Program PWSCF v.5.1.1 starts on 2Dec2015 at 2:11:40 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./LiNbO3.save/ file Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 60 60 16 2085 2085 300 Max 61 61 17 2090 2090 305 Sum 2921 2921 807 100197 100197 14531 bravais-lattice index = 14 lattice parameter (alat) = 10.3690 a.u. unit-cell volume = 712.1987 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 3 number of electrons = 68.00 number of Kohn-Sham states= 82 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 411.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.369033 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.561574 celldm(5)= 0.561574 celldm(6)= 0.561574 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.561574 0.827426 0.000000 ) a(3) = ( 0.561574 0.297560 0.772071 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.678700 -0.465787 ) b(2) = ( 0.000000 1.208567 -0.465787 ) b(3) = ( 0.000000 0.000000 1.295218 ) PseudoPot. # 1 for O read from file: /home/autes/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 Nb read from file: /home/autes/Pseudo/Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: c1e153ab096482f446ae869583c6ae55 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1227 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Li read from file: /home/autes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Nb 13.00 92.90640 Nb( 1.00) Li 3.00 6.94100 Li( 1.00) No symmetry 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 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class: E 1 -E -1 Cartesian axes number of k points= 273 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 2) = ( 0.0131579 -0.0089303 -0.0061288), wk = 0.0036630 k( 3) = ( 0.0263158 -0.0178605 -0.0122576), wk = 0.0036630 k( 4) = ( 0.0394737 -0.0267908 -0.0183863), wk = 0.0036630 k( 5) = ( 0.0526316 -0.0357210 -0.0245151), wk = 0.0036630 k( 6) = ( 0.0657895 -0.0446513 -0.0306439), wk = 0.0036630 k( 7) = ( 0.0789474 -0.0535815 -0.0367727), wk = 0.0036630 k( 8) = ( 0.0921053 -0.0625118 -0.0429014), wk = 0.0036630 k( 9) = ( 0.1052632 -0.0714421 -0.0490302), wk = 0.0036630 k( 10) = ( 0.1184210 -0.0803723 -0.0551590), wk = 0.0036630 k( 11) = ( 0.1315790 -0.0893026 -0.0612878), wk = 0.0036630 k( 12) = ( 0.1447368 -0.0982328 -0.0674166), wk = 0.0036630 k( 13) = ( 0.1578947 -0.1071631 -0.0735453), wk = 0.0036630 k( 14) = ( 0.1710526 -0.1160934 -0.0796741), wk = 0.0036630 k( 15) = ( 0.1842105 -0.1250236 -0.0858029), wk = 0.0036630 k( 16) = ( 0.1973684 -0.1339539 -0.0919317), wk = 0.0036630 k( 17) = ( 0.2105263 -0.1428841 -0.0980604), wk = 0.0036630 k( 18) = ( 0.2236842 -0.1518144 -0.1041892), wk = 0.0036630 k( 19) = ( 0.2368421 -0.1607446 -0.1103180), wk = 0.0036630 k( 20) = ( 0.2500000 -0.1696749 -0.1164468), wk = 0.0036630 k( 21) = ( 0.2631579 -0.1786052 -0.1225756), wk = 0.0036630 k( 22) = ( 0.2763158 -0.1875354 -0.1287043), wk = 0.0036630 k( 23) = ( 0.2894737 -0.1964657 -0.1348331), wk = 0.0036630 k( 24) = ( 0.3026316 -0.2053959 -0.1409619), wk = 0.0036630 k( 25) = ( 0.3157895 -0.2143262 -0.1470907), wk = 0.0036630 k( 26) = ( 0.3289474 -0.2232565 -0.1532194), wk = 0.0036630 k( 27) = ( 0.3421053 -0.2321867 -0.1593482), wk = 0.0036630 k( 28) = ( 0.3552632 -0.2411170 -0.1654770), wk = 0.0036630 k( 29) = ( 0.3684211 -0.2500472 -0.1716058), wk = 0.0036630 k( 30) = ( 0.3815789 -0.2589775 -0.1777346), wk = 0.0036630 k( 31) = ( 0.3947368 -0.2679077 -0.1838633), wk = 0.0036630 k( 32) = ( 0.4078947 -0.2768380 -0.1899921), wk = 0.0036630 k( 33) = ( 0.4210526 -0.2857683 -0.1961209), wk = 0.0036630 k( 34) = ( 0.4342105 -0.2946985 -0.2022497), wk = 0.0036630 k( 35) = ( 0.4473684 -0.3036288 -0.2083784), wk = 0.0036630 k( 36) = ( 0.4605263 -0.3125590 -0.2145072), wk = 0.0036630 k( 37) = ( 0.4736842 -0.3214893 -0.2206360), wk = 0.0036630 k( 38) = ( 0.4868421 -0.3304195 -0.2267648), wk = 0.0036630 k( 39) = ( 0.5000000 -0.3393498 -0.2328935), wk = 0.0036630 k( 40) = ( 0.5000000 -0.3393498 -0.2328935), wk = 0.0036630 k( 41) = ( 0.5000000 -0.3295354 -0.2471941), wk = 0.0036630 k( 42) = ( 0.5000000 -0.3197211 -0.2614946), wk = 0.0036630 k( 43) = ( 0.5000000 -0.3099067 -0.2757952), wk = 0.0036630 k( 44) = ( 0.5000000 -0.3000923 -0.2900957), wk = 0.0036630 k( 45) = ( 0.5000000 -0.2902780 -0.3043963), wk = 0.0036630 k( 46) = ( 0.5000000 -0.2804636 -0.3186968), wk = 0.0036630 k( 47) = ( 0.5000000 -0.2706492 -0.3329973), wk = 0.0036630 k( 48) = ( 0.5000000 -0.2608349 -0.3472979), wk = 0.0036630 k( 49) = ( 0.5000000 -0.2510205 -0.3615984), wk = 0.0036630 k( 50) = ( 0.5000000 -0.2412061 -0.3758989), wk = 0.0036630 k( 51) = ( 0.5000000 -0.2313918 -0.3901995), wk = 0.0036630 k( 52) = ( 0.5000000 -0.2215774 -0.4045000), wk = 0.0036630 k( 53) = ( 0.5000000 -0.2117630 -0.4188006), wk = 0.0036630 k( 54) = ( 0.5000000 -0.2019487 -0.4331011), wk = 0.0036630 k( 55) = ( 0.5000000 -0.1921343 -0.4474017), wk = 0.0036630 k( 56) = ( 0.5000000 -0.1823199 -0.4617022), wk = 0.0036630 k( 57) = ( 0.5000000 -0.1725056 -0.4760027), wk = 0.0036630 k( 58) = ( 0.5000000 -0.1626912 -0.4903033), wk = 0.0036630 k( 59) = ( 0.5000000 -0.1528768 -0.5046038), wk = 0.0036630 k( 60) = ( 0.5000000 -0.1430625 -0.5189044), wk = 0.0036630 k( 61) = ( 0.5000000 -0.1332481 -0.5332049), wk = 0.0036630 k( 62) = ( 0.5000000 -0.1234337 -0.5475054), wk = 0.0036630 k( 63) = ( 0.5000000 -0.1136194 -0.5618060), wk = 0.0036630 k( 64) = ( 0.5000000 -0.1038050 -0.5761065), wk = 0.0036630 k( 65) = ( 0.5000000 -0.0939906 -0.5904070), wk = 0.0036630 k( 66) = ( 0.5000000 -0.0841763 -0.6047076), wk = 0.0036630 k( 67) = ( 0.5000000 -0.0743619 -0.6190081), wk = 0.0036630 k( 68) = ( 0.5000000 -0.0645475 -0.6333087), wk = 0.0036630 k( 69) = ( 0.5000000 -0.0547332 -0.6476092), wk = 0.0036630 k( 70) = ( 0.7645007 0.0854170 -0.2839650), wk = 0.0036630 k( 71) = ( 0.7564855 0.0908569 -0.2698502), wk = 0.0036630 k( 72) = ( 0.7484703 0.0962968 -0.2557355), wk = 0.0036630 k( 73) = ( 0.7404551 0.1017367 -0.2416207), wk = 0.0036630 k( 74) = ( 0.7324400 0.1071766 -0.2275059), wk = 0.0036630 k( 75) = ( 0.7244248 0.1126165 -0.2133912), wk = 0.0036630 k( 76) = ( 0.7164096 0.1180564 -0.1992764), wk = 0.0036630 k( 77) = ( 0.7083945 0.1234963 -0.1851617), wk = 0.0036630 k( 78) = ( 0.7003793 0.1289361 -0.1710469), wk = 0.0036630 k( 79) = ( 0.6923641 0.1343760 -0.1569321), wk = 0.0036630 k( 80) = ( 0.6843489 0.1398159 -0.1428174), wk = 0.0036630 k( 81) = ( 0.6763338 0.1452558 -0.1287026), wk = 0.0036630 k( 82) = ( 0.6683186 0.1506957 -0.1145879), wk = 0.0036630 k( 83) = ( 0.6603034 0.1561356 -0.1004731), wk = 0.0036630 k( 84) = ( 0.6522883 0.1615755 -0.0863583), wk = 0.0036630 k( 85) = ( 0.6442731 0.1670154 -0.0722436), wk = 0.0036630 k( 86) = ( 0.6362579 0.1724553 -0.0581288), wk = 0.0036630 k( 87) = ( 0.6282427 0.1778952 -0.0440141), wk = 0.0036630 k( 88) = ( 0.6202276 0.1833351 -0.0298993), wk = 0.0036630 k( 89) = ( 0.6122124 0.1887750 -0.0157845), wk = 0.0036630 k( 90) = ( 0.6041972 0.1942149 -0.0016698), wk = 0.0036630 k( 91) = ( 0.5961821 0.1996548 0.0124450), wk = 0.0036630 k( 92) = ( 0.5881669 0.2050947 0.0265598), wk = 0.0036630 k( 93) = ( 0.5801517 0.2105345 0.0406745), wk = 0.0036630 k( 94) = ( 0.5721365 0.2159744 0.0547893), wk = 0.0036630 k( 95) = ( 0.5641214 0.2214143 0.0689040), wk = 0.0036630 k( 96) = ( 0.5561062 0.2268542 0.0830188), wk = 0.0036630 k( 97) = ( 0.5480910 0.2322941 0.0971335), wk = 0.0036630 k( 98) = ( 0.5400759 0.2377340 0.1112483), wk = 0.0036630 k( 99) = ( 0.5320607 0.2431739 0.1253631), wk = 0.0036630 k( 100) = ( 0.5240455 0.2486138 0.1394778), wk = 0.0036630 k( 101) = ( 0.5160303 0.2540537 0.1535926), wk = 0.0036630 k( 102) = ( 0.5080152 0.2594936 0.1677074), wk = 0.0036630 k( 103) = ( 0.5000000 0.2649335 0.1818221), wk = 0.0036630 k( 104) = ( 0.5000000 0.2649335 0.1818221), wk = 0.0036630 k( 105) = ( 0.4857143 0.2573640 0.1766272), wk = 0.0036630 k( 106) = ( 0.4714286 0.2497944 0.1714323), wk = 0.0036630 k( 107) = ( 0.4571429 0.2422249 0.1662374), wk = 0.0036630 k( 108) = ( 0.4428571 0.2346554 0.1610424), wk = 0.0036630 k( 109) = ( 0.4285714 0.2270858 0.1558475), wk = 0.0036630 k( 110) = ( 0.4142857 0.2195163 0.1506526), wk = 0.0036630 k( 111) = ( 0.4000000 0.2119468 0.1454577), wk = 0.0036630 k( 112) = ( 0.3857143 0.2043773 0.1402628), wk = 0.0036630 k( 113) = ( 0.3714286 0.1968077 0.1350679), wk = 0.0036630 k( 114) = ( 0.3571429 0.1892382 0.1298729), wk = 0.0036630 k( 115) = ( 0.3428571 0.1816687 0.1246780), wk = 0.0036630 k( 116) = ( 0.3285714 0.1740991 0.1194831), wk = 0.0036630 k( 117) = ( 0.3142857 0.1665296 0.1142882), wk = 0.0036630 k( 118) = ( 0.3000000 0.1589601 0.1090933), wk = 0.0036630 k( 119) = ( 0.2857143 0.1513906 0.1038984), wk = 0.0036630 k( 120) = ( 0.2714286 0.1438210 0.0987034), wk = 0.0036630 k( 121) = ( 0.2571429 0.1362515 0.0935085), wk = 0.0036630 k( 122) = ( 0.2428571 0.1286820 0.0883136), wk = 0.0036630 k( 123) = ( 0.2285714 0.1211124 0.0831187), wk = 0.0036630 k( 124) = ( 0.2142857 0.1135429 0.0779238), wk = 0.0036630 k( 125) = ( 0.2000000 0.1059734 0.0727288), wk = 0.0036630 k( 126) = ( 0.1857143 0.0984039 0.0675339), wk = 0.0036630 k( 127) = ( 0.1714286 0.0908343 0.0623390), wk = 0.0036630 k( 128) = ( 0.1571429 0.0832648 0.0571441), wk = 0.0036630 k( 129) = ( 0.1428571 0.0756953 0.0519492), wk = 0.0036630 k( 130) = ( 0.1285714 0.0681258 0.0467543), wk = 0.0036630 k( 131) = ( 0.1142857 0.0605562 0.0415593), wk = 0.0036630 k( 132) = ( 0.1000000 0.0529867 0.0363644), wk = 0.0036630 k( 133) = ( 0.0857143 0.0454172 0.0311695), wk = 0.0036630 k( 134) = ( 0.0714286 0.0378476 0.0259746), wk = 0.0036630 k( 135) = ( 0.0571429 0.0302781 0.0207797), wk = 0.0036630 k( 136) = ( 0.0428571 0.0227086 0.0155848), wk = 0.0036630 k( 137) = ( 0.0285714 0.0151391 0.0103898), wk = 0.0036630 k( 138) = ( 0.0142857 0.0075695 0.0051949), wk = 0.0036630 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 141) = ( 0.0081722 -0.0055465 -0.0143913), wk = 0.0036630 k( 142) = ( 0.0163444 -0.0110930 -0.0287826), wk = 0.0036630 k( 143) = ( 0.0245167 -0.0166394 -0.0431740), wk = 0.0036630 k( 144) = ( 0.0326889 -0.0221859 -0.0575653), wk = 0.0036630 k( 145) = ( 0.0408611 -0.0277324 -0.0719566), wk = 0.0036630 k( 146) = ( 0.0490333 -0.0332789 -0.0863479), wk = 0.0036630 k( 147) = ( 0.0572055 -0.0388254 -0.1007392), wk = 0.0036630 k( 148) = ( 0.0653777 -0.0443718 -0.1151305), wk = 0.0036630 k( 149) = ( 0.0735499 -0.0499183 -0.1295219), wk = 0.0036630 k( 150) = ( 0.0817221 -0.0554648 -0.1439132), wk = 0.0036630 k( 151) = ( 0.0898944 -0.0610113 -0.1583045), wk = 0.0036630 k( 152) = ( 0.0980666 -0.0665577 -0.1726958), wk = 0.0036630 k( 153) = ( 0.1062388 -0.0721042 -0.1870871), wk = 0.0036630 k( 154) = ( 0.1144110 -0.0776507 -0.2014784), wk = 0.0036630 k( 155) = ( 0.1225832 -0.0831972 -0.2158697), wk = 0.0036630 k( 156) = ( 0.1307554 -0.0887437 -0.2302611), wk = 0.0036630 k( 157) = ( 0.1389277 -0.0942901 -0.2446524), wk = 0.0036630 k( 158) = ( 0.1470999 -0.0998366 -0.2590437), wk = 0.0036630 k( 159) = ( 0.1552721 -0.1053831 -0.2734350), wk = 0.0036630 k( 160) = ( 0.1634443 -0.1109296 -0.2878263), wk = 0.0036630 k( 161) = ( 0.1716165 -0.1164761 -0.3022176), wk = 0.0036630 k( 162) = ( 0.1797887 -0.1220225 -0.3166089), wk = 0.0036630 k( 163) = ( 0.1879609 -0.1275690 -0.3310003), wk = 0.0036630 k( 164) = ( 0.1961332 -0.1331155 -0.3453916), wk = 0.0036630 k( 165) = ( 0.2043054 -0.1386620 -0.3597829), wk = 0.0036630 k( 166) = ( 0.2124776 -0.1442085 -0.3741742), wk = 0.0036630 k( 167) = ( 0.2206498 -0.1497549 -0.3885655), wk = 0.0036630 k( 168) = ( 0.2288220 -0.1553014 -0.4029568), wk = 0.0036630 k( 169) = ( 0.2369942 -0.1608479 -0.4173482), wk = 0.0036630 k( 170) = ( 0.2451665 -0.1663944 -0.4317395), wk = 0.0036630 k( 171) = ( 0.2533387 -0.1719409 -0.4461308), wk = 0.0036630 k( 172) = ( 0.2615109 -0.1774873 -0.4605221), wk = 0.0036630 k( 173) = ( 0.2696831 -0.1830338 -0.4749134), wk = 0.0036630 k( 174) = ( 0.2778553 -0.1885803 -0.4893047), wk = 0.0036630 k( 175) = ( 0.2860275 -0.1941268 -0.5036961), wk = 0.0036630 k( 176) = ( 0.2941997 -0.1996732 -0.5180874), wk = 0.0036630 k( 177) = ( 0.3023720 -0.2052197 -0.5324787), wk = 0.0036630 k( 178) = ( 0.3105442 -0.2107662 -0.5468700), wk = 0.0036630 k( 179) = ( 0.3187164 -0.2163127 -0.5612613), wk = 0.0036630 k( 180) = ( 0.3268886 -0.2218592 -0.5756526), wk = 0.0036630 k( 181) = ( 0.3350608 -0.2274056 -0.5900440), wk = 0.0036630 k( 182) = ( 0.3432330 -0.2329521 -0.6044353), wk = 0.0036630 k( 183) = ( 0.3514053 -0.2384986 -0.6188266), wk = 0.0036630 k( 184) = ( 0.3595775 -0.2440451 -0.6332179), wk = 0.0036630 k( 185) = ( 0.3677497 -0.2495916 -0.6476092), wk = 0.0036630 k( 186) = ( 0.6322503 0.0153419 -0.4657871), wk = 0.0036630 k( 187) = ( 0.6244709 0.0300238 -0.4657871), wk = 0.0036630 k( 188) = ( 0.6166915 0.0447056 -0.4657871), wk = 0.0036630 k( 189) = ( 0.6089120 0.0593875 -0.4657871), wk = 0.0036630 k( 190) = ( 0.6011326 0.0740693 -0.4657871), wk = 0.0036630 k( 191) = ( 0.5933532 0.0887512 -0.4657871), wk = 0.0036630 k( 192) = ( 0.5855737 0.1034331 -0.4657871), wk = 0.0036630 k( 193) = ( 0.5777943 0.1181149 -0.4657871), wk = 0.0036630 k( 194) = ( 0.5700149 0.1327968 -0.4657871), wk = 0.0036630 k( 195) = ( 0.5622354 0.1474786 -0.4657871), wk = 0.0036630 k( 196) = ( 0.5544560 0.1621605 -0.4657871), wk = 0.0036630 k( 197) = ( 0.5466766 0.1768424 -0.4657871), wk = 0.0036630 k( 198) = ( 0.5388972 0.1915242 -0.4657871), wk = 0.0036630 k( 199) = ( 0.5311177 0.2062061 -0.4657871), wk = 0.0036630 k( 200) = ( 0.5233383 0.2208879 -0.4657871), wk = 0.0036630 k( 201) = ( 0.5155589 0.2355698 -0.4657871), wk = 0.0036630 k( 202) = ( 0.5077794 0.2502516 -0.4657871), wk = 0.0036630 k( 203) = ( 0.5000000 0.2649335 -0.4657871), wk = 0.0036630 k( 204) = ( 0.5000000 0.2649335 -0.4657871), wk = 0.0036630 k( 205) = ( 0.5094464 0.2699388 -0.4527998), wk = 0.0036630 k( 206) = ( 0.5188929 0.2749442 -0.4398125), wk = 0.0036630 k( 207) = ( 0.5283393 0.2799496 -0.4268252), wk = 0.0036630 k( 208) = ( 0.5377858 0.2849549 -0.4138379), wk = 0.0036630 k( 209) = ( 0.5472323 0.2899603 -0.4008506), wk = 0.0036630 k( 210) = ( 0.5566787 0.2949657 -0.3878633), wk = 0.0036630 k( 211) = ( 0.5661252 0.2999710 -0.3748760), wk = 0.0036630 k( 212) = ( 0.5755716 0.3049764 -0.3618887), wk = 0.0036630 k( 213) = ( 0.5850181 0.3099817 -0.3489015), wk = 0.0036630 k( 214) = ( 0.5944645 0.3149871 -0.3359142), wk = 0.0036630 k( 215) = ( 0.6039110 0.3199925 -0.3229269), wk = 0.0036630 k( 216) = ( 0.6133574 0.3249978 -0.3099396), wk = 0.0036630 k( 217) = ( 0.6228039 0.3300032 -0.2969523), wk = 0.0036630 k( 218) = ( 0.6322503 0.3350086 -0.2839650), wk = 0.0036630 k( 219) = ( 0.6322503 0.3350086 -0.2839650), wk = 0.0036630 k( 220) = ( 0.6276900 0.3325922 -0.2679034), wk = 0.0036630 k( 221) = ( 0.6231296 0.3301758 -0.2518417), wk = 0.0036630 k( 222) = ( 0.6185692 0.3277594 -0.2357801), wk = 0.0036630 k( 223) = ( 0.6140089 0.3253430 -0.2197185), wk = 0.0036630 k( 224) = ( 0.6094485 0.3229266 -0.2036569), wk = 0.0036630 k( 225) = ( 0.6048882 0.3205103 -0.1875952), wk = 0.0036630 k( 226) = ( 0.6003278 0.3180939 -0.1715336), wk = 0.0036630 k( 227) = ( 0.5957675 0.3156775 -0.1554720), wk = 0.0036630 k( 228) = ( 0.5912071 0.3132611 -0.1394104), wk = 0.0036630 k( 229) = ( 0.5866468 0.3108447 -0.1233487), wk = 0.0036630 k( 230) = ( 0.5820864 0.3084284 -0.1072871), wk = 0.0036630 k( 231) = ( 0.5775261 0.3060120 -0.0912255), wk = 0.0036630 k( 232) = ( 0.5729657 0.3035956 -0.0751639), wk = 0.0036630 k( 233) = ( 0.5684053 0.3011792 -0.0591022), wk = 0.0036630 k( 234) = ( 0.5638450 0.2987628 -0.0430406), wk = 0.0036630 k( 235) = ( 0.5592846 0.2963464 -0.0269790), wk = 0.0036630 k( 236) = ( 0.5547243 0.2939301 -0.0109174), wk = 0.0036630 k( 237) = ( 0.5501639 0.2915137 0.0051442), wk = 0.0036630 k( 238) = ( 0.5456036 0.2890973 0.0212059), wk = 0.0036630 k( 239) = ( 0.5410432 0.2866809 0.0372675), wk = 0.0036630 k( 240) = ( 0.5364828 0.2842645 0.0533291), wk = 0.0036630 k( 241) = ( 0.5319225 0.2818482 0.0693908), wk = 0.0036630 k( 242) = ( 0.5273621 0.2794318 0.0854524), wk = 0.0036630 k( 243) = ( 0.5228018 0.2770154 0.1015140), wk = 0.0036630 k( 244) = ( 0.5182414 0.2745990 0.1175756), wk = 0.0036630 k( 245) = ( 0.5136811 0.2721826 0.1336372), wk = 0.0036630 k( 246) = ( 0.5091207 0.2697662 0.1496989), wk = 0.0036630 k( 247) = ( 0.5045604 0.2673499 0.1657605), wk = 0.0036630 k( 248) = ( 0.5000000 0.2649335 0.1818221), wk = 0.0036630 k( 249) = ( 0.5000000 -0.3393498 -0.2328935), wk = 0.0036630 k( 250) = ( 0.5110209 -0.3283109 -0.2253176), wk = 0.0036630 k( 251) = ( 0.5220417 -0.3172720 -0.2177417), wk = 0.0036630 k( 252) = ( 0.5330626 -0.3062331 -0.2101658), wk = 0.0036630 k( 253) = ( 0.5440834 -0.2951942 -0.2025899), wk = 0.0036630 k( 254) = ( 0.5551043 -0.2841553 -0.1950139), wk = 0.0036630 k( 255) = ( 0.5661252 -0.2731164 -0.1874380), wk = 0.0036630 k( 256) = ( 0.5771460 -0.2620775 -0.1798621), wk = 0.0036630 k( 257) = ( 0.5881669 -0.2510386 -0.1722862), wk = 0.0036630 k( 258) = ( 0.5991877 -0.2399997 -0.1647103), wk = 0.0036630 k( 259) = ( 0.6102086 -0.2289609 -0.1571343), wk = 0.0036630 k( 260) = ( 0.6212295 -0.2179220 -0.1495584), wk = 0.0036630 k( 261) = ( 0.6322503 -0.2068831 -0.1419825), wk = 0.0036630 k( 262) = ( 0.6432712 -0.1958442 -0.1344066), wk = 0.0036630 k( 263) = ( 0.6542920 -0.1848053 -0.1268306), wk = 0.0036630 k( 264) = ( 0.6653129 -0.1737664 -0.1192547), wk = 0.0036630 k( 265) = ( 0.6763338 -0.1627275 -0.1116788), wk = 0.0036630 k( 266) = ( 0.6873546 -0.1516886 -0.1041029), wk = 0.0036630 k( 267) = ( 0.6983755 -0.1406497 -0.0965270), wk = 0.0036630 k( 268) = ( 0.7093963 -0.1296108 -0.0889510), wk = 0.0036630 k( 269) = ( 0.7204172 -0.1185719 -0.0813751), wk = 0.0036630 k( 270) = ( 0.7314381 -0.1075330 -0.0737992), wk = 0.0036630 k( 271) = ( 0.7424589 -0.0964941 -0.0662233), wk = 0.0036630 k( 272) = ( 0.7534798 -0.0854552 -0.0586474), wk = 0.0036630 k( 273) = ( 0.7645007 -0.0744163 -0.0510714), wk = 0.0036630 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 2) = ( 0.0131579 0.0000000 0.0000000), wk = 0.0036630 k( 3) = ( 0.0263158 0.0000000 0.0000000), wk = 0.0036630 k( 4) = ( 0.0394737 0.0000000 0.0000000), wk = 0.0036630 k( 5) = ( 0.0526316 0.0000000 0.0000000), wk = 0.0036630 k( 6) = ( 0.0657895 0.0000000 0.0000000), wk = 0.0036630 k( 7) = ( 0.0789474 -0.0000000 0.0000000), wk = 0.0036630 k( 8) = ( 0.0921053 0.0000000 0.0000000), wk = 0.0036630 k( 9) = ( 0.1052632 0.0000000 0.0000000), wk = 0.0036630 k( 10) = ( 0.1184210 0.0000000 0.0000000), wk = 0.0036630 k( 11) = ( 0.1315790 -0.0000000 0.0000000), wk = 0.0036630 k( 12) = ( 0.1447368 -0.0000000 0.0000000), wk = 0.0036630 k( 13) = ( 0.1578947 -0.0000000 0.0000000), wk = 0.0036630 k( 14) = ( 0.1710526 -0.0000000 0.0000000), wk = 0.0036630 k( 15) = ( 0.1842105 -0.0000000 -0.0000000), wk = 0.0036630 k( 16) = ( 0.1973684 -0.0000000 -0.0000000), wk = 0.0036630 k( 17) = ( 0.2105263 0.0000000 0.0000000), wk = 0.0036630 k( 18) = ( 0.2236842 0.0000000 0.0000000), wk = 0.0036630 k( 19) = ( 0.2368421 0.0000000 0.0000000), wk = 0.0036630 k( 20) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0036630 k( 21) = ( 0.2631579 -0.0000000 0.0000000), wk = 0.0036630 k( 22) = ( 0.2763158 -0.0000000 0.0000000), wk = 0.0036630 k( 23) = ( 0.2894737 -0.0000000 0.0000000), wk = 0.0036630 k( 24) = ( 0.3026316 0.0000000 0.0000000), wk = 0.0036630 k( 25) = ( 0.3157895 -0.0000000 -0.0000000), wk = 0.0036630 k( 26) = ( 0.3289474 -0.0000000 0.0000000), wk = 0.0036630 k( 27) = ( 0.3421053 -0.0000000 0.0000000), wk = 0.0036630 k( 28) = ( 0.3552632 0.0000000 0.0000000), wk = 0.0036630 k( 29) = ( 0.3684211 0.0000000 0.0000000), wk = 0.0036630 k( 30) = ( 0.3815789 -0.0000000 0.0000000), wk = 0.0036630 k( 31) = ( 0.3947368 -0.0000000 -0.0000000), wk = 0.0036630 k( 32) = ( 0.4078947 -0.0000000 -0.0000000), wk = 0.0036630 k( 33) = ( 0.4210526 0.0000000 0.0000000), wk = 0.0036630 k( 34) = ( 0.4342105 -0.0000000 0.0000000), wk = 0.0036630 k( 35) = ( 0.4473684 0.0000000 0.0000000), wk = 0.0036630 k( 36) = ( 0.4605263 0.0000000 0.0000000), wk = 0.0036630 k( 37) = ( 0.4736842 0.0000000 -0.0000000), wk = 0.0036630 k( 38) = ( 0.4868421 -0.0000000 -0.0000000), wk = 0.0036630 k( 39) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0036630 k( 40) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0036630 k( 41) = ( 0.5000000 0.0081207 -0.0081207), wk = 0.0036630 k( 42) = ( 0.5000000 0.0162413 -0.0162413), wk = 0.0036630 k( 43) = ( 0.5000000 0.0243620 -0.0243620), wk = 0.0036630 k( 44) = ( 0.5000000 0.0324827 -0.0324827), wk = 0.0036630 k( 45) = ( 0.5000000 0.0406033 -0.0406033), wk = 0.0036630 k( 46) = ( 0.5000000 0.0487240 -0.0487240), wk = 0.0036630 k( 47) = ( 0.5000000 0.0568447 -0.0568447), wk = 0.0036630 k( 48) = ( 0.5000000 0.0649653 -0.0649653), wk = 0.0036630 k( 49) = ( 0.5000000 0.0730860 -0.0730860), wk = 0.0036630 k( 50) = ( 0.5000000 0.0812067 -0.0812067), wk = 0.0036630 