9957 11.9957 15.5080 15.5080 16.0521 16.0521 k = 0.1457-0.2831 0.9032 ( 6215 PWs) bands (ev): -76.6596 -76.6596 -45.4673 -45.4673 -41.1165 -41.1165 -40.8378 -40.8378 -35.0639 -35.0639 -35.0487 -35.0487 -9.3861 -9.3861 -9.2694 -9.2694 2.9641 2.9641 3.7065 3.7065 3.8035 3.8035 4.9913 4.9913 5.1192 5.1192 5.4762 5.4762 5.6369 5.6369 5.9717 5.9717 6.1974 6.1974 6.7856 6.7856 7.3427 7.3427 12.0109 12.0109 15.4586 15.4586 16.0380 16.0380 k = 0.1503-0.2922 0.8904 ( 6213 PWs) bands (ev): -76.6598 -76.6598 -45.4668 -45.4668 -41.1168 -41.1168 -40.8360 -40.8360 -35.0651 -35.0651 -35.0493 -35.0493 -9.3761 -9.3761 -9.2598 -9.2598 2.9328 2.9328 3.6893 3.6893 3.8142 3.8142 5.0002 5.0002 5.1294 5.1294 5.4996 5.4996 5.6202 5.6202 5.9632 5.9632 6.1366 6.1366 6.7772 6.7772 7.3384 7.3384 12.0239 12.0239 15.4099 15.4099 16.0188 16.0188 k = 0.1550-0.3013 0.8775 ( 6215 PWs) bands (ev): -76.6599 -76.6599 -45.4664 -45.4664 -41.1170 -41.1170 -40.8341 -40.8341 -35.0662 -35.0662 -35.0499 -35.0499 -9.3660 -9.3660 -9.2500 -9.2500 2.9018 2.9018 3.6709 3.6709 3.8274 3.8274 5.0076 5.0076 5.1396 5.1396 5.5179 5.5179 5.6035 5.6035 5.9524 5.9524 6.0839 6.0839 6.7689 6.7689 7.3341 7.3341 12.0346 12.0346 15.3619 15.3619 15.9951 15.9951 k = 0.1597-0.3103 0.8646 ( 6219 PWs) bands (ev): -76.6601 -76.6601 -45.4659 -45.4659 -41.1172 -41.1172 -40.8323 -40.8323 -35.0674 -35.0674 -35.0505 -35.0505 -9.3559 -9.3559 -9.2402 -9.2402 2.8712 2.8712 3.6522 3.6522 3.8424 3.8424 5.0140 5.0140 5.1490 5.1490 5.5224 5.5224 5.5945 5.5945 5.9386 5.9386 6.0411 6.0411 6.7609 6.7609 7.3300 7.3300 12.0434 12.0434 15.3147 15.3147 15.9673 15.9673 k = 0.1644-0.3194 0.8518 ( 6219 PWs) bands (ev): -76.6603 -76.6603 -45.4655 -45.4655 -41.1175 -41.1175 -40.8304 -40.8304 -35.0686 -35.0686 -35.0512 -35.0512 -9.3457 -9.3457 -9.2302 -9.2302 2.8411 2.8411 3.6334 3.6334 3.8590 3.8590 5.0197 5.0197 5.1572 5.1572 5.5048 5.5048 5.6008 5.6008 5.9222 5.9222 6.0089 6.0089 6.7531 6.7531 7.3258 7.3258 12.0503 12.0503 15.2683 15.2683 15.9360 15.9360 k = 0.1690-0.3285 0.8389 ( 6213 PWs) bands (ev): -76.6604 -76.6604 -45.4650 -45.4650 -41.1177 -41.1177 -40.8286 -40.8286 -35.0698 -35.0698 -35.0518 -35.0518 -9.3356 -9.3356 -9.2202 -9.2202 2.8115 2.8115 3.6147 3.6147 3.8769 3.8769 5.0247 5.0247 5.1633 5.1633 5.4727 5.4727 5.6150 5.6150 5.9055 5.9055 5.9855 5.9855 6.7456 6.7456 7.3217 7.3217 12.0555 12.0555 15.2227 15.2227 15.9019 15.9019 k = 0.1737-0.3376 0.8260 ( 6221 PWs) bands (ev): -76.6606 -76.6606 -45.4646 -45.4646 -41.1179 -41.1179 -40.8267 -40.8267 -35.0709 -35.0709 -35.0524 -35.0524 -9.3254 -9.3254 -9.2102 -9.2102 2.7824 2.7824 3.5963 3.5963 3.8961 3.8961 5.0291 5.0291 5.1667 5.1667 5.4343 5.4343 5.6297 5.6297 5.8915 5.8915 5.9679 5.9679 6.7385 6.7385 7.3177 7.3177 12.0591 12.0591 15.1781 15.1781 15.8654 15.8654 k = 0.1784-0.3467 0.8132 ( 6221 PWs) bands (ev): -76.6608 -76.6608 -45.4641 -45.4641 -41.1182 -41.1182 -40.8249 -40.8249 -35.0720 -35.0720 -35.0531 -35.0531 -9.3154 -9.3154 -9.2003 -9.2003 2.7540 2.7540 3.5783 3.5783 3.9165 3.9165 5.0327 5.0327 5.1663 5.1663 5.3940 5.3940 5.6423 5.6423 5.8822 5.8822 5.9536 5.9536 6.7318 6.7318 7.3136 7.3136 12.0614 12.0614 15.1344 15.1344 15.8271 15.8271 k = 0.1831-0.3558 0.8003 ( 6217 PWs) bands (ev): -76.6609 -76.6609 -45.4637 -45.4637 -41.1184 -41.1184 -40.8230 -40.8230 -35.0732 -35.0732 -35.0537 -35.0537 -9.3055 -9.3055 -9.1904 -9.1904 2.7262 2.7262 3.5608 3.5608 3.9381 3.9381 5.0350 5.0350 5.1610 5.1610 5.3556 5.3556 5.6515 5.6515 5.8777 5.8777 5.9416 5.9416 6.7258 6.7258 7.3096 7.3096 12.0625 12.0625 15.0918 15.0918 15.7877 