k( 51) = ( 0.5000000 0.0893273 -0.0893273), wk = 0.0036630 k( 52) = ( 0.5000000 0.0974480 -0.0974480), wk = 0.0036630 k( 53) = ( 0.5000000 0.1055687 -0.1055687), wk = 0.0036630 k( 54) = ( 0.5000000 0.1136893 -0.1136893), wk = 0.0036630 k( 55) = ( 0.5000000 0.1218100 -0.1218100), wk = 0.0036630 k( 56) = ( 0.5000000 0.1299307 -0.1299307), wk = 0.0036630 k( 57) = ( 0.5000000 0.1380513 -0.1380513), wk = 0.0036630 k( 58) = ( 0.5000000 0.1461720 -0.1461720), wk = 0.0036630 k( 59) = ( 0.5000000 0.1542927 -0.1542927), wk = 0.0036630 k( 60) = ( 0.5000000 0.1624134 -0.1624133), wk = 0.0036630 k( 61) = ( 0.5000000 0.1705340 -0.1705340), wk = 0.0036630 k( 62) = ( 0.5000000 0.1786547 -0.1786547), wk = 0.0036630 k( 63) = ( 0.5000000 0.1867754 -0.1867754), wk = 0.0036630 k( 64) = ( 0.5000000 0.1948960 -0.1948960), wk = 0.0036630 k( 65) = ( 0.5000000 0.2030167 -0.2030167), wk = 0.0036630 k( 66) = ( 0.5000000 0.2111374 -0.2111374), wk = 0.0036630 k( 67) = ( 0.5000000 0.2192580 -0.2192580), wk = 0.0036630 k( 68) = ( 0.5000000 0.2273787 -0.2273787), wk = 0.0036630 k( 69) = ( 0.5000000 0.2354993 -0.2354993), wk = 0.0036630 k( 70) = ( 0.7645007 0.5000000 0.2354994), wk = 0.0036630 k( 71) = ( 0.7564855 0.5000000 0.2435145), wk = 0.0036630 k( 72) = ( 0.7484703 0.5000000 0.2515297), wk = 0.0036630 k( 73) = ( 0.7404551 0.5000000 0.2595449), wk = 0.0036630 k( 74) = ( 0.7324400 0.5000000 0.2675600), wk = 0.0036630 k( 75) = ( 0.7244248 0.5000000 0.2755752), wk = 0.0036630 k( 76) = ( 0.7164096 0.5000000 0.2835904), wk = 0.0036630 k( 77) = ( 0.7083945 0.5000000 0.2916056), wk = 0.0036630 k( 78) = ( 0.7003793 0.5000000 0.2996207), wk = 0.0036630 k( 79) = ( 0.6923641 0.5000000 0.3076359), wk = 0.0036630 k( 80) = ( 0.6843489 0.5000000 0.3156511), wk = 0.0036630 k( 81) = ( 0.6763338 0.5000000 0.3236662), wk = 0.0036630 k( 82) = ( 0.6683186 0.5000000 0.3316814), wk = 0.0036630 k( 83) = ( 0.6603034 0.5000000 0.3396966), wk = 0.0036630 k( 84) = ( 0.6522883 0.5000000 0.3477117), wk = 0.0036630 k( 85) = ( 0.6442731 0.5000000 0.3557269), wk = 0.0036630 k( 86) = ( 0.6362579 0.5000000 0.3637421), wk = 0.0036630 k( 87) = ( 0.6282427 0.5000000 0.3717573), wk = 0.0036630 k( 88) = ( 0.6202276 0.5000000 0.3797724), wk = 0.0036630 k( 89) = ( 0.6122124 0.5000000 0.3877876), wk = 0.0036630 k( 90) = ( 0.6041972 0.5000000 0.3958028), wk = 0.0036630 k( 91) = ( 0.5961821 0.5000000 0.4038180), wk = 0.0036630 k( 92) = ( 0.5881669 0.5000000 0.4118331), wk = 0.0036630 k( 93) = ( 0.5801517 0.5000000 0.4198483), wk = 0.0036630 k( 94) = ( 0.5721365 0.5000000 0.4278635), wk = 0.0036630 k( 95) = ( 0.5641214 0.5000000 0.4358786), wk = 0.0036630 k( 96) = ( 0.5561062 0.5000000 0.4438938), wk = 0.0036630 k( 97) = ( 0.5480910 0.5000000 0.4519090), wk = 0.0036630 k( 98) = ( 0.5400759 0.5000000 0.4599241), wk = 0.0036630 k( 99) = ( 0.5320607 0.5000000 0.4679393), wk = 0.0036630 k( 100) = ( 0.5240455 0.5000000 0.4759545), wk = 0.0036630 k( 101) = ( 0.5160303 0.5000000 0.4839697), wk = 0.0036630 k( 102) = ( 0.5080152 0.5000000 0.4919848), wk = 0.0036630 k( 103) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036630 k( 104) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036630 k( 105) = ( 0.4857143 0.4857143 0.4857143), wk = 0.0036630 k( 106) = ( 0.4714286 0.4714286 0.4714286), wk = 0.0036630 k( 107) = ( 0.4571429 0.4571429 0.4571429), wk = 0.0036630 k( 108) = ( 0.4428571 0.4428571 0.4428571), wk = 0.0036630 k( 109) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0036630 k( 110) = ( 0.4142857 0.4142857 0.4142857), wk = 0.0036630 k( 111) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0036630 k( 112) = ( 0.3857143 0.3857143 0.3857143), wk = 0.0036630 k( 113) = ( 0.3714286 0.3714286 0.3714286), wk = 0.0036630 k( 114) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0036630 k( 115) = ( 0.3428571 0.3428571 0.3428571), wk = 0.0036630 k( 116) = ( 0.3285714 0.3285714 0.3285714), wk = 0.0036630 k( 117) = ( 0.3142857 0.3142857 0.3142857), wk = 0.0036630 k( 118) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0036630 k( 119) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0036630 k( 120) = ( 0.2714286 0.2714286 0.2714286), wk = 0.0036630 k( 121) = ( 0.2571429 0.2571429 0.2571429), wk = 0.0036630 k( 122) = ( 0.2428571 0.2428571 0.2428571), wk = 0.0036630 k( 123) = ( 0.2285714 0.2285714 0.2285714), wk = 0.0036630 k( 124) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0036630 k( 125) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0036630 k( 126) = ( 0.1857143 0.1857143 0.1857143), wk = 0.0036630 k( 127) = ( 0.1714286 0.1714286 0.1714286), wk = 0.0036630 k( 128) = ( 0.1571429 0.1571429 0.1571429), wk = 0.0036630 k( 129) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0036630 k( 130) = ( 0.1285714 0.1285714 0.1285714), wk = 0.0036630 k( 131) = ( 0.1142857 0.1142857 0.1142857), wk = 0.0036630 k( 132) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0036630 k( 133) = ( 0.0857143 0.0857143 0.0857143), wk = 0.0036630 k( 134) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0036630 k( 135) = ( 0.0571429 0.0571429 0.0571429), wk = 0.0036630 k( 136) = ( 0.0428571 0.0428571 0.0428571), wk = 0.0036630 k( 137) = ( 0.0285714 0.0285714 0.0285714), wk = 0.0036630 k( 138) = ( 0.0142857 0.0142857 0.0142857), wk = 0.0036630 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 141) = ( 0.0081722 -0.0000000 -0.0081722), wk = 0.0036630 k( 142) = ( 0.0163444 -0.0000000 -0.0163444), wk = 0.0036630 k( 143) = ( 0.0245167 -0.0000000 -0.0245166), wk = 0.0036630 k( 144) = ( 0.0326889 -0.0000000 -0.0326889), wk = 0.0036630 k( 145) = ( 0.0408611 0.0000000 -0.0408611), wk = 0.0036630 k( 146) = ( 0.0490333 -0.0000000 -0.0490333), wk = 0.0036630 k( 147) = ( 0.0572055 0.0000000 -0.0572055), wk = 0.0036630 k( 148) = ( 0.0653777 -0.0000000 -0.0653777), wk = 0.0036630 k( 149) = ( 0.0735499 -0.0000000 -0.0735499), wk = 0.0036630 k( 150) = ( 0.0817221 0.0000000 -0.0817221), wk = 0.0036630 k( 151) = ( 0.0898944 -0.0000000 -0.0898944), wk = 0.0036630 k( 152) = ( 0.0980666 -0.0000000 -0.0980666), wk = 0.0036630 k( 153) = ( 0.1062388 -0.0000000 -0.1062388), wk = 0.0036630 k( 154) = ( 0.1144110 -0.0000000 -0.1144110), wk = 0.0036630 k( 155) = ( 0.1225832 -0.0000000 -0.1225832), wk = 0.0036630 k( 156) = ( 0.1307554 -0.0000000 -0.1307554), wk = 0.0036630 k( 157) = ( 0.1389277 0.0000000 -0.1389277), wk = 0.0036630 k( 158) = ( 0.1470999 -0.0000000 -0.1470999), wk = 0.0036630 k( 159) = ( 0.1552721 0.0000000 -0.1552721), wk = 0.0036630 k( 160) = ( 0.1634443 0.0000000 -0.1634443), wk = 0.0036630 k( 161) = ( 0.1716165 -0.0000000 -0.1716165), wk = 0.0036630 k( 162) = ( 0.1797887 -0.0000000 -0.1797887), wk = 0.0036630 k( 163) = ( 0.1879609 -0.0000000 -0.1879609), wk = 0.0036630 k( 164) = ( 0.1961332 -0.0000000 -0.1961332), wk = 0.0036630 k( 165) = ( 0.2043054 -0.0000000 -0.2043054), wk = 0.0036630 k( 166) = ( 0.2124776 -0.0000000 -0.2124776), wk = 0.0036630 k( 167) = ( 0.2206498 -0.0000000 -0.2206498), wk = 0.0036630 k( 168) = ( 0.2288220 -0.0000000 -0.2288220), wk = 0.0036630 k( 169) = ( 0.2369942 0.0000000 -0.2369942), wk = 0.0036630 k( 170) = ( 0.2451665 0.0000000 -0.2451664), wk = 0.0036630 k( 171) = ( 0.2533387 0.0000000 -0.2533387), wk = 0.0036630 k( 172) = ( 0.2615109 -0.0000000 -0.2615109), wk = 0.0036630 k( 173) = ( 0.2696831 0.0000000 -0.2696831), wk = 0.0036630 k( 174) = ( 0.2778553 -0.0000000 -0.2778553), wk = 0.0036630 k( 175) = ( 0.2860275 -0.0000000 -0.2860275), wk = 0.0036630 k( 176) = ( 0.2941997 -0.0000000 -0.2941997), wk = 0.0036630 k( 177) = ( 0.3023720 -0.0000000 -0.3023720), wk = 0.0036630 k( 178) = ( 0.3105442 0.0000000 -0.3105442), wk = 0.0036630 k( 179) = ( 0.3187164 -0.0000000 -0.3187164), wk = 0.0036630 k( 180) = ( 0.3268886 0.0000000 -0.3268886), wk = 0.0036630 k( 181) = ( 0.3350608 -0.0000000 -0.3350608), wk = 0.0036630 k( 182) = ( 0.3432330 -0.0000000 -0.3432330), wk = 0.0036630 k( 183) = ( 0.3514053 0.0000000 -0.3514053), wk = 0.0036630 k( 184) = ( 0.3595775 -0.0000000 -0.3595775), wk = 0.0036630 k( 185) = ( 0.3677497 0.0000000 -0.3677497), wk = 0.0036630 k( 186) = ( 0.6322503 0.3677497 0.0000000), wk = 0.0036630 k( 187) = ( 0.6244709 0.3755291 -0.0000000), wk = 0.0036630 k( 188) = ( 0.6166915 0.3833085 0.0000000), wk = 0.0036630 k( 189) = ( 0.6089120 0.3910880 0.0000000), wk = 0.0036630 k( 190) = ( 0.6011326 0.3988674 0.0000000), wk = 0.0036630 k( 191) = ( 0.5933532 0.4066468 0.0000000), wk = 0.0036630 k( 192) = ( 0.5855737 0.4144263 -0.0000000), wk = 0.0036630 k( 193) = ( 0.5777943 0.4222057 0.0000000), wk = 0.0036630 k( 194) = ( 0.5700149 0.4299851 -0.0000000), wk = 0.0036630 k( 195) = ( 0.5622354 0.4377645 -0.0000000), wk = 0.0036630 k( 196) = ( 0.5544560 0.4455440 0.0000000), wk = 0.0036630 k( 197) = ( 0.5466766 0.4533234 -0.0000000), wk = 0.0036630 k( 198) = ( 0.5388972 0.4611028 -0.0000000), wk = 0.0036630 k( 199) = ( 0.5311177 0.4688823 0.0000000), wk = 0.0036630 k( 200) = ( 0.5233383 0.4766617 0.0000000), wk = 0.0036630 k( 201) = ( 0.5155589 0.4844411 -0.0000000), wk = 0.0036630 k( 202) = ( 0.5077794 0.4922206 -0.0000000), wk = 0.0036630 k( 203) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0036630 k( 204) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0036630 k( 205) = ( 0.5094464 0.5094464 0.0168214), wk = 0.0036630 k( 206) = ( 0.5188929 0.5188929 0.0336428), wk = 0.0036630 k( 207) = ( 0.5283393 0.5283393 0.0504641), wk = 0.0036630 k( 208) = ( 0.5377858 0.5377858 0.0672855), wk = 0.0036630 k( 209) = ( 0.5472323 0.5472323 0.0841069), wk = 0.0036630 k( 210) = ( 0.5566787 0.5566787 0.1009283), wk = 0.0036630 k( 211) = ( 0.5661252 0.5661252 0.1177497), wk = 0.0036630 k( 212) = ( 0.5755716 0.5755716 0.1345711), wk = 0.0036630 k( 213) = ( 0.5850181 0.5850181 0.1513924), wk = 0.0036630 k( 214) = ( 0.5944645 0.5944645 0.1682138), wk = 0.0036630 k( 215) = ( 0.6039110 0.6039110 0.1850352), wk = 0.0036630 k( 216) = ( 0.6133574 0.6133574 0.2018566), wk = 0.0036630 k( 217) = ( 0.6228039 0.6228039 0.2186780), wk = 0.0036630 k( 218) = ( 0.6322503 0.6322503 0.2354994), wk = 0.0036630 k( 219) = ( 0.6322503 0.6322503 0.2354994), wk = 0.0036630 k( 220) = ( 0.6276900 0.6276900 0.2446201), wk = 0.0036630 k( 221) = ( 0.6231296 0.6231296 0.2537408), wk = 0.0036630 k( 222) = ( 0.6185692 0.6185692 0.2628615), wk = 0.0036630 k( 223) = ( 0.6140089 0.6140089 0.2719822), wk = 0.0036630 k( 224) = ( 0.6094485 0.6094485 0.2811029), wk = 0.0036630 k( 225) = ( 0.6048882 0.6048882 0.2902236), wk = 0.0036630 k( 226) = ( 0.6003278 0.6003278 0.2993443), wk = 0.0036630 k( 227) = ( 0.5957675 0.5957675 0.3084651), wk = 0.0036630 k( 228) = ( 0.5912071 0.5912071 0.3175858), wk = 0.0036630 k( 229) = ( 0.5866468 0.5866468 0.3267065), wk = 0.0036630 k( 230) = ( 0.5820864 0.5820864 0.3358272), wk = 0.0036630 k( 231) = ( 0.5775261 0.5775261 0.3449479), wk = 0.0036630 k( 232) = ( 0.5729657 0.5729657 0.3540686), wk = 0.0036630 k( 233) = ( 0.5684053 0.5684053 0.3631893), wk = 0.0036630 k( 234) = ( 0.5638450 0.5638450 0.3723100), wk = 0.0036630 k( 235) = ( 0.5592846 0.5592846 0.3814308), wk = 0.0036630 k( 236) = ( 0.5547243 0.5547243 0.3905515), wk = 0.0036630 k( 237) = ( 0.5501639 0.5501639 0.3996722), wk = 0.0036630 k( 238) = ( 0.5456036 0.5456036 0.4087929), wk = 0.0036630 k( 239) = ( 0.5410432 0.5410432 0.4179136), wk = 0.0036630 k( 240) = ( 0.5364828 0.5364828 0.4270343), wk = 0.0036630 k( 241) = ( 0.5319225 0.5319225 0.4361550), wk = 0.0036630 k( 242) = ( 0.5273621 0.5273621 0.4452757), wk = 0.0036630 k( 243) = ( 0.5228018 0.5228018 0.4543964), wk = 0.0036630 k( 244) = ( 0.5182414 0.5182414 0.4635171), wk = 0.0036630 k( 245) = ( 0.5136811 0.5136811 0.4726379), wk = 0.0036630 k( 246) = ( 0.5091207 0.5091207 0.4817586), wk = 0.0036630 k( 247) = ( 0.5045604 0.5045604 0.4908793), wk = 0.0036630 k( 248) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036630 k( 249) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0036630 k( 250) = ( 0.5110209 0.0153229 0.0153229), wk = 0.0036630 k( 251) = ( 0.5220417 0.0306458 0.0306458), wk = 0.0036630 k( 252) = ( 0.5330626 0.0459687 0.0459687), wk = 0.0036630 k( 253) = ( 0.5440834 0.0612916 0.0612916), wk = 0.0036630 k( 254) = ( 0.5551043 0.0766145 0.0766145), wk = 0.0036630 k( 255) = ( 0.5661252 0.0919374 0.0919374), wk = 0.0036630 k( 256) = ( 0.5771460 0.1072603 0.1072603), wk = 0.0036630 k( 257) = ( 0.5881669 0.1225832 0.1225832), wk = 0.0036630 k( 258) = ( 0.5991877 0.1379061 0.1379061), wk = 0.0036630 k( 259) = ( 0.6102086 0.1532290 0.1532290), wk = 0.0036630 k( 260) = ( 0.6212295 0.1685519 0.1685519), wk = 0.0036630 k( 261) = ( 0.6322503 0.1838748 0.1838748), wk = 0.0036630 k( 262) = ( 0.6432712 0.1991977 0.1991977), wk = 0.0036630 k( 263) = ( 0.6542920 0.2145206 0.2145206), wk = 0.0036630 k( 264) = ( 0.6653129 0.2298435 0.2298435), wk = 0.0036630 k( 265) = ( 0.6763338 0.2451665 0.2451665), wk = 0.0036630 k( 266) = ( 0.6873546 0.2604894 0.2604894), wk = 0.0036630 k( 267) = ( 0.6983755 0.2758123 0.2758123), wk = 0.0036630 k( 268) = ( 0.7093963 0.2911352 0.2911352), wk = 0.0036630 k( 269) = ( 0.7204172 0.3064581 0.3064581), wk = 0.0036630 k( 270) = ( 0.7314381 0.3217810 0.3217810), wk = 0.0036630 k( 271) = ( 0.7424589 0.3371039 0.3371039), wk = 0.0036630 k( 272) = ( 0.7534798 0.3524268 0.3524268), wk = 0.0036630 k( 273) = ( 0.7645007 0.3677497 0.3677497), wk = 0.0036630 Dense grid: 100197 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.69 Mb ( 552, 82) NL pseudopotentials 0.76 Mb ( 276, 180) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2089) G-vector shells 0.01 Mb ( 1725) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.76 Mb ( 552, 328) Each subspace H/S matrix 1.64 Mb ( 328, 328) Each matrix 0.45 Mb ( 180, 2, 82) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./LiNbO3.save/charge-density.dat Starting wfc are 120 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 45.1 secs Computing kpt #: 2 total cpu time spent up to now is 53.1 secs Computing kpt #: 3 total cpu time spent up to now is 60.3 secs Computing kpt #: 4 total cpu time spent up to now is 70.2 secs Computing kpt #: 5 total cpu time spent up to now is 78.9 secs Computing kpt #: 6 total cpu time spent up to now is 87.2 secs Computing kpt #: 7 total cpu time spent up to now is 96.0 secs Computing kpt #: 8 total cpu time spent up to now is 104.1 secs Computing kpt #: 9 total cpu time spent up to now is 112.3 secs Computing kpt #: 10 total cpu time spent up to now is 121.0 secs Computing kpt #: 11 total cpu time spent up to now is 129.6 secs Computing kpt #: 12 total cpu time spent up to now is 138.7 secs Computing kpt #: 13 total cpu time spent up to now is 151.3 secs Computing kpt #: 14 total cpu time spent up to now is 163.2 secs Computing kpt #: 15 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 177.4 secs Computing kpt #: 16 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 191.7 secs Computing kpt #: 17 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 205.7 secs Computing kpt #: 18 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 220.2 secs Computing kpt #: 19 total cpu time spent up to now is 227.7 secs Computing kpt #: 20 total cpu time spent up to now is 235.1 secs Computing kpt #: 21 total cpu time spent up to now is 242.4 secs Computing kpt #: 22 total cpu time spent up to now is 249.7 secs Computing kpt #: 23 total cpu time spent up to now is 257.0 secs Computing kpt #: 24 total cpu time spent up to now is 267.9 secs Computing kpt #: 25 total cpu time spent up to now is 275.2 secs Computing kpt #: 26 total cpu time spent up to now is 282.4 secs Computing kpt #: 27 total cpu time spent up to now is 289.6 secs Computing kpt #: 28 total cpu time spent up to now is 298.5 secs Computing kpt #: 29 total cpu time spent up to now is 305.8 secs Computing kpt #: 30 total cpu time spent up to now is 315.9 secs Computing kpt #: 31 total cpu time spent up to now is 323.6 secs Computing kpt #: 32 total cpu time spent up to now is 335.0 secs Computing kpt #: 33 total cpu time spent up to now is 342.6 secs Computing kpt #: 34 total cpu time spent up to now is 353.1 secs Computing kpt #: 35 total cpu time spent up to now is 364.5 secs Computing kpt #: 36 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 381.2 secs Computing kpt #: 37 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 395.4 secs Computing kpt #: 38 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 409.4 secs Computing kpt #: 39 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 422.9 secs Computing kpt #: 40 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 436.4 secs Computing kpt #: 41 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 450.3 secs Computing kpt #: 42 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 464.4 secs Computing kpt #: 43 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 478.3 secs Computing kpt #: 44 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 492.1 secs Computing kpt #: 45 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 506.0 secs Computing kpt #: 46 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 520.1 secs Computing kpt #: 47 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 534.2 secs Computing kpt #: 48 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 548.2 secs Computing kpt #: 49 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 562.2 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 576.1 secs Computing kpt #: 51 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 589.9 secs Computing kpt #: 52 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 603.8 secs Computing kpt #: 53 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 618.0 secs Computing kpt #: 54 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 632.0 secs Computing kpt #: 55 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 646.0 secs Computing kpt #: 56 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 659.9 secs Computing kpt #: 57 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 674.6 secs Computing kpt #: 58 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 688.6 secs Computing kpt #: 59 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 702.5 secs Computing kpt #: 60 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 716.6 secs Computing kpt #: 61 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 730.6 secs Computing kpt #: 62 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 744.5 secs Computing kpt #: 63 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 758.4 secs Computing kpt #: 64 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 772.4 secs Computing kpt #: 65 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 786.3 secs Computing kpt #: 66 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 800.5 secs Computing kpt #: 67 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 815.2 secs Computing kpt #: 68 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 829.1 secs Computing kpt #: 69 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 843.0 secs Computing kpt #: 70 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 857.0 secs Computing kpt #: 71 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 871.2 secs Computing kpt #: 72 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 885.4 secs Computing kpt #: 73 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 899.6 secs Computing kpt #: 74 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 913.5 secs Computing kpt #: 75 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 927.4 secs Computing kpt #: 76 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 941.3 secs Computing kpt #: 77 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 955.2 secs Computing kpt #: 78 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 970.3 secs Computing kpt #: 79 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 985.6 secs Computing kpt #: 80 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 999.9 secs Computing kpt #: 81 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1013.7 secs Computing kpt #: 82 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1027.6 secs Computing kpt #: 83 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1041.6 secs Computing kpt #: 84 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1055.6 secs Computing kpt #: 85 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1069.8 secs Computing kpt #: 86 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1083.8 secs Computing kpt #: 87 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1097.9 secs Computing kpt #: 88 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1112.0 secs Computing kpt #: 89 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1126.2 secs Computing kpt #: 90 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1140.2 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1154.6 secs Computing kpt #: 92 