15.7877 k = 0.1877-0.3648 0.7875 ( 6207 PWs) bands (ev): -76.6611 -76.6611 -45.4632 -45.4632 -41.1186 -41.1186 -40.8212 -40.8212 -35.0743 -35.0743 -35.0544 -35.0544 -9.2957 -9.2957 -9.1806 -9.1806 2.6992 2.6992 3.5437 3.5437 3.9608 3.9608 5.0344 5.0344 5.1501 5.1501 5.3226 5.3226 5.6568 5.6568 5.8767 5.8767 5.9323 5.9323 6.7203 6.7203 7.3055 7.3055 12.0626 12.0626 15.0502 15.0502 15.7475 15.7475 k = 0.1924-0.3739 0.7746 ( 6209 PWs) bands (ev): -76.6612 -76.6612 -45.4628 -45.4628 -41.1188 -41.1188 -40.8194 -40.8194 -35.0753 -35.0753 -35.0550 -35.0550 -9.2861 -9.2861 -9.1709 -9.1709 2.6730 2.6730 3.5271 3.5271 3.9845 3.9845 5.0280 5.0280 5.1357 5.1357 5.2971 5.2971 5.6584 5.6584 5.8757 5.8757 5.9280 5.9280 6.7156 6.7156 7.3015 7.3015 12.0617 12.0617 15.0098 15.0098 15.7069 15.7069 k = 0.1971-0.3830 0.7617 ( 6199 PWs) bands (ev): -76.6614 -76.6614 -45.4624 -45.4624 -41.1190 -41.1190 -40.8177 -40.8177 -35.0764 -35.0764 -35.0556 -35.0556 -9.2767 -9.2767 -9.1614 -9.1614 2.6476 2.6476 3.5112 3.5112 4.0092 4.0092 5.0117 5.0117 5.1231 5.1231 5.2786 5.2786 5.6568 5.6568 5.8710 5.8710 5.9311 5.9311 6.7116 6.7116 7.2975 7.2975 12.0600 12.0600 14.9706 14.9706 15.6664 15.6664 k = 0.2018-0.3921 0.7489 ( 6199 PWs) bands (ev): -76.6615 -76.6615 -45.4619 -45.4619 -41.1193 -41.1193 -40.8160 -40.8160 -35.0774 -35.0774 -35.0562 -35.0562 -9.2675 -9.2675 -9.1521 -9.1521 2.6232 2.6232 3.4959 3.4959 4.0349 4.0349 4.9838 4.9838 5.1170 5.1170 5.2649 5.2649 5.6526 5.6526 5.8618 5.8618 5.9412 5.9412 6.7084 6.7084 7.2935 7.2935 12.0577 12.0577 14.9327 14.9327 15.6263 15.6263 k = 0.2064-0.4012 0.7360 ( 6200 PWs) bands (ev): -76.6617 -76.6617 -45.4615 -45.4615 -41.1195 -41.1195 -40.8143 -40.8143 -35.0784 -35.0784 -35.0568 -35.0568 -9.2586 -9.2586 -9.1431 -9.1431 2.5996 2.5996 3.4812 3.4812 4.0614 4.0614 4.9475 4.9475 5.1167 5.1167 5.2538 5.2538 5.6464 5.6464 5.8500 5.8500 5.9556 5.9556 6.7061 6.7061 7.2895 7.2895 12.0549 12.0549 14.8961 14.8961 15.5868 15.5868 k = 0.2111-0.4103 0.7232 ( 6198 PWs) bands (ev): -76.6618 -76.6618 -45.4612 -45.4612 -41.1197 -41.1197 -40.8127 -40.8127 -35.0794 -35.0794 -35.0574 -35.0574 -9.2500 -9.2500 -9.1343 -9.1343 2.5770 2.5770 3.4671 3.4671 4.0887 4.0887 4.9072 4.9072 5.1199 5.1199 5.2439 5.2439 5.6385 5.6385 5.8366 5.8366 5.9722 5.9722 6.7046 6.7046 7.2856 7.2856 12.0516 12.0516 14.8610 14.8610 15.5483 15.5483 k = 0.2158-0.4194 0.7103 ( 6200 PWs) bands (ev): -76.6620 -76.6620 -45.4608 -45.4608 -41.1198 -41.1198 -40.8112 -40.8112 -35.0803 -35.0803 -35.0580 -35.0580 -9.2417 -9.2417 -9.1259 -9.1259 2.5555 2.5555 3.4538 3.4538 4.1167 4.1167 4.8657 4.8657 5.1247 5.1247 5.2344 5.2344 5.6294 5.6294 5.8225 5.8225 5.9899 5.9899 6.7039 6.7039 7.2817 7.2817 12.0480 12.0480 14.8273 14.8273 15.5109 15.5109 k = 0.2205-0.4284 0.6974 ( 6206 PWs) bands (ev): -76.6621 -76.6621 -45.4604 -45.4604 -41.1200 -41.1200 -40.8097 -40.8097 -35.0812 -35.0812 -35.0585 -35.0585 -9.2337 -9.2337 -9.1177 -9.1177 2.5350 2.5350 3.4412 3.4412 4.1453 4.1453 4.8247 4.8247 5.1294 5.1294 5.2255 5.2255 5.6193 5.6193 5.8080 5.8080 6.0081 6.0081 6.7039 6.7039 7.2780 7.2780 12.0442 12.0442 14.7952 14.7952 15.4749 15.4749 k = 0.2251-0.4375 0.6846 ( 6198 PWs) bands (ev): -76.6622 -76.6622 -45.4601 -45.4601 -41.1202 -41.1202 -40.8083 -40.8083 -35.0820 -35.0820 -35.0591 -35.0591 -9.2262 -9.2262 -9.1100 -9.1100 2.5156 2.5156 3.4293 3.4293 4.1743 4.1743 4.7853 4.7853 5.1323 5.1323 5.2182 5.2182 5.6084 5.6084 5.7934 5.7934 6.0262 6.0262 6.7047 6.7047 7.2743 7.2743 12.0402 12.0402 14.7647 14.7647 15.4405 15.4405 k = 0.2298-0.4466 0.6717 ( 6194 PWs) bands (ev): -76.6623 -76.6623 -45.4598 -45.4598 -41.1204 -41.1204 -40.8069 -40.8069 -35.0828 -35.0828 -35.0595 -35.0595 -9.2190 -9.2190 -9.1027 -9.1027 2.4973 2.4973 3.4182 3.4182 4.2034 4.2034 4.7483 4.7483 5.1313 5.1313 5.2143 5.2143 5.5968 5.5968 5.7788 5.7788 6.0440 6.0440 6.7060 6.7060 7.2708 7.2708 12.0362 12.0362 14.7360 14.7360 15.4078 15.4078 k = 0.2345-0.4557 0.6589 ( 6190 PWs) bands (ev): -76.6624 -76.6624 -45.4595 -45.4595 -41.1205 -41.1205 -40.8057 -40.8057 -35.0835 -35.0835 -35.0600 -35.0600 -9.2123 -9.2123 -9.0957 -9.0957 2.4803 2.4803 3.4078 3.4078 4.2323 4.2323 4.7143 4.7143 5.1244 5.1244 5.2153 5.2153 5.5845 5.5845 5.7644 5.7644 6.0610 6.0610 6.7079 6.7079 7.2674 7.2674 12.0322 12.0322 14.7090 14.7090 15.3770 15.3770 k = 0.2392-0.4648 0.6460 ( 6181 PWs) bands (ev): -76.6625 -76.6625 -45.4592 -45.4592 -41.1207 -41.1207 -40.8045 -40.8045 -35.0842 -35.0842 -35.0604 -35.0604 -9.2060 -9.2060 -9.0893 -9.0893 2.4644 2.4644 3.3983 3.3983 4.2607 4.2607 4.6838 4.6838 5.1118 5.1118 5.2211 5.2211 5.5717 5.5717 5.7505 5.7505 6.0773 6.0773 6.7102 6.7102 7.2642 7.2642 12.0283 12.0283 14.6839 14.6839 15.3483 15.3483 k = 0.2438-0.4739 0.6331 ( 6188 PWs) bands (ev): -76.6626 -76.6626 -45.4589 -45.4589 -41.1208 -41.1208 -40.8034 -40.8034 -35.0848 -35.0848 -35.0609 -35.0609 -9.2002 -9.2002 -9.0833 -9.0833 2.4498 2.4498 3.3895 3.3895 4.2880 4.2880 4.6576 4.6576 5.0945 5.0945 5.2306 5.2306 5.5583 5.5583 5.7373 5.7373 6.0926 6.0926 6.7127 6.7127 7.2612 7.2612 12.0245 12.0245 14.6608 14.6608 15.3216 15.3216 k = 0.2485-0.4829 0.6203 ( 6200 PWs) bands (ev): -76.6627 -76.6627 -45.4587 -45.4587 -41.1209 -41.1209 -40.8024 -40.8024 -35.0854 -35.0854 -35.0612 -35.0612 -9.1949 -9.1949 -9.0778 -9.0778 2.4365 2.4365 3.3815 3.3815 4.3133 4.3133 4.6363 4.6363 5.0740 5.0740 5.2424 5.2424 5.5444 5.5444 5.7249 5.7249 6.1068 6.1068 6.7155 6.7155 7.2584 7.2584 12.0209 12.0209 14.6396 14.6396 15.2972 15.2972 k = 0.2532-0.4920 0.6074 ( 6202 PWs) bands (ev): -76.6628 -76.6628 -45.4585 -45.4585 -41.1210 -41.1210 -40.8015 -40.8015 -35.0859 -35.0859 -35.0616 -35.0616 -9.1901 -9.1901 -9.0728 -9.0728 2.4245 2.4245 3.3744 3.3744 4.3358 4.3358 4.6209 4.6209 5.0510 5.0510 5.2559 5.2559 5.5299 5.5299 5.7135 5.7135 6.1198 6.1198 6.7183 6.7183 7.2558 7.2558 12.0176 12.0176 14.6205 14.6205 15.2751 15.2751 k = 0.2579-0.5011 0.5946 ( 6198 PWs) bands (ev): -76.6629 -76.6629 -45.4583 -45.4583 -41.1211 -41.1211 -40.8007 -40.8007 -35.0864 -35.0864 -35.0619 -35.0619 -9.1859 -9.1859 -9.0684 -9.0684 2.4139 2.4139 3.3680 3.3680 4.3542 4.3542 4.6123 4.6123 5.0264 5.0264 5.2705 5.2705 5.5148 5.5148 5.7033 5.7033 6.1314 6.1314 6.7210 6.7210 7.2535 7.2535 12.0145 12.0145 14.6034 14.6034 15.2555 15.2555 k = 0.2625-0.5102 0.5817 ( 6190 PWs) bands (ev): -76.6629 -76.6629 -45.4581 -45.4581 -41.1212 -41.1212 -40.8000 -40.8000 -35.0868 -35.0868 -35.0621 -35.0621 -9.1821 -9.1821 -9.0645 -9.0645 2.4046 2.4046 3.3625 3.3625 4.3677 4.3677 4.6111 4.6111 5.0007 5.0007 5.2860 5.2860 5.4992 5.4992 5.6943 5.6943 6.1417 6.1417 6.7236 6.7236 7.2515 7.2515 12.0118 12.0118 14.5886 14.5886 15.2383 15.2383 k = 0.2672-0.5193 0.5688 ( 6186 PWs) bands (ev): -76.6630 -76.6630 -45.4580 -45.4580 -41.1213 -41.1213 -40.7994 -40.7994 -35.0871 -35.0871 -35.0624 -35.0624 -9.1789 -9.1789 -9.0612 -9.0612 2.3967 2.3967 3.3579 3.3579 4.3762 4.3762 4.6171 4.6171 4.9747 4.9747 5.3021 5.3021 5.4832 5.4832 5.6866 5.6866 6.1504 6.1504 6.7260 6.7260 7.2497 7.2497 12.0094 12.0094 14.5759 14.5759 15.2237 15.2237 k = 0.2719-0.5284 0.5560 ( 6188 PWs) bands (ev): -76.6630 -76.6630 -45.4579 -45.4579 -41.1214 -41.1214 -40.7989 -40.7989 -35.0874 -35.0874 -35.0625 -35.0625 -9.1763 -9.1763 -9.0585 -9.0585 2.3902 2.3902 3.3541 3.3541 4.3805 4.3805 4.6286 4.6286 4.9492 4.9492 5.3185 5.3185 5.4669 5.4669 5.6803 5.6803 6.1577 6.1577 6.7280 6.7280 7.2483 7.2483 12.0075 12.0075 14.5655 14.5655 15.2116 15.2116 k = 0.2766-0.5375 0.5431 ( 6189 PWs) bands (ev): -76.6631 -76.6631 -45.4578 -45.4578 -41.1214 -41.1214 -40.7985 -40.7985 -35.0876 -35.0876 -35.0627 -35.0627 -9.1743 -9.1743 -9.0563 -9.0563 2.3851 2.3851 3.3511 3.3511 4.3820 4.3820 4.6432 4.6432 4.9254 4.9254 5.3350 5.3350 5.4504 5.4504 5.6755 5.6755 6.1634 6.1634 6.7297 6.7297 7.2471 7.2471 12.0059 12.0059 14.5574 14.5574 15.2022 15.2022 k = 0.2812-0.5465 0.5303 ( 6190 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1214 -41.1214 -40.7982 -40.7982 -35.0878 -35.0878 -35.0628 -35.0628 -9.1728 -9.1728 -9.0548 -9.0548 2.3815 2.3815 3.3490 3.3490 4.3820 4.3820 4.6578 4.6578 4.9052 4.9052 5.3510 5.3510 5.4345 5.4345 5.6720 5.6720 6.1675 6.1675 6.7309 6.7309 7.2463 7.2463 12.0048 12.0048 14.5515 14.5515 15.1955 15.1955 k = 0.2859-0.5556 0.5174 ( 6192 PWs) bands (ev): -76.6631 -76.6631 -45.4577 -45.4577 -41.1215 -41.1215 -40.7981 -40.7981 -35.0879 -35.0879 -35.0629 -35.0629 -9.1719 -9.1719 -9.0539 -9.0539 2.3793 2.3793 3.3477 3.3477 4.3816 4.3816 4.6689 4.6689 4.8911 4.8911 5.3648 5.3648 5.4207 5.4207 5.6699 5.6699 6.1700 6.1700 6.7317 6.7317 7.2458 7.2458 12.0041 12.0041 14.5480 14.5480 15.1914 15.1914 k = 0.2906-0.5647 0.5045 ( 6190 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1215 -41.1215 -40.7980 -40.7980 -35.0879 -35.0879 -35.0629 -35.0629 -9.1716 -9.1716 -9.0536 -9.0536 2.3786 2.3786 3.3473 3.3473 4.3814 4.3814 4.6731 4.6731 4.8860 4.8860 5.3713 5.3713 5.4143 5.4143 5.6692 5.6692 6.1708 6.1708 6.7320 6.7320 7.2456 7.2456 12.0039 12.0039 14.5469 14.5469 15.1901 15.1901 k = 0.7094-0.1497 0.3636 ( 6190 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1215 -41.1215 -40.7980 -40.7980 -35.0879 -35.0879 -35.0629 -35.0629 -9.1716 -9.1716 -9.0536 -9.0536 2.3786 2.3786 3.3473 3.3473 4.3814 4.3814 4.6731 4.6731 4.8860 4.8860 5.3713 5.3713 5.4143 5.4143 5.6692 5.6692 6.1708 6.1708 6.7320 6.7320 7.2456 7.2456 12.0039 12.0039 14.5469 14.5469 15.1901 15.1901 k = 0.7036-0.1384 0.3535 ( 6186 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1214 -41.1214 -40.7980 -40.7980 -35.0897 -35.0897 -35.0611 -35.0611 -9.1696 -9.1696 -9.0578 -9.0578 2.3814 2.3814 3.3256 3.3256 4.3823 4.3823 4.6706 4.6706 4.8645 4.8645 5.4044 5.4044 5.4567 5.4567 5.7061 5.7061 6.1779 6.1779 6.7204 6.7204 7.1965 7.1965 11.9608 11.9608 14.5001 14.5001 15.2585 15.2585 k = 0.6978-0.1271 0.3434 ( 6188 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1214 -41.1214 -40.7980 -40.7980 -35.0914 -35.0914 -35.0594 -35.0594 -9.1680 -9.1680 -9.0619 -9.0619 2.3872 2.3872 3.3051 3.3051 4.3826 4.3826 4.6682 4.6682 4.8398 4.8398 5.4096 5.4096 5.5220 5.5220 5.7477 5.7477 6.1867 6.1867 6.7080 6.7080 7.1490 7.1490 11.9158 11.9158 14.4495 14.4495 15.3318 15.3318 k = 0.6920-0.1158 0.3333 ( 6178 PWs) bands (ev): -76.6631 -76.6631 -45.4576 -45.4576 -41.1213 -41.1213 -40.7980 -40.7980 -35.0932 -35.0932 -35.0576 -35.0576 -9.1669 -9.1669 -9.0658 -9.0658 2.3962 2.3962 3.2858 3.2858 4.3824 4.3824 4.6655 4.6655 4.8131 4.8131 5.4107 5.4107 5.5852 5.5852 5.7936 5.7936 6.1971 6.1971 6.6948 6.6948 7.1039 7.1039 11.8696 11.8696 14.3953 14.3953 15.4096 15.4096 k = 0.6861-0.1045 0.3232 ( 6174 PWs) bands (ev): -76.6631 -76.6631 -45.4575 -45.4575 -41.1212 -41.1212 -40.7980 -40.7980 -35.0949 -35.0949 -35.0560 -35.0560 -9.1662 -9.1662 -9.0695 -9.0695 2.4082 2.4082 3.2678 3.2678 4.3818 4.3818 4.6619 4.6619 4.7861 4.7861 5.4098 5.4098 5.6431 5.6431 5.8428 5.8428 6.2088 6.2088 6.6808 6.6808 7.0623 7.0623 11.8227 11.8227 14.3377 14.3377 15.4914 15.4914 k = 0.6803-0.0932 0.3131 ( 6172 PWs) bands (ev): -76.6631 -76.6631 -45.4575 -45.4575 -41.1211 -41.1211 -40.7980 -40.7980 -35.0966 -35.0966 -35.0543 -35.0543 -9.1659 -9.1659 -9.0730 -9.0730 2.4231 2.4231 3.2511 3.2511 4.3806 4.3806 4.6561 4.6561 4.7606 4.7606 5.4073 5.4073 5.6945 5.6945 5.8940 5.8940 6.2218 6.2218 6.6662 6.6662 7.0254 7.0254 11.7758 11.7758 14.2768 14.2768 15.5769 15.5769 k = 0.6745-0.0819 0.3030 ( 6172 PWs) bands (ev): -76.6631 -76.6631 -45.4575 -45.4575 -41.1210 -41.1210 -40.7980 -40.7980 -35.0982 -35.0982 -35.0527 -35.0527 -9.1661 -9.1661 -9.0764 -9.0764 2.4411 2.4411 3.2359 3.2359 4.3788 4.3788 4.6461 4.6461 4.7393 4.7393 5.4034 5.4034 5.7394 5.7394 5.9446 5.9446 6.2356 6.2356 6.6510 6.6510 6.9951 6.9951 11.7293 11.7293 14.2128 14.2128 15.6658 15.6658 k = 0.6687-0.0706 0.2929 ( 6174 PWs) bands (ev): -76.6631 -76.6631 -45.4574 -45.4574 -41.1210 -41.1210 -40.7980 -40.7980 -35.0999 -35.0999 -35.0511 -35.0511 -9.1666 -9.1666 -9.0796 -9.0796 2.4619 2.4619 3.2220 3.2220 4.3763 4.3763 4.6298 4.6298 4.7247 4.7247 5.3984 5.3984 5.7782 5.7782 5.9916 5.9916 6.2503 6.2503 6.6356 6.6356 6.9732 6.9732 11.6837 11.6837 14.1459 14.1459 15.7577 15.7577 k = 0.6629-0.0592 0.2828 ( 6178 PWs) bands (ev): -76.6631 -76.6631 -45.4574 -45.4574 -41.1209 -41.1209 -40.7979 -40.7979 -35.1015 -35.1015 -35.0495 -35.0495 -9.1675 -9.1675 -9.0826 -9.0826 2.4855 2.4855 3.2095 3.2095 4.3730 4.3730 4.6076 4.6076 4.7169 4.7169 5.3923 5.3923 5.8114 5.8114 6.0314 6.0314 6.2654 6.2654 6.6204 6.6204 6.9619 6.9619 11.6394 11.6394 14.0763 14.0763 15.8526 15.8526 k = 0.6571-0.0479 0.2727 ( 6178 PWs) bands (ev): -76.6631 -76.6631 -45.4573 -45.4573 -41.1208 -41.1208 -40.7979 -40.7979 -35.1030 -35.1030 -35.0480 -35.0480 -9.1687 -9.1687 -9.0854 -9.0854 2.5118 2.5118 3.1985 3.1985 4.3687 4.3687 4.5817 4.5817 4.7141 4.7141 5.3855 5.3855 5.8395 5.8395 6.0606 6.0606 6.2809 6.2809 6.6057 6.6057 6.9634 6.9634 11.5967 11.5967 14.0042 14.0042 15.9503 15.9503 k = 0.6512-0.0366 0.2626 ( 6186 PWs) bands (ev): -76.6631 -76.6631 -45.4573 -45.4573 -41.1207 -41.1207 -40.7979 -40.7979 -35.1046 -35.1046 -35.0465 -35.0465 -9.1702 -9.1702 -9.0881 -9.0881 2.5408 2.5408 3.1889 3.1889 4.3631 4.3631 4.5547 4.5547 4.7143 4.7143 5.3780 5.3780 5.8627 5.8627 6.0770 6.0770 6.2964 6.2964 6.5920 6.5920 6.9792 6.9792 11.5560 11.5560 13.9298 13.9298 16.0504 16.0504 k = 0.6454-0.0253 0.2525 ( 6184 PWs) bands (ev): -76.6631 -76.6631 -45.4573 -45.4573 -41.1206 -41.1206 -40.7979 -40.7979 -35.1061 -35.1061 -35.0450 -35.0450 -9.1720 -9.1720 -9.0906 -9.0906 2.5723 2.5723 3.1806 3.1806 4.3558 4.3558 4.5282 4.5282 4.7165 4.7165 5.3699 5.3699 5.8813 5.8813 6.0798 6.0798 6.3116 6.3116 6.5793 6.5793 7.0096 7.0096 11.5174 11.5174 13.8533 13.8533 16.1530 16.1530 k = 0.6396-0.0140 0.2424 ( 6188 PWs) bands (ev): -76.6631 -76.6631 -45.4572 -45.4572 -41.1205 -41.1205 -40.7979 -40.7979 -35.1075 -35.1075 -35.0436 -35.0436 -9.1740 -9.1740 -9.0930 -9.0930 2.6063 2.6063 3.1738 3.1738 4.3463 4.3463 4.5035 4.5035 4.7200 4.7200 5.3614 5.3614 5.8952 5.8952 6.0701 6.0701 6.3261 6.3261 6.5676 6.5676 7.0537 7.0537 11.4812 11.4812 13.7748 13.7748 16.2579 16.2579 k = 0.6338-0.0027 0.2323 ( 6184 PWs) bands (ev): -76.6632 -76.6632 -45.4572 -45.4572 -41.1203 -41.1203 -40.7979 -40.7979 -35.1089 -35.1089 -35.0423 -35.0423 -9.1763 -9.1763 -9.0952 -9.0952 2.6425 2.6425 3.1683 3.1683 4.3341 4.3341 4.4816 4.4816 4.7245 4.7245 5.3526 5.3526 5.9044 5.9044 6.0500 6.0500 6.3393 6.3393 6.5571 6.5571 7.1097 7.1097 11.4476 11.4476 13.6948 13.6948 16.3649 16.3649 k = 0.6280 0.0086 0.2222 ( 6184 PWs) bands (ev): -76.6632 -76.6632 -45.4571 -45.4571 -41.1202 -41.1202 -40.7979 -40.7979 -35.1103 -35.1103 -35.0409 -35.0409 -9.1788 -9.1788 -9.0972 -9.0972 2.6809 2.6809 3.1640 3.1640 4.3188 4.3188 4.4631 4.4631 4.7297 4.7297 5.3436 5.3436 5.9088 5.9088 6.0221 6.0221 6.3509 6.3509 6.5480 6.5480 7.1752 7.1752 11.4167 11.4167 13.6132 13.6132 16.4739 16.4739 k = 0.6222 0.0199 0.2121 ( 6188 PWs) bands (ev): -76.6632 -76.6632 -45.4571 -45.4571 -41.1201 -41.1201 -40.7978 -40.7978 -35.1116 -35.1116 -35.0397 -35.0397 -9.1814 -9.1814 -9.0992 -9.0992 2.7212 2.7212 3.1610 3.1610 4.3006 4.3006 4.4482 4.4482 4.7356 4.7356 5.3345 5.3345 5.9080 5.9080 5.9888 5.9888 6.3600 6.3600 6.5407 6.5407 7.2479 7.2479 11.3885 11.3885 13.5305 13.5305 16.5849 16.5849 k = 0.6163 0.0312 0.2020 ( 6184 PWs) bands (ev): -76.6632 -76.6632 -45.4570 -45.4570 -41.1200 -41.1200 -40.7978 -40.7978 -35.1129 -35.1129 -35.0384 -35.0384 -9.1842 -9.1842 -9.1010 -9.1010 2.7634 2.7634 3.1593 3.1593 4.2800 4.2800 4.4364 4.4364 4.7419 4.7419 5.3253 5.3253 5.9007 5.9007 5.9536 5.9536 6.3663 6.3663 6.5359 6.5359 7.3260 7.3260 11.3632 11.3632 13.4470 13.4470 16.6977 16.6977 k = 0.6105 0.0425 0.1919 ( 6192 PWs) bands (ev): -76.6632 -76.6632 -45.4570 -45.4570 -41.1199 -41.1199 -40.7978 -40.7978 -35.1141 -35.1141 -35.0373 -35.0373 -9.1870 -9.1870 -9.1026 -9.1026 2.8072 2.8072 3.1586 3.1586 4.2578 4.2578 4.4272 4.4272 4.7485 4.7485 5.3162 5.3162 5.8826 5.8826 5.9222 5.9222 6.3691 6.3691 6.5340 6.5340 7.4078 7.4078 11.3405 11.3405 13.3628 13.3628 16.8120 16.8120 k = 0.6047 0.0538 0.1818 ( 6200 PWs) bands (ev): -76.6632 -76.6632 -45.4570 -45.4570 -41.1198 -41.1198 -40.7978 -40.7978 -35.1153 -35.1153 -35.0361 -35.0361 -9.1900 -9.1900 -9.1042 -9.1042 2.8524 2.8524 3.1590 3.1590 4.2348 4.2348 4.4199 4.4199 4.7555 4.7555 5.3072 5.3072 5.8497 5.8497 5.8998 5.8998 6.3683 6.3683 6.5353 6.5353 7.4921 7.4921 11.3206 11.3206 13.2783 13.2783 16.9279 16.9279 k = 0.5989 0.0651 0.1717 ( 6210 PWs) bands (ev): -76.6632 -76.6632 -45.4569 -45.4569 -41.1197 -41.1197 -40.7978 -40.7978 -35.1164 -35.1164 -35.0351 -35.0351 -9.1930 -9.1930 -9.1056 -9.1056 2.8988 2.8988 3.1605 3.1605 4.2116 4.2116 4.4139 4.4139 4.7627 4.7627 5.2983 5.2983 5.8092 5.8092 5.8805 5.8805 6.3643 6.3643 6.5394 6.5394 7.5778 7.5778 11.3033 11.3033 13.1938 13.1938 17.0451 17.0451 k = 0.5931 0.0764 0.1616 ( 6204 PWs) bands (ev): -76.6632 -76.6632 -45.4569 -45.4569 -41.1196 -41.1196 -40.7978 -40.7978 -35.1174 -35.1174 -35.0341 -35.0341 -9.1959 -9.1959 -9.1069 -9.1069 2.9461 2.9461 3.1628 3.1628 4.1888 4.1888 4.4089 4.4089 4.7701 4.7701 5.2896 5.2896 5.7665 5.7665 5.8598 5.8598 6.3576 6.3576 6.5458 6.5458 7.6641 7.6641 11.2884 11.2884 13.1098 13.1098 17.1635 17.1635 k = 0.5873 0.0877 0.1515 ( 6202 PWs) bands (ev): -76.6632 -76.6632 -45.4568 -45.4568 -41.1195 -41.1195 -40.7978 -40.7978 -35.1184 -35.1184 -35.0331 -35.0331 -9.1989 -9.1989 -9.1081 -9.1081 2.9938 2.9938 3.1661 3.1661 4.1665 4.1665 4.4047 4.4047 4.7775 4.7775 5.2812 5.2812 5.7235 5.7235 5.8366 5.8366 6.3490 6.3490 6.5539 6.5539 7.7501 7.7501 11.2759 11.2759 13.0265 13.0265 17.2827 17.2827 k = 0.5814 0.0990 0.1414 ( 6202 PWs) bands (ev): -76.6632 -76.6632 -45.4568 -45.4568 -41.1194 -41.1194 -40.7977 -40.7977 -35.1194 -35.1194 -35.0322 -35.0322 -9.2019 -9.2019 -9.1092 -9.1092 3.0417 3.0417 3.1703 3.1703 4.1452 4.1452 4.4011 4.4011 4.7849 4.7849 5.2731 5.2731 5.6811 5.6811 5.8109 5.8109 6.3392 6.3392 6.5629 6.5629 7.8353 7.8353 11.2656 11.2656 12.9445 12.9445 17.4027 17.4027 k = 0.5756 0.1103 0.1313 ( 6202 PWs) bands (ev): -76.6632 -76.6632 -45.4568 -45.4568 -41.1193 -41.1193 -40.7977 -40.7977 -35.1203 -35.1203 -35.0314 -35.0314 -9.2047 -9.2047 -9.1101 -9.1101 3.0888 3.0888 3.1758 3.1758 4.1249 4.1249 4.3979 4.3979 4.7922 4.7922 5.2653 5.2653 5.6398 5.6398 5.7830 5.7830 6.3287 6.3287 6.5724 6.5724 7.9190 7.9190 11.2572 11.2572 12.8641 12.8641 17.5231 17.5231 k = 0.5698 0.1216 0.1212 ( 6210 PWs) bands (ev): -76.6632 -76.6632 -45.4567 -45.4567 -41.1192 -41.1192 -40.7977 -40.7977 -35.1211 -35.1211 -35.0306 -35.0306 -9.2075 -9.2075 -9.1110 -9.1110 3.1332 3.1332 3.1841 3.1841 4.1059 4.1059 4.3950 4.3950 4.7994 4.7994 5.2578 5.2578 5.6002 5.6002 5.7534 5.7534 6.3178 6.3178 6.5821 6.5821 8.0005 8.0005 11.2506 11.2506 12.7860 12.7860 17.6435 17.6435 k = 0.5640 0.1329 0.1111 ( 6220 PWs) bands (ev): -76.6632 -76.6632 -45.4567 -45.4567 -41.1192 -41.1192 -40.7977 -40.7977 -35.1219 -35.1219 -35.0299 -35.0299 -9.2101 -9.2101 -9.1118 -9.1118 3.1657 3.1657 3.2037 3.2037 4.0882 4.0882 4.3924 4.3924 4.8064 4.8064 5.2507 5.2507 5.5624 5.5624 5.7224 5.7224 6.3071 6.3071 6.5915 6.5915 8.0791 8.0791 11.2455 11.2455 12.7105 12.7105 17.7637 17.7637 k = 0.5582 0.1442 0.1010 ( 6220 PWs) bands (ev): -76.6632 -76.6632 -45.4567 -45.4567 -41.1191 -41.1191 -40.7977 -40.7977 -35.1226 -35.1226 -35.0292 -35.0292 -9.2126 -9.2126 -9.1126 -9.1126 3.1795 3.1795 3.2411 3.2411 4.0720 4.0720 4.3902 4.3902 4.8130 4.8130 5.2440 5.2440 5.5269 5.5269 5.6908 5.6908 6.2966 6.2966 6.6006 6.6006 8.1543 8.1543 11.2417 11.2417 12.6383 12.6383 17.8833 17.8833 k = 0.5524 0.1555 0.0909 ( 6224 PWs) bands (ev): -76.6632 -76.6632 -45.4566 -45.4566 -41.1190 -41.1190 -40.7977 -40.7977 -35.1232 -35.1232 -35.0286 -35.0286 -9.2149 -9.2149 -9.1132 -9.1132 3.1869 3.1869 3.2830 3.2830 4.0572 4.0572 4.3881 4.3881 4.8193 4.8193 5.2377 5.2377 5.4940 5.4940 5.6591 5.6591 6.2866 6.2866 6.6092 6.6092 8.2254 8.2254 11.2391 11.2391 12.5701 12.5701 18.0017 18.0017 k = 0.5465 0.1668 0.0808 ( 6220 PWs) bands (ev): -76.6632 -76.6632 -45.4566 -45.4566 -41.1189 -41.1189 -40.7977 -40.7977 -35.1238 -35.1238 -35.0280 -35.0280 -9.2171 -9.2171 -9.1138 -9.1138 3.1929 3.1929 3.3241 3.3241 4.0441 4.0441 4.3863 4.3863 4.8251 4.8251 5.2318 5.2318 5.4638 5.4638 5.6280 5.6280 6.2773 6.2773 6.6171 6.6171 8.2916 8.2916 11.2373 11.2373 12.5064 12.5064 18.1185 18.1185 k = 0.5407 0.1782 0.0707 ( 6228 PWs) bands (ev): -76.6632 -76.6632 -45.4566 -45.4566 -41.1189 -41.1189 -40.7977 -40.7977 -35.1243 -35.1243 -35.0276 -35.0276 -9.2190 -9.2190 -9.1143 -9.1143 3.1981 3.1981 3.3627 3.3627 4.0325 4.0325 4.3848 4.3848 4.8305 4.8305 5.2264 5.2264 5.4366 5.4366 5.5982 5.5982 6.2688 6.2688 6.6242 6.6242 8.3524 8.3524 11.2363 11.2363 12.4479 12.4479 18.2329 18.2329 k = 0.5349 0.1895 0.0606 ( 6228 PWs) bands (ev): -76.6632 -76.6632 -45.4566 -45.4566 -41.1188 -41.1188 -40.7977 -40.7977 -35.1247 -35.1247 -35.0271 -35.0271 -9.2207 -9.2207 -9.1147 -9.1147 3.2027 3.2027 3.3981 3.3981 4.0225 4.0225 4.3834 4.3834 4.8352 4.8352 5.2214 5.2214 5.4126 5.4126 5.5705 5.5705 6.2612 6.2612 6.6305 6.6305 8.4069 8.4069 11.2357 11.2357 12.3954 12.3954 18.3443 18.3443 k = 0.5291 0.2008 0.0505 ( 6232 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1188 -41.1188 -40.7976 -40.7976 -35.1251 -35.1251 -35.0268 -35.0268 -9.2222 -9.2222 -9.1150 -9.1150 3.2068 3.2068 3.4294 3.4294 