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1168.7 secs Computing kpt #: 93 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1182.6 secs Computing kpt #: 94 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1196.5 secs Computing kpt #: 95 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1211.6 secs Computing kpt #: 96 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1225.8 secs Computing kpt #: 97 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1240.1 secs Computing kpt #: 98 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1254.1 secs Computing kpt #: 99 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1268.6 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1283.0 secs Computing kpt #: 101 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1297.0 secs Computing kpt #: 102 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1311.3 secs Computing kpt #: 103 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1325.0 secs Computing kpt #: 104 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1338.6 secs Computing kpt #: 105 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1352.3 secs Computing kpt #: 106 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1366.3 secs Computing kpt #: 107 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1380.8 secs Computing kpt #: 108 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1394.8 secs Computing kpt #: 109 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1409.0 secs Computing kpt #: 110 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1423.3 secs Computing kpt #: 111 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1437.3 secs Computing kpt #: 112 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1451.3 secs Computing kpt #: 113 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1465.3 secs Computing kpt #: 114 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1479.4 secs Computing kpt #: 115 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1493.6 secs Computing kpt #: 116 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1507.7 secs Computing kpt #: 117 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1521.5 secs Computing kpt #: 118 total cpu time spent up to now is 1529.3 secs Computing kpt #: 119 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1543.3 secs Computing kpt #: 120 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1557.3 secs Computing kpt #: 121 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1573.1 secs Computing kpt #: 122 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1587.2 secs Computing kpt #: 123 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1601.2 secs Computing kpt #: 124 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1615.4 secs Computing kpt #: 125 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1629.5 secs Computing kpt #: 126 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1643.6 secs Computing kpt #: 127 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1657.5 secs Computing kpt #: 128 total cpu time spent up to now is 1666.3 secs Computing kpt #: 129 total cpu time spent up to now is 1675.0 secs Computing kpt #: 130 total cpu time spent up to now is 1683.2 secs Computing kpt #: 131 total cpu time spent up to now is 1692.3 secs Computing kpt #: 132 total cpu time spent up to now is 1703.2 secs Computing kpt #: 133 total cpu time spent up to now is 1710.8 secs Computing kpt #: 134 total cpu time spent up to now is 1719.2 secs Computing kpt #: 135 total cpu time spent up to now is 1727.4 secs Computing kpt #: 136 total cpu time spent up to now is 1735.6 secs Computing kpt #: 137 total cpu time spent up to now is 1747.0 secs Computing kpt #: 138 total cpu time spent up to now is 1755.7 secs Computing kpt #: 139 total cpu time spent up to now is 1762.6 secs Computing kpt #: 140 total cpu time spent up to now is 1771.1 secs Computing kpt #: 141 total cpu time spent up to now is 1779.1 secs Computing kpt #: 142 total cpu time spent up to now is 1787.3 secs Computing kpt #: 143 total cpu time spent up to now is 1796.2 secs Computing kpt #: 144 total cpu time spent up to now is 1804.8 secs Computing kpt #: 145 total cpu time spent up to now is 1813.6 secs Computing kpt #: 146 total cpu time spent up to now is 1822.1 secs Computing kpt #: 147 total cpu time spent up to now is 1830.5 secs Computing kpt #: 148 total cpu time spent up to now is 1838.8 secs Computing kpt #: 149 total cpu time spent up to now is 1847.6 secs Computing kpt #: 150 total cpu time spent up to now is 1857.1 secs Computing kpt #: 151 total cpu time spent up to now is 1866.9 secs Computing kpt #: 152 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1882.7 secs Computing kpt #: 153 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1896.9 secs Computing kpt #: 154 total cpu time spent up to now is 1908.8 secs Computing kpt #: 155 total cpu time spent up to now is 1920.2 secs Computing kpt #: 156 total cpu time spent up to now is 1930.9 secs Computing kpt #: 157 total cpu time spent up to now is 1940.4 secs Computing kpt #: 158 total cpu time spent up to now is 1947.9 secs Computing kpt #: 159 total cpu time spent up to now is 1955.0 secs Computing kpt #: 160 total cpu time spent up to now is 1962.2 secs Computing kpt #: 161 total cpu time spent up to now is 1969.1 secs Computing kpt #: 162 total cpu time spent up to now is 1976.1 secs Computing kpt #: 163 total cpu time spent up to now is 1983.6 secs Computing kpt #: 164 total cpu time spent up to now is 1991.0 secs Computing kpt #: 165 total cpu time spent up to now is 1998.2 secs Computing kpt #: 166 total cpu time spent up to now is 2005.5 secs Computing kpt #: 167 total cpu time spent up to now is 2012.9 secs Computing kpt #: 168 total cpu time spent up to now is 2020.0 secs Computing kpt #: 169 total cpu time spent up to now is 2027.3 secs Computing kpt #: 170 total cpu time spent up to now is 2034.4 secs Computing kpt #: 171 total cpu time spent up to now is 2041.3 secs Computing kpt #: 172 total cpu time spent up to now is 2048.3 secs Computing kpt #: 173 total cpu time spent up to now is 2055.4 secs Computing kpt #: 174 total cpu time spent up to now is 2062.5 secs Computing kpt #: 175 total cpu time spent up to now is 2069.8 secs Computing kpt #: 176 total cpu time spent up to now is 2077.5 secs Computing kpt #: 177 total cpu time spent up to now is 2084.9 secs Computing kpt #: 178 total cpu time spent up to now is 2092.4 secs Computing kpt #: 179 total cpu time spent up to now is 2100.9 secs Computing kpt #: 180 total cpu time spent up to now is 2111.2 secs Computing kpt #: 181 total cpu time spent up to now is 2121.4 secs Computing kpt #: 182 total cpu time spent up to now is 2135.6 secs Computing kpt #: 183 total cpu time spent up to now is 2149.5 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2163.8 secs Computing kpt #: 185 total cpu time spent up to now is 2178.1 secs Computing kpt #: 186 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2192.0 secs Computing kpt #: 187 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2206.2 secs Computing kpt #: 188 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2220.5 secs Computing kpt #: 189 total cpu time spent up to now is 2227.9 secs Computing kpt #: 190 total cpu time spent up to now is 2235.5 secs Computing kpt #: 191 total cpu time spent up to now is 2243.1 secs Computing kpt #: 192 total cpu time spent up to now is 2250.5 secs Computing kpt #: 193 total cpu time spent up to now is 2258.1 secs Computing kpt #: 194 total cpu time spent up to now is 2265.2 secs Computing kpt #: 195 total cpu time spent up to now is 2272.3 secs Computing kpt #: 196 total cpu time spent up to now is 2280.0 secs Computing kpt #: 197 total cpu time spent up to now is 2287.4 secs Computing kpt #: 198 total cpu time spent up to now is 2294.9 secs Computing kpt #: 199 total cpu time spent up to now is 2302.1 secs Computing kpt #: 200 total cpu time spent up to now is 2309.5 secs Computing kpt #: 201 total cpu time spent up to now is 2316.7 secs Computing kpt #: 202 total cpu time spent up to now is 2323.9 secs Computing kpt #: 203 total cpu time spent up to now is 2330.9 secs Computing kpt #: 204 total cpu time spent up to now is 2337.9 secs Computing kpt #: 205 total cpu time spent up to now is 2345.2 secs Computing kpt #: 206 total cpu time spent up to now is 2352.3 secs Computing kpt #: 207 total cpu time spent up to now is 2359.7 secs Computing kpt #: 208 total cpu time spent up to now is 2366.8 secs Computing kpt #: 209 total cpu time spent up to now is 2374.0 secs Computing kpt #: 210 total cpu time spent up to now is 2381.4 secs Computing kpt #: 211 total cpu time spent up to now is 2388.6 secs Computing kpt #: 212 total cpu time spent up to now is 2395.9 secs Computing kpt #: 213 total cpu time spent up to now is 2403.4 secs Computing kpt #: 214 total cpu time spent up to now is 2411.0 secs Computing kpt #: 215 total cpu time spent up to now is 2418.9 secs Computing kpt #: 216 total cpu time spent up to now is 2426.5 secs Computing kpt #: 217 total cpu time spent up to now is 2434.4 secs Computing kpt #: 218 total cpu time spent up to now is 2441.7 secs Computing kpt #: 219 total cpu time spent up to now is 2452.5 secs Computing kpt #: 220 total cpu time spent up to now is 2459.9 secs Computing kpt #: 221 total cpu time spent up to now is 2467.9 secs Computing kpt #: 222 total cpu time spent up to now is 2477.1 secs Computing kpt #: 223 total cpu time spent up to now is 2484.9 secs Computing kpt #: 224 total cpu time spent up to now is 2495.0 secs Computing kpt #: 225 total cpu time spent up to now is 2505.3 secs Computing kpt #: 226 total cpu time spent up to now is 2512.6 secs Computing kpt #: 227 total cpu time spent up to now is 2520.4 secs Computing kpt #: 228 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2534.5 secs Computing kpt #: 229 total cpu time spent up to now is 2542.2 secs Computing kpt #: 230 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2556.4 secs Computing kpt #: 231 total cpu time spent up to now is 2564.2 secs Computing kpt #: 232 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2578.7 secs Computing kpt #: 233 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2593.1 secs Computing kpt #: 234 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2607.5 secs Computing kpt #: 235 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2622.3 secs Computing kpt #: 236 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2636.4 secs Computing kpt #: 237 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2650.5 secs Computing kpt #: 238 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2664.6 secs Computing kpt #: 239 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2679.0 secs Computing kpt #: 240 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2693.3 secs Computing kpt #: 241 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2707.4 secs Computing kpt #: 242 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2721.6 secs Computing kpt #: 243 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2735.8 secs Computing kpt #: 244 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2749.9 secs Computing kpt #: 245 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2764.2 secs Computing kpt #: 246 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2779.5 secs Computing kpt #: 247 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2793.6 secs Computing kpt #: 248 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2807.3 secs Computing kpt #: 249 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2821.2 secs Computing kpt #: 250 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2835.5 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2849.7 secs Computing kpt #: 252 total cpu time spent up to now is 2863.1 secs Computing kpt #: 253 total cpu time spent up to now is 2874.6 secs Computing kpt #: 254 total cpu time spent up to now is 2883.6 secs Computing kpt #: 255 total cpu time spent up to now is 2893.8 secs Computing kpt #: 256 total cpu time spent up to now is 2903.7 secs Computing kpt #: 257 total cpu time spent up to now is 2912.9 secs Computing kpt #: 258 total cpu time spent up to now is 2922.1 secs Computing kpt #: 259 total cpu time spent up to now is 2931.0 secs Computing kpt #: 260 total cpu time spent up to now is 2938.2 secs Computing kpt #: 261 total cpu time spent up to now is 2947.7 secs Computing kpt #: 262 total cpu time spent up to now is 2957.7 secs Computing kpt #: 263 total cpu time spent up to now is 2965.0 secs Computing kpt #: 264 total cpu time spent up to now is 2972.7 secs Computing kpt #: 265 total cpu time spent up to now is 2980.2 secs Computing kpt #: 266 total cpu time spent up to now is 2987.5 secs Computing kpt #: 267 total cpu time spent up to now is 2994.8 secs Computing kpt #: 268 total cpu time spent up to now is 3002.2 secs Computing kpt #: 269 total cpu time spent up to now is 3009.7 secs Computing kpt #: 270 total cpu time spent up to now is 3017.3 secs Computing kpt #: 271 total cpu time spent up to now is 3024.9 secs Computing kpt #: 272 total cpu time spent up to now is 3032.3 secs Computing kpt #: 273 total cpu time spent up to now is 3039.9 secs ethr = 1.47E-11, avg # of iterations = 77.2 total cpu time spent up to now is 3039.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 12581 PWs) bands (ev): -46.7124 -46.7124 -46.6964 -46.6964 -35.1726 -35.1726 -35.1698 -35.1698 -24.4374 -24.4374 -24.3046 -24.3046 -22.4447 -22.4447 -22.3834 -22.3834 -22.2619 -22.2619 -22.1833 -22.1833 -9.6090 -9.6090 -8.9524 -8.9524 -8.9359 -8.9359 -8.0507 -8.0507 -7.8359 -7.8359 -7.7429 -7.7429 2.9164 2.9164 2.9270 2.9270 3.1113 3.1113 3.1734 3.1734 3.1946 3.1946 4.1247 4.1247 5.2029 5.2029 5.3275 5.3275 5.3981 5.3981 6.1143 6.1143 6.4804 6.4804 6.4852 6.4852 6.6694 6.6694 6.6800 6.6800 6.6911 6.6911 6.8627 6.8627 7.3424 7.3424 7.3602 7.3602 10.9604 10.9604 10.9870 10.9870 11.4393 11.4393 12.5055 12.5055 12.5698 12.5698 12.7586 12.7586 14.7333 14.7333 k = 0.0132-0.0089-0.0061 ( 12585 PWs) bands (ev): -46.7124 -46.7124 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4377 -24.4371 -24.3049 -24.3044 -22.4447 -22.4447 -22.3838 -22.3829 -22.2620 -22.2620 -22.1838 -22.1830 -9.6086 -9.6080 -8.9527 -8.9513 -8.9355 -8.9355 -8.0540 -8.0482 -7.8389 -7.8342 -7.7436 -7.7436 2.9139 2.9169 2.9259 2.9267 3.1109 3.1157 3.1752 3.1756 3.1959 3.1971 4.1250 4.1250 5.1978 5.2047 5.3223 5.3287 5.3963 5.3965 6.1123 6.1148 6.4777 6.4809 6.4839 6.4851 6.6652 6.6664 6.6785 6.6785 6.6984 6.6992 6.8638 6.8640 7.3412 7.3416 7.3591 7.3592 10.9599 10.9613 10.9855 10.9897 11.4367 11.4405 12.5062 12.5066 12.5658 12.5754 12.7548 12.7611 14.7353 14.7356 k = 0.0263-0.0179-0.0123 ( 12575 PWs) bands (ev): -46.7124 -46.7124 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4378 -24.4366 -24.3054 -24.3043 -22.4445 -22.4445 -22.3840 -22.3822 -22.2622 -22.2622 -22.1845 -22.1829 -9.6067 -9.6057 -8.9523 -8.9494 -8.9343 -8.9342 -8.0582 -8.0467 -7.8431 -7.8338 -7.7457 -7.7456 2.9090 2.9158 2.9230 2.9259 3.1145 3.1233 3.1812 3.1814 3.2010 3.2035 4.1258 4.1258 5.1893 5.2028 5.3132 5.3259 5.3911 5.3913 6.1090 6.1140 6.4730 6.4777 6.4815 6.4852 6.6545 6.6558 6.6840 6.6847 6.7106 6.7116 6.8675 6.8679 7.3381 7.3390 7.3561 7.3562 10.9599 10.9627 10.9854 10.9939 11.4325 11.4402 12.5083 12.5095 12.5636 12.5825 12.7495 12.7623 14.7417 14.7423 k = 0.0395-0.0268-0.0184 ( 12573 PWs) bands (ev): -46.7124 -46.7124 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4378 -24.4361 -24.3059 -24.3044 -22.4441 -22.4441 -22.3840 -22.3813 -22.2627 -22.2627 -22.1854 -22.1829 -9.6035 -9.6019 -8.9511 -8.9468 -8.9322 -8.9322 -8.0632 -8.0460 -7.8486 -7.8346 -7.7491 -7.7490 2.9020 2.9124 2.9198 2.9252 3.1216 3.1328 3.1907 3.1916 3.2100 3.2138 4.1271 4.1273 5.1776 5.1972 5.3004 5.3190 5.3826 5.3826 6.1047 6.1121 6.4659 6.4714 6.4789 6.4856 6.6420 6.6432 6.6947 6.6959 6.7236 6.7248 6.8735 6.8742 7.3331 7.3344 7.3512 7.3513 10.9604 10.9645 10.9865 10.9993 11.4271 11.4388 12.5107 12.5140 12.5636 12.5910 12.7427 12.7625 14.7524 14.7534 k = 0.0526-0.0357-0.0245 ( 12563 PWs) bands (ev): -46.7123 -46.7123 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4377 -24.4354 -24.3066 -24.3045 -22.4437 -22.4437 -22.3838 -22.3803 -22.2633 -22.2633 -22.1864 -22.1831 -9.5988 -9.5968 -8.9491 -8.9434 -8.9293 -8.9292 -8.0692 -8.0462 -7.8554 -7.8367 -7.7539 -7.7537 2.8937 2.9062 2.9178 2.9248 3.1313 3.1434 3.2032 3.2062 3.2228 3.2280 4.1291 4.1293 5.1628 5.1876 5.2842 5.3080 5.3704 5.3708 6.0998 6.1094 6.4562 6.4626 6.4770 6.4862 6.6287 6.6302 6.7090 6.7104 6.7368 6.7382 6.8816 6.8824 7.3265 7.3280 7.3445 7.3447 10.9615 10.9666 10.9889 11.0060 11.4208 11.4367 12.5124 12.5198 12.5665 12.6010 12.7345 12.7619 14.7674 14.7688 k = 0.0658-0.0447-0.0306 ( 12570 PWs) bands (ev): -46.7123 -46.7123 -46.6966 -46.6966 -35.1725 -35.1725 -35.1698 -35.1698 -24.4375 -24.4346 -24.3074 -24.3048 -22.4431 -22.4431 -22.3835 -22.3791 -22.2641 -22.2641 -22.1876 -22.1835 -9.5928 -9.5902 -8.9464 -8.9394 -8.9256 -8.9255 -8.0759 -8.0473 -7.8635 -7.8400 -7.7600 -7.7597 2.8849 2.8984 2.9169 2.9247 3.1427 3.1544 3.2190 3.2248 3.2395 3.2459 4.1318 4.1319 5.1450 5.1739 5.2649 5.2927 5.3549 5.3559 6.0947 6.1065 6.4439 6.4515 6.4762 6.4873 6.6151 6.6172 6.7259 6.7273 6.7498 6.7514 6.8912 6.8921 7.3182 7.3199 7.3363 7.3364 10.9631 10.9688 10.9926 11.0136 11.4140 11.4343 12.5121 12.5262 12.5726 12.6123 12.7250 12.7609 14.7865 14.7883 k = 0.0789-0.0536-0.0368 ( 12569 PWs) bands (ev): -46.7122 -46.7122 -46.6967 -46.6967 -35.1725 -35.1725 -35.1699 -35.1699 -24.4372 -24.4338 -24.3083 -24.3052 -22.4423 -22.4423 -22.3831 -22.3778 -22.2650 -22.2650 -22.1890 -22.1841 -9.5854 -9.5824 -8.9429 -8.9346 -8.9211 -8.9209 -8.0836 -8.0493 -7.8728 -7.8445 -7.7674 -7.7669 2.8762 2.8902 2.9168 2.9252 3.1553 3.1660 3.2378 3.2467 3.2598 3.2672 4.1352 4.1353 5.1244 5.1559 5.2428 5.2730 5.3364 5.3380 6.0899 6.1039 6.4288 6.4379 6.4765 6.4891 6.6018 6.6049 6.7444 6.7458 6.7624 6.7644 6.9019 6.9028 7.3085 7.3101 7.3267 7.3269 10.9654 10.9709 10.9975 11.0220 11.4073 11.4322 12.5092 12.5326 12.5815 12.6247 12.7146 12.7599 14.8098 14.8120 k = 0.0921-0.0625-0.0429 ( 12573 PWs) bands (ev): -46.7121 -46.7121 -46.6968 -46.6968 -35.1725 -35.1725 -35.1699 -35.1699 -24.4368 -24.4328 -24.3094 -24.3057 -22.4415 -22.4414 -22.3824 -22.3763 -22.2661 -22.2661 -22.1905 -22.1848 -9.5766 -9.5731 -8.9386 -8.9290 -8.9157 -8.9155 -8.0921 -8.0522 -7.8834 -7.8503 -7.7762 -7.7754 2.8681 2.8823 2.9176 2.9265 3.1688 3.1782 3.2595 3.2714 3.2833 3.2915 4.1393 4.1395 5.1010 5.1334 5.2184 5.2489 5.3152 5.3171 6.0859 6.1020 6.4105 6.4213 6.4780 6.4920 6.5894 6.5938 6.7634 6.7651 6.7747 6.7773 6.9129 6.9137 7.2974 7.2988 7.3163 7.3166 10.9685 10.9730 11.0035 11.0307 11.4015 11.4311 12.5035 12.5381 12.5926 12.6381 12.7037 12.7590 14.8370 14.8396 k = 0.1053-0.0714-0.0490 ( 12573 PWs) bands (ev): -46.7120 -46.7120 -46.6969 -46.6969 -35.1725 -35.1725 -35.1699 -35.1699 -24.4363 -24.4317 -24.3105 -24.3063 -22.4405 -22.4404 -22.3816 -22.3747 -22.2674 -22.2674 -22.1922 -22.1857 -9.5665 -9.5625 -8.9336 -8.9228 -8.9096 -8.9093 -8.1014 -8.0559 -7.8952 -7.8572 -7.7863 -7.7851 2.8607 2.8750 2.9193 2.9287 3.1831 3.1912 3.2838 3.2985 3.3096 3.3187 4.1443 4.1444 5.0748 5.1063 5.1921 5.2207 5.2915 5.2935 6.0830 6.1010 6.3884 6.4011 6.4809 6.4960 6.5785 6.5844 6.7812 6.7835 6.7877 6.7913 6.9235 6.9239 7.2849 7.2860 7.3056 7.3062 10.9725 10.9749 11.0105 11.0393 11.3972 11.4316 12.4952 12.5416 12.6047 12.6520 12.6932 12.7588 14.8680 14.8710 k = 0.1184-0.0804-0.0552 ( 12577 PWs) bands (ev): -46.7119 -46.7119 -46.6970 -46.6970 -35.1725 -35.1725 -35.1699 -35.1699 -24.4357 -24.4306 -24.3117 -24.3071 -22.4393 -22.4393 -22.3806 -22.3729 -22.2689 -22.2689 -22.1941 -22.1868 -9.5550 -9.5506 -8.9278 -8.9159 -8.9027 -8.9022 -8.1115 -8.0606 -7.9082 -7.8653 -7.7976 -7.7959 2.8544 2.8687 2.9222 2.9319 3.1983 3.2052 3.3103 3.3280 3.3384 3.3485 4.1502 4.1503 5.0460 5.0747 5.1641 5.1887 5.2656 5.2674 6.0811 6.1011 6.3624 6.3768 6.4851 6.5012 6.5695 6.5770 6.7955 6.7966 6.8054 6.8082 6.9328 6.9330 7.2710 7.2719 7.2951 7.2963 10.9765 10.9776 11.0184 11.0473 11.3952 11.4341 12.4841 12.5421 12.6172 12.6648 12.6850 12.7592 14.9026 14.9061 k = 0.1316-0.0893-0.0613 ( 12569 PWs) bands (ev): -46.7118 -46.7118 -46.6971 -46.6971 -35.1725 -35.1725 -35.1699 -35.1699 -24.4350 -24.4293 -24.3131 -24.3079 -22.4381 -22.4380 -22.3795 -22.3710 -22.2705 -22.2705 -22.1961 -22.1880 -9.5422 -9.5374 -8.9213 -8.9082 -8.8950 -8.8944 -8.1225 -8.0661 -7.9224 -7.8746 -7.8101 -7.8079 2.8494 2.8636 2.9262 2.9363 3.2143 3.2202 3.3387 3.3595 3.3692 3.3806 4.1571 4.1571 5.0144 5.0388 5.1347 5.1537 5.2377 5.2391 6.0804 6.1023 6.3322 6.3484 6.4907 6.5077 6.5626 6.5713 6.8072 6.8078 6.8239 6.8264 6.9396 6.9406 7.2560 7.2568 