4.0141 4.0141 4.3822 4.3822 4.8394 4.8394 5.2171 5.2171 5.3920 5.3920 5.5456 5.5456 6.2546 6.2546 6.6360 6.6360 8.4544 8.4544 11.2356 11.2356 12.3495 12.3495 18.4513 18.4513 k = 0.5233 0.2121 0.0404 ( 6232 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1188 -41.1188 -40.7976 -40.7976 -35.1254 -35.1254 -35.0265 -35.0265 -9.2234 -9.2234 -9.1153 -9.1153 3.2103 3.2103 3.4561 3.4561 4.0074 4.0074 4.3813 4.3813 4.8428 4.8428 5.2133 5.2133 5.3749 5.3749 5.5241 5.5241 6.2491 6.2491 6.6405 6.6405 8.4944 8.4944 11.2357 11.2357 12.3109 12.3109 18.5525 18.5525 k = 0.5175 0.2234 0.0303 ( 6244 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1256 -35.1256 -35.0263 -35.0263 -9.2244 -9.2244 -9.1155 -9.1155 3.2130 3.2130 3.4775 3.4775 4.0022 4.0022 4.3806 4.3806 4.8456 4.8456 5.2102 5.2102 5.3614 5.3614 5.5067 5.5067 6.2448 6.2448 6.6440 6.6440 8.5262 8.5262 11.2359 11.2359 12.2802 12.2802 18.6448 18.6448 k = 0.5116 0.2347 0.0202 ( 6248 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1258 -35.1258 -35.0261 -35.0261 -9.2251 -9.2251 -9.1157 -9.1157 3.2151 3.2151 3.4932 3.4932 3.9985 3.9985 4.3800 4.3800 4.8475 4.8475 5.2079 5.2079 5.3518 5.3518 5.4939 5.4939 6.2416 6.2416 6.6466 6.6466 8.5494 8.5494 11.2361 11.2361 12.2578 12.2578 18.7234 18.7234 k = 0.5058 0.2460 0.0101 ( 6252 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1259 -35.1259 -35.0260 -35.0260 -9.2255 -9.2255 -9.1158 -9.1158 3.2163 3.2163 3.5027 3.5027 3.9963 3.9963 4.3797 4.3797 4.8487 4.8487 5.2065 5.2065 5.3459 5.3459 5.4861 5.4861 6.2397 6.2397 6.6481 6.6481 8.5634 8.5634 11.2362 11.2362 12.2442 12.2442 18.7793 18.7793 k = 0.5000 0.2573 0.0000 ( 6250 PWs) bands (ev): -76.6632 -76.6632 -45.4565 -45.4565 -41.1187 -41.1187 -40.7976 -40.7976 -35.1259 -35.1259 -35.0260 -35.0260 -9.2256 -9.2256 -9.1158 -9.1158 3.2167 3.2167 3.5059 3.5059 3.9956 3.9956 4.3796 4.3796 4.8491 4.8491 5.2061 5.2061 5.3440 5.3440 5.4834 5.4834 6.2391 6.2391 6.6486 6.6486 8.5681 8.5681 11.2363 11.2363 12.2397 12.2397 18.8002 18.8002 Writing output data file Li2PdO2.save init_run : 0.33s CPU 0.53s WALL ( 1 calls) electrons : 288.43s CPU 291.68s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.04s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 288.41s CPU 291.66s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.04s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.11s WALL ( 481 calls) cegterg : 258.88s CPU 261.37s WALL ( 601 calls) Called by sum_band: Called by *egterg: h_psi : 208.36s CPU 210.09s WALL ( 10196 calls) s_psi : 3.44s CPU 3.44s WALL ( 10196 calls) g_psi : 0.32s CPU 0.38s WALL ( 9114 calls) cdiaghg : 50.70s CPU 51.33s WALL ( 9595 calls) cegterg:over : 7.45s CPU 7.92s WALL ( 9114 calls) cegterg:upda : 7.70s CPU 7.87s WALL ( 9114 calls) cegterg:last : 3.68s CPU 3.70s WALL ( 1563 calls) cdiaghg:chol : 3.09s CPU 2.96s WALL ( 9595 calls) cdiaghg:inve : 1.69s CPU 1.67s WALL ( 9595 calls) cdiaghg:para : 2.93s CPU 2.89s WALL ( 19190 calls) Called by h_psi: h_psi:vloc : 198.89s CPU 200.61s WALL ( 10196 calls) h_psi:vnl : 9.04s CPU 9.10s WALL ( 10196 calls) add_vuspsi : 4.22s CPU 4.11s WALL ( 10196 calls) General routines calbec : 4.81s CPU 4.96s WALL ( 10196 calls) fft : 0.01s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 185.01s CPU 187.00s WALL ( 887896 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.36s WALL ( 962 calls) Parallel routines fft_scatter : 53.46s CPU 53.97s WALL ( 887919 calls) PWSCF : 5m13.50s CPU 5m45.24s WALL This run was terminated on: 20:32:12 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=