7.2855 7.2877 10.9778 10.9837 11.0273 11.0544 11.3961 11.4391 12.4702 12.5384 12.6294 12.6694 12.6868 12.7605 14.9405 14.9446 k = 0.1447-0.0982-0.0674 ( 12572 PWs) bands (ev): -46.7116 -46.7116 -46.6972 -46.6972 -35.1725 -35.1724 -35.1700 -35.1700 -24.4341 -24.4280 -24.3145 -24.3089 -22.4367 -22.4366 -22.3782 -22.3689 -22.2723 -22.2722 -22.1982 -22.1895 -9.5281 -9.5229 -8.9140 -8.9000 -8.8866 -8.8858 -8.1343 -8.0726 -7.9378 -7.8850 -7.8239 -7.8209 2.8457 2.8598 2.9316 2.9419 3.2313 3.2362 3.3687 3.3928 3.4019 3.4150 4.1648 4.1650 4.9800 4.9990 5.1043 5.1164 5.2079 5.2088 6.0807 6.1042 6.2981 6.3157 6.4976 6.5155 6.5572 6.5670 6.8178 6.8185 6.8414 6.8440 6.9438 6.9458 7.2402 7.2409 7.2773 7.2809 10.9787 10.9911 11.0371 11.0602 11.4006 11.4470 12.4536 12.5296 12.6406 12.6661 12.6984 12.7624 14.9816 14.9862 k = 0.1579-0.1072-0.0735 ( 12572 PWs) bands (ev): -46.7115 -46.7115 -46.6974 -46.6974 -35.1724 -35.1724 -35.1700 -35.1700 -24.4332 -24.4265 -24.3161 -24.3100 -22.4352 -22.4351 -22.3767 -22.3667 -22.2742 -22.2742 -22.2006 -22.1911 -9.5127 -9.5071 -8.9060 -8.8910 -8.8774 -8.8764 -8.1469 -8.0799 -7.9542 -7.8965 -7.8387 -7.8350 2.8435 2.8574 2.9382 2.9488 3.2491 3.2533 3.4002 3.4276 3.4367 3.4514 4.1735 4.1739 4.9426 4.9555 5.0729 5.0778 5.1767 5.1770 6.0815 6.1066 6.2604 6.2791 6.5060 6.5246 6.5530 6.5634 6.8277 6.8287 6.8574 6.8601 6.9453 6.9484 7.2240 7.2249 7.2710 7.2762 10.9791 10.9997 11.0481 11.0647 11.4088 11.4578 12.4343 12.5158 12.6506 12.6635 12.7108 12.7647 15.0252 15.0302 k = 0.1711-0.1161-0.0797 ( 12581 PWs) bands (ev): -46.7113 -46.7113 -46.6976 -46.6976 -35.1724 -35.1724 -35.1700 -35.1700 -24.4322 -24.4250 -24.3178 -24.3111 -22.4336 -22.4334 -22.3751 -22.3643 -22.2763 -22.2762 -22.2030 -22.1928 -9.4961 -9.4901 -8.8973 -8.8814 -8.8674 -8.8663 -8.1602 -8.0882 -7.9717 -7.9091 -7.8546 -7.8500 2.8428 2.8567 2.9461 2.9570 3.2678 3.2713 3.4329 3.4633 3.4736 3.4899 4.1832 4.1838 4.9019 4.9090 5.0386 5.0406 5.1440 5.1441 6.0825 6.1087 6.2196 6.2391 6.5159 6.5343 6.5499 6.5596 6.8366 6.8383 6.8714 6.8742 6.9445 6.9486 7.2081 7.2090 7.2666 7.2736 10.9792 11.0094 11.0603 11.0680 11.4209 11.4717 12.4126 12.4976 12.6590 12.6622 12.7221 12.7671 15.0680 15.0700 k = 0.1842-0.1250-0.0858 ( 12587 PWs) bands (ev): -46.7111 -46.7111 -46.6977 -46.6977 -35.1724 -35.1724 -35.1701 -35.1701 -24.4310 -24.4234 -24.3195 -24.3124 -22.4318 -22.4316 -22.3733 -22.3618 -22.2785 -22.2784 -22.2056 -22.1947 -9.4782 -9.4720 -8.8879 -8.8712 -8.8568 -8.8554 -8.1744 -8.0975 -7.9902 -7.9228 -7.8714 -7.8660 2.8438 2.8575 2.9554 2.9665 3.2873 3.2902 3.4668 3.4996 3.5128 3.5301 4.1936 4.1946 4.8580 4.8597 4.9997 5.0078 5.1102 5.1108 6.0830 6.1093 6.1766 6.1958 6.5273 6.5389 6.5528 6.5550 6.8443 6.8468 6.8830 6.8857 6.9422 6.9472 7.1930 7.1940 7.2644 7.2731 10.9790 11.0201 11.0707 11.0739 11.4367 11.4886 12.3886 12.4758 12.6616 12.6655 12.7317 12.7689 15.0742 15.0920 k = 0.1974-0.1340-0.0919 ( 12577 PWs) bands (ev): -46.7109 -46.7109 -46.6979 -46.6979 -35.1724 -35.1724 -35.1701 -35.1701 -24.4298 -24.4217 -24.3214 -24.3138 -22.4299 -22.4297 -22.3713 -22.3592 -22.2809 -22.2808 -22.2083 -22.1968 -9.4591 -9.4526 -8.8778 -8.8604 -8.8454 -8.8438 -8.1893 -8.1078 -8.0095 -7.9375 -7.8892 -7.8828 2.8465 2.8601 2.9660 2.9774 3.3076 3.3100 3.5016 3.5366 3.5539 3.5721 4.2048 4.2062 4.8082 4.8109 4.9615 4.9745 5.0762 5.0770 6.0823 6.1030 6.1366 6.1499 6.5341 6.5396 6.5493 6.5650 6.8501 6.8536 6.8921 6.8945 6.9398 6.9454 7.1793 7.1804 7.2639 7.2742 10.9787 11.0311 11.0737 11.0889 11.4559 11.5082 12.3626 12.4512 12.6609 12.6702 12.7393 12.7699 15.0768 15.0958 k = 0.2105-0.1429-0.0981 ( 12571 PWs) bands (ev): -46.7107 -46.7107 -46.6981 -46.6981 -35.1723 -35.1723 -35.1701 -35.1701 -24.4284 -24.4199 -24.3233 -24.3153 -22.4279 -22.4277 -22.3692 -22.3565 -22.2834 -22.2832 -22.2112 -22.1990 -9.4388 -9.4321 -8.8670 -8.8489 -8.8334 -8.8316 -8.2050 -8.1191 -8.0296 -7.9534 -7.9078 -7.9005 2.8509 2.8644 2.9780 2.9897 3.3286 3.3305 3.5374 3.5743 3.5967 3.6155 4.2164 4.2183 4.7548 4.7609 4.9246 4.9410 5.0426 5.0435 6.0696 6.0788 6.1026 6.1194 6.5251 6.5377 6.5568 6.5804 6.8533 6.8579 6.8985 6.9003 6.9390 6.9447 7.1676 7.1687 7.2647 7.2765 10.9786 11.0412 11.0788 11.1054 11.4782 11.5302 12.3349 12.4246 12.6594 12.6728 12.7445 12.7696 15.0810 15.1011 k = 0.2237-0.1518-0.1042 ( 12571 PWs) bands (ev): -46.7105 -46.7105 -46.6983 -46.6983 -35.1723 -35.1723 -35.1702 -35.1702 -24.4270 -24.4180 -24.3253 -24.3169 -22.4258 -22.4255 -22.3670 -22.3536 -22.2861 -22.2858 -22.2142 -22.2014 -9.4174 -9.4105 -8.8555 -8.8369 -8.8208 -8.8186 -8.2214 -8.1317 -8.0503 -7.9703 -7.9270 -7.9188 2.8570 2.8706 2.9913 3.0032 3.3500 3.3516 3.5741 3.6126 3.6409 3.6603 4.2281 4.2307 4.7000 4.7084 4.8889 4.9073 5.0099 5.0108 6.0203 6.0475 6.0785 6.1131 6.5123 6.5250 6.5733 6.5978 6.8538 6.8594 6.9025 6.9035 6.9404 6.9464 7.1582 7.1592 7.2665 7.2794 10.9789 11.0487 11.0880 11.1234 11.5030 11.5546 12.3058 12.3963 12.6568 12.6732 12.7470 12.7675 15.0872 15.1085 k = 0.2368-0.1607-0.1103 ( 12570 PWs) bands (ev): -46.7103 -46.7103 -46.6985 -46.6985 -35.1723 -35.1723 -35.1702 -35.1702 -24.4255 -24.4161 -24.3274 -24.3186 -22.4236 -22.4232 -22.3646 -22.3506 -22.2888 -22.2886 -22.2173 -22.2039 -9.3949 -9.3879 -8.8434 -8.8244 -8.8075 -8.8050 -8.2385 -8.1457 -8.0713 -7.9883 -7.9469 -7.9379 2.8650 2.8785 3.0058 3.0181 3.3719 3.3732 3.6116 3.6517 3.6863 3.7062 4.2395 4.2428 4.6442 4.6540 4.8546 4.8738 4.9790 4.9797 5.9671 5.9953 6.0705 6.1057 6.4952 6.5077 6.5919 6.6170 6.8524 6.8586 6.9041 6.9045 6.9444 6.9511 7.1512 7.1520 7.2687 7.2826 10.9798 11.0533 11.1019 11.1427 11.5300 11.5808 12.2756 12.3669 12.6525 12.6715 12.7468 12.7634 15.0958 15.1181 k = 0.2500-0.1697-0.1164 ( 12580 PWs) bands (ev): -46.7101 -46.7101 -46.6988 -46.6988 -35.1722 -35.1722 -35.1702 -35.1702 -24.4239 -24.4140 -24.3296 -24.3204 -22.4213 -22.4209 -22.3621 -22.3475 -22.2917 -22.2914 -22.2205 -22.2065 -9.3712 -9.3642 -8.8306 -8.8114 -8.7936 -8.7909 -8.2564 -8.1613 -8.0923 -8.0074 -7.9672 -7.9577 2.8749 2.8883 3.0217 3.0343 3.3941 3.3952 3.6499 3.6914 3.7324 3.7530 4.2500 4.2541 4.5877 4.5983 4.8216 4.8405 4.9507 4.9511 5.9116 5.9406 6.0598 6.0952 6.4733 6.4855 6.6124 6.6378 6.8503 6.8568 6.9034 6.9036 6.9505 6.9582 7.1464 7.1470 7.2709 7.2857 10.9816 11.0564 11.1193 11.1634 11.5587 11.6087 12.2446 12.3367 12.6466 12.6676 12.7438 12.7570 15.1070 15.1302 k = 0.2632-0.1786-0.1226 ( 12572 PWs) bands (ev): -46.7098 -46.7098 -46.6990 -46.6990 -35.1722 -35.1722 -35.1703 -35.1703 -24.4222 -24.4119 -24.3318 -24.3223 -22.4188 -22.4184 -22.3595 -22.3443 -22.2947 -22.2944 -22.2239 -22.2093 -9.3466 -9.3396 -8.8173 -8.7979 -8.7792 -8.7761 -8.2748 -8.1787 -8.1130 -8.0275 -7.9879 -7.9780 2.8866 2.9000 3.0387 3.0516 3.4165 3.4175 3.6890 3.7319 3.7789 3.8002 4.2588 4.2639 4.5312 4.5417 4.7900 4.8077 4.9261 4.9261 5.8544 5.8842 6.0455 6.0808 6.4464 6.4584 6.6346 6.6602 6.8487 6.8552 6.9007 6.9016 6.9582 6.9672 7.1436 7.1438 7.2727 7.2882 10.9844 11.0594 11.1390 11.1852 11.5888 11.6380 12.2131 12.3062 12.6386 12.6614 12.7379 12.7482 15.1207 15.1449 k = 0.2763-0.1875-0.1287 ( 12569 PWs) bands (ev): -46.7096 -46.7096 -46.6992 -46.6992 -35.1722 -35.1722 -35.1703 -35.1703 -24.4204 -24.4098 -24.3342 -24.3242 -22.4162 -22.4157 -22.3567 -22.3410 -22.2978 -22.2974 -22.2273 -22.2122 -9.3210 -9.3140 -8.8033 -8.7839 -8.7643 -8.7607 -8.2940 -8.1981 -8.1331 -8.0487 -8.0089 -7.9988 2.9001 2.9135 3.0570 3.0702 3.4388 3.4398 3.7289 3.7730 3.8252 3.8473 4.2652 4.2713 4.4751 4.4850 4.7596 4.7757 4.9059 4.9062 5.7958 5.8264 6.0271 6.0622 6.4147 6.4265 6.6583 6.6839 6.8484 6.8545 6.8971 6.8988 6.9669 6.9772 7.1421 7.1421 7.2740 7.2900 10.9884 11.0629 11.1603 11.2079 11.6201 11.6685 12.1817 12.2756 12.6287 12.6529 12.7291 12.7369 15.1371 15.1622 k = 0.2895-0.1965-0.1348 ( 12573 PWs) bands (ev): -46.7093 -46.7093 -46.6995 -46.6995 -35.1721 -35.1721 -35.1704 -35.1704 -24.4185 -24.4076 -24.3365 -24.3262 -22.4136 -22.4130 -22.3538 -22.3377 -22.3010 -22.3006 -22.2308 -22.2152 -9.2944 -9.2876 -8.7888 -8.7697 -8.7490 -8.7448 -8.3136 -8.2195 -8.1525 -8.0708 -8.0300 -8.0201 2.9155 2.9290 3.0764 3.0899 3.4610 3.4620 3.7695 3.8148 3.8705 3.8937 4.2683 4.2753 4.4204 4.4290 4.7306 4.7447 4.8916 4.8922 5.7360 5.7675 6.0046 6.0393 6.3785 6.3902 6.6833 6.7088 6.8495 6.8552 6.8934 6.8960 6.9762 6.9876 7.1413 7.1415 7.2745 7.2910 10.9938 11.0673 11.1827 11.2312 11.6522 11.6998 12.1506 12.2455 12.6166 12.6421 12.7174 12.7231 15.1561 15.1820 k = 0.3026-0.2054-0.1410 ( 12577 PWs) bands (ev): -46.7091 -46.7091 -46.6998 -46.6998 -35.1721 -35.1721 -35.1704 -35.1704 -24.4165 -24.4053 -24.3390 -24.3283 -22.4108 -22.4102 -22.3508 -22.3342 -22.3042 -22.3038 -22.2344 -22.2184 -9.2669 -9.2603 -8.7738 -8.7551 -8.7334 -8.7285 -8.3338 -8.2429 -8.1712 -8.0937 -8.0514 -8.0418 2.9329 2.9463 3.0968 3.1107 3.4828 3.4840 3.8107 3.8573 3.9134 3.9383 4.2670 4.2748 4.3685 4.3750 4.7032 4.7152 4.8841 4.8848 5.6754 5.7078 5.9779 6.0120 6.3382 6.3498 6.7093 6.7347 6.8521 6.8571 6.8902 6.8937 6.9855 6.9981 7.1410 7.1414 7.2740 7.2908 11.0006 11.0729 11.2057 11.2547 11.6850 11.7318 12.1203 12.2162 12.6025 12.6292 12.7030 12.7070 15.1777 15.2044 k = 0.3158-0.2143-0.1471 ( 12575 PWs) bands (ev): -46.7088 -46.7088 -46.7000 -46.7000 -35.1720 -35.1720 -35.1705 -35.1705 -24.4145 -24.4029 -24.3415 -24.3305 -22.4079 -22.4073 -22.3476 -22.3306 -22.3076 -22.3071 -22.2381 -22.2216 -9.2385 -9.2323 -8.7584 -8.7404 -8.7175 -8.7117 -8.3544 -8.2678 -8.1893 -8.1173 -8.0730 -8.0639 2.9520 2.9655 3.1182 3.1325 3.5040 3.5055 3.8523 3.9002 3.9518 3.9792 4.2597 4.2680 4.3227 4.3262 4.6779 4.6877 4.8840 4.8848 5.6141 5.6474 5.9470 5.9806 6.2945 6.3061 6.7361 6.7613 6.8558 6.8603 6.8881 6.8924 6.9947 7.0084 7.1409 7.1415 7.2725 7.2896 11.0089 11.0798 11.2289 11.2780 11.7182 11.7644 12.0915 12.1881 12.5864 12.6140 12.6861 12.6885 15.2018 15.2292 k = 0.3289-0.2233-0.1532 ( 12578 PWs) bands (ev): -46.7085 -46.7085 -46.7003 -46.7003 -35.1720 -35.1720 -35.1705 -35.1705 -24.4124 -24.4005 -24.3440 -24.3328 -22.4050 -22.4043 -22.3444 -22.3270 -22.3111 -22.3105 -22.2419 -22.2250 -9.2094 -9.2036 -8.7426 -8.7256 -8.7014 -8.6944 -8.3752 -8.2938 -8.2071 -8.1415 -8.0947 -8.0863 2.9731 2.9865 3.1405 3.1551 3.5245 3.5264 3.8942 3.9434 3.9819 4.0128 4.2419 4.2515 4.2899 4.2901 4.6556 4.6630 4.8913 4.8921 5.5525 5.5867 5.9124 5.9454 6.2477 6.2593 6.7632 6.7883 6.8605 6.8643 6.8872 6.8923 7.0036 7.0183 7.1408 7.1413 7.2699 7.2872 11.0187 11.0881 11.2518 11.3003 11.7516 11.7972 12.0649 12.1619 12.5684 12.5967 12.6667 12.6679 15.2283 15.2563 k = 0.3421-0.2322-0.1593 ( 12577 PWs) bands (ev): -46.7082 -46.7082 -46.7006 -46.7006 -35.1719 -35.1719 -35.1706 -35.1706 -24.4102 -24.3981 -24.3466 -24.3351 -22.4019 -22.4012 -22.3410 -22.3233 -22.3146 -22.3140 -22.2457 -22.2284 -9.1794 -9.1742 -8.7266 -8.7111 -8.6854 -8.6768 -8.3959 -8.3206 -8.2246 -8.1662 -8.1166 -8.1089 2.9959 3.0093 3.1635 3.1785 3.5440 3.5463 3.9356 3.9858 3.9978 4.0326 4.2168 4.2306 4.2703 4.2711 4.6374 4.6422 4.9056 4.9066 5.4909 5.5260 5.8742 5.9067 6.1984 6.2101 6.7904 6.8154 6.8658 6.8691 6.8878 6.8938 7.0120 7.0275 7.1405 7.1409 7.2661 7.2835 11.0300 11.0978 11.2737 11.3210 11.7851 11.8302 12.0411 12.1380 12.5485 12.5773 12.6450 12.6454 15.2570 15.2855 k = 0.3553-0.2411-0.1655 ( 12579 PWs) bands (ev): -46.7079 -46.7079 -46.7009 -46.7009 -35.1719 -35.1719 -35.1706 -35.1706 -24.4079 -24.3956 -24.3493 -24.3375 -22.3988 -22.3980 -22.3376 -22.3196 -22.3182 -22.3175 -22.2497 -22.2320 -9.1488 -9.1442 -8.7106 -8.6969 -8.6697 -8.6590 -8.4162 -8.3475 -8.2421 -8.1911 -8.1386 -8.1317 3.0206 3.0339 3.1872 3.2026 3.5622 3.5650 3.9754 3.9911 4.0290 4.0292 4.2025 4.2202 4.2576 4.2585 4.6248 4.6266 4.9260 4.9275 5.4296 5.4656 5.8331 5.8652 6.1470 6.1589 6.8169 6.8419 6.8715 6.8744 6.8904 6.8970 7.0199 7.0360 7.1399 7.1402 7.2612 7.2787 11.0429 11.1089 11.2941 11.3393 11.8183 11.8630 12.0210 12.1172 12.5270 12.5560 12.6212 12.6214 15.2876 15.3166 k = 0.3684-0.2500-0.1716 ( 12583 PWs) bands (ev): -46.7076 -46.7076 -46.7012 -46.7012 -35.1718 -35.1718 -35.1707 -35.1707 -24.4056 -24.3930 -24.3519 -24.3399 -22.3955 -22.3948 -22.3340 -22.3218 -22.3212 -22.3156 -22.2536 -22.2356 -9.1176 -9.1137 -8.6952 -8.6837 -8.6544 -8.6409 -8.4354 -8.3740 -8.2595 -8.2162 -8.1607 -8.1546 3.0469 3.0602 3.2113 3.2271 3.5788 3.5821 3.9660 3.9982 4.0160 4.0679 4.2040 4.2224 4.2479 4.2513 4.6178 4.6193 4.9516 4.9539 5.3691 5.4060 5.7896 5.8214 6.0939 6.1061 6.8419 6.8659 6.8778 6.8800 6.8960 6.9025 7.0272 7.0438 7.1390 7.1390 7.2552 7.2726 11.0573 11.1214 11.3122 11.3543 11.8513 11.8955 12.0056 12.1001 12.5039 12.5329 12.5956 12.5961 15.3199 15.3493 k = 0.3816-0.2590-0.1777 ( 12581 PWs) bands (ev): -46.7073 -46.7073 -46.7015 -46.7015 -35.1718 -35.1718 -35.1708 -35.1707 -24.4032 -24.3905 -24.3547 -24.3424 -22.3922 -22.3914 -22.3304 -22.3255 -22.3249 -22.3117 -22.2576 -22.2393 -9.0858 -9.0828 -8.6812 -8.6720 -8.6397 -8.6227 -8.4525 -8.3992 -8.2769 -8.2413 -8.1830 -8.1776 3.0749 3.0881 3.2356 3.2517 3.5934 3.5973 3.9285 3.9592 4.0451 4.0998 4.2128 4.2290 4.2464 4.2493 4.6171 4.6222 4.9812 4.9847 5.3100 5.3478 5.7444 5.7761 6.0395 6.0521 6.8636 6.8799 6.8858 6.8870 6.9092 6.9117 7.0338 7.0507 7.1374 7.1378 7.2480 7.2654 11.0732 11.1351 11.3275 11.3651 11.8836 11.9270 11.9961 12.0874 12.4797 12.5081 12.5689 12.5693 15.3536 15.3833 k = 0.3947-0.2679-0.1839 ( 12581 PWs) bands (ev): -46.7070 -46.7070 -46.7018 -46.7018 -35.1717 -35.1717 -35.1708 -35.1708 -24.4007 -24.3879 -24.3574 -24.3449 -22.3888 -22.3880 -22.3292 -22.3285 -22.3267 -22.3077 -22.2617 -22.2431 -9.0535 -9.0515 -8.6704 -8.6629 -8.6253 -8.6045 -8.4660 -8.4221 -8.2943 -8.2663 -8.2053 -8.2006 3.1045 3.1175 3.2599 3.2762 3.6056 3.6101 3.8852 3.9129 4.0670 4.1186 4.2208 4.2326 4.2564 4.2602 4.6249 4.6334 5.0135 5.0185 5.2533 5.2918 5.6984 5.7301 5.9842 5.9972 6.8798 6.8862 6.8916 6.8951 6.9262 6.9311 7.0399 7.0566 7.1356 7.1363 7.2397 7.2569 11.0905 11.1501 11.3392 11.3711 11.9150 11.9561 11.9944 12.0797 12.4544 12.4819 12.5413 12.5414 15.3885 15.4184 k = 0.4079-0.2768-0.1900 ( 12575 PWs) bands (ev): -46.7067 -46.7067 -46.7021 -46.7021 -35.1717 -35.1717 -35.1709 -35.1709 -24.3982 -24.3852 -24.3601 -24.3475 -22.3854 -22.3845 -22.3330 -22.3323 -22.3229 -22.3038 -22.2658 -22.2469 -9.0209 -9.0200 -8.6656 -8.6580 -8.6103 -8.5864 -8.4743 -8.4410 -8.3115 -8.2910 -8.2275 -8.2234 3.1354 3.1482 3.2837 3.3001 3.6151 3.6200 3.8400 3.8650 4.0790 4.1236 4.2207 4.2312 4.2790 4.2899 4.6397 4.6509 5.0470 5.0542 5.2003 5.2392 5.6526 5.6847 5.9282 5.9419 6.8904 6.8916 6.8974 6.9011 6.9457 6.9551 7.0452 7.0617 7.1337 7.1348 7.2303 7.2473 11.1092 11.1661 11.3468 11.3718 11.9452 11.9778 12.0053 12.0775 12.4287 12.4548 12.5125 12.5134 15.4241 15.4541 k = 0.4211-0.2858-0.1961 ( 12583 PWs) bands (ev): -46.7063 -46.7063 -46.7024 -46.7024 -35.1716 -35.1716 -35.1709 -35.1709 -24.3957 -24.3825 -24.3629 -24.3501 -22.3819 -22.3810 -22.3368 -22.3360 -22.3190 -22.2997 -22.2699 -22.2508 -8.9883 -8.9878 -8.6687 -8.6591 -8.5939 -8.5684 -8.4763 -8.4542 -8.3284 -8.3152 -8.2497 -8.2461 3.1675 3.1799 3.3065 3.3228 3.6215 3.6268 3.7951 3.8178 4.0839 4.1214 4.2130 4.2245 4.3144 4.3301 4.6584 4.6711 5.0794 5.0899 5.1537 5.1918 5.6087 5.6416 5.8721 5.8866 6.8968 6.8977 6.9028 6.9063 6.9674 6.9788 7.0500 7.0659 7.1319 7.1333 7.2199 7.2366 11.1290 11.1832 11.3502 11.3673 11.9738 11.9915 12.0287 12.0806 12.4029 12.4273 12.4831 12.4853 15.4601 15.4901 k = 0.4342-0.2947-0.2022 ( 12596 PWs) bands (ev): -46.7060 -46.7060 -46.7028 -46.7028 -35.1716 -35.1716 -35.1710 -35.1710 -24.3931 -24.3799 -24.3657 -24.3527 -22.3783 -22.3774 -22.3406 -22.3398 -22.3151 -22.2957 -22.2741 -22.2548 -8.9565 -8.9546 -8.6799 -8.6675 -8.5759 -8.5508 -8.4724 -8.4607 -8.3445 -8.3385 -8.2718 -8.2684 3.2005 3.2123 3.3274 3.3433 3.6249 3.6301 3.7524 3.7726 4.0861 4.1177 4.2008 4.2135 4.3570 4.3756 4.6764 4.6887 5.1006 5.1223 5.1244 5.1531 5.5692 5.6030 5.8162 5.8317 6.9017 6.9034 6.9076 6.9107 6.9893 7.0010 7.0543 7.0692 7.1306 7.1322 7.2086 7.2248 11.1500 11.2010 11.3492 11.3580 12.0008 12.0062 12.0544 12.0883 12.3781 12.4004 12.4537 12.4573 15.4961 15.5260 k = 0.4474-0.3036-0.2084 ( 12589 PWs) bands (ev): -46.7057 -46.7057 -46.7031 -46.7031 -35.1715 -35.1715 -35.1710 -35.1710 -24.3905 -24.3771 -24.3685 -24.3554 -22.3747 -22.3738 -22.3444 -22.3436 -22.3111 -22.2916 -22.2782 -22.2588 -8.9248 -8.9213 -8.6975 -8.6832 -8.5568 -8.5334 -8.4644 -8.4612 -8.3604 -8.3592 -8.2936 -8.2903 3.2339 3.2449 3.3454 3.3602 3.6254 3.6301 3.7134 3.7307 4.0885 4.1157 4.1859 4.1996 4.4038 4.4237 4.6881 4.6976 5.0844 5.1216 5.1395 5.1530 5.5377 5.5724 5.7610 5.7779 6.9063 6.9081 6.9117 6.9143 7.0101 7.0211 7.0579 7.0716 7.1305 7.1317 7.1966 7.2121 11.1719 11.2193 11.3440 11.3444 12.0240 12.0261 12.0779 12.0989 12.3555 12.3755 12.4247 12.4299 15.5318 15.5613 k = 0.4605-0.3126-0.2145 ( 12589 PWs) bands (ev): -46.7054 -46.7054 -46.7034 -46.7034 -35.1715 -35.1715 -35.1711 -35.1711 -24.3878 -24.3744 -24.3713 -24.3581 -22.3710 -22.3701 -22.3483 -22.3474 -22.3071 -22.2875 -22.2824 -22.2628 -8.8932 -8.8880 -8.7197 -8.7049 -8.5369 -8.5163 -8.4585 -8.4558 -8.3788 -8.3710 -8.3149 -8.3114 3.2672 3.2767 3.3589 3.3716 3.6241 3.6277 3.6800 3.6937 4.0930 4.1167 4.1696 4.1842 4.4527 4.4725 4.6883 4.6926 5.0760 5.1082 5.1532 5.1695 5.5193 5.5541 5.7073 5.7258 6.9104 6.9120 6.9148 6.9169 7.0290 7.0380 7.0610 7.0728 7.1324 7.1325 7.1840 7.1986 11.1945 11.2380 11.3275 11.3352 12.0443 12.0499 12.0968 12.1095 12.3370 12.3548 12.3968 12.4037 15.5665 15.5956 k = 0.4737-0.3215-0.2206 ( 12588 PWs) bands (ev): -46.7051 -46.7051 -46.7037 -46.7037 -35.1714 -35.1714 -35.1712 -35.1712 -24.3851 -24.3741 -24.3717 -24.3608 -22.3673 -22.3664 -22.3521 -22.3512 -22.3031 -22.2865 -22.2833 -22.2669 -8.8620 -8.8549 -8.7450 -8.7309 -8.5166 -8.4999 -8.4571 -8.4526 -8.3891 -8.3772 -8.3356 -8.3315 3.2992 3.3066 3.3658 3.3750 3.6224 3.6243 3.6540 3.6634 4.1002 4.1213 4.1531 4.1686 4.5022 4.5210 4.6721 4.6744 5.0829 5.1096 5.1546 5.1725 5.5183 5.5516 5.6559 5.6766 6.9138 6.9150 6.9170 6.9184 7.0450 7.0507 7.0632 7.0727 7.1351 7.1373 7.1713 7.1846 11.2176 11.2567 11.3079 11.3233 12.0656 12.0721 12.1082 12.1163 12.3256 12.3412 12.3710 12.3795 15.5998 15.6283 k = 0.4868-0.3304-0.2268 ( 12590 PWs) bands (ev): -46.7047 -46.7047 -46.7041 -46.7041 -35.1713 -35.1713 -35.1712 -35.1712 -24.3824 -24.3769 -24.3689 -24.3635 -22.3635 -22.3626 -22.3559 -22.3550 -22.2990 -22.2907 -22.2792 -22.2710 -8.8313 -8.8222 -8.7724 -8.7597 -8.4964 -8.4844 -8.4610 -8.4606 -8.3858 -8.3750 -8.3552 -8.3497 3.3283 3.3328 3.3640 3.3686 3.6229 3.6229 3.6362 3.6415 4.1102 4.1293 4.1372 4.1537 4.5510 4.5677 4.6390 4.6474 5.1010 5.1231 5.1434 5.1619 5.5354 5.5657 5.6084 5.6318 6.9165 6.9171 6.9181 6.9188 7.0575 7.0589 7.0641 7.0707 7.1404 7.1458 7.1592 7.1706 11.2409 11.2750 11.2866 11.3089 12.0857 12.0918 12.1099 12.1159 12.3237 12.3373 12.3487 12.3587 15.6312 15.6589 k = 0.5000-0.3393-0.2329 ( 12592 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3796 -24.3796 -24.3662 -24.3662 -22.3597 -22.3597 -22.3588 -22.3588 -22.2948 -22.2948 -22.2751 -22.2751 -8.8013 -8.8013 -8.7904 -8.7904 -8.4770 -8.4770 -8.4708 -8.4708 -8.3727 -8.3727 -8.3650 -8.3650 3.3524 3.3524 3.3526 3.3526 3.6262 3.6262 3.6284 3.6284 4.1227 4.1227 4.1403 4.1403 4.5974 4.5974 4.6107 4.6107 5.1234 5.1234 5.1430 5.1430 5.5670 5.5670 5.5937 5.5937 6.9181 6.9181 6.9182 6.9182 7.0630 7.0630 7.0659 7.0659 7.1486 7.1486 7.1573 7.1573 11.2641 11.2641 11.2926 11.2926 12.1015 12.1015 12.1073 12.1073 12.3320 12.3320 12.3437 12.3437 15.6600 15.6600 k = 0.5000-0.3393-0.2329 ( 12592 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3796 -24.3796 -24.3662 -24.3662 -22.3597 -22.3597 -22.3588 -22.3588 -22.2948 -22.2948 -22.2751 -22.2751 -8.8013 -8.8013 -8.7904 -8.7904 -8.4770 -8.4770 -8.4708 -8.4708 -8.3727 -8.3727 -8.3650 -8.3650 3.3524 3.3524 3.3526 3.3526 3.6262 3.6262 3.6284 3.6284 4.1227 4.1227 4.1403 4.1403 4.5974 4.5974 4.6107 4.6107 5.1234 5.1234 5.1430 5.1430 5.5670 5.5670 5.5937 5.5937 6.9181 6.9181 6.9182 6.9182 7.0630 7.0630 7.0659 7.0659 7.1486 7.1486 7.1573 7.1573 11.2641 11.2641 11.2926 11.2926 12.1015 12.1015 12.1073 12.1073 12.3320 12.3320 12.3437 12.3437 15.6600 15.6600 k = 0.5000-0.3295-0.2472 ( 12602 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3796 -24.3796 -24.3662 -24.3662 -22.3604 -22.3604 -22.3584 -22.3584 -22.2947 -22.2947 -22.2749 -22.2749 -8.8025 -8.8025 -8.7911 -8.7911 -8.4787 -8.4787 -8.4706 -8.4706 -8.3716 -8.3716 -8.3624 -8.3624 3.3481 3.3481 3.3519 3.3519 3.6250 3.6250 3.6307 3.6307 4.1230 4.1230 4.1409 4.1409 4.5991 4.5991 4.6126 4.6126 5.1184 5.1184 5.1394 5.1394 5.5730 5.5730 5.6003 5.6003 6.9150 6.9150 6.9174 6.9174 7.0587 7.0587 7.0657 7.0657 7.1486 7.1486 7.1603 7.1603 11.2627 11.2627 11.2920 11.2920 12.0996 12.0996 12.1104 12.1104 12.3315 12.3315 12.3459 12.3459 15.6582 15.6588 k = 0.5000-0.3197-0.2615 ( 12606 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3797 -24.3797 -24.3662 -24.3662 -22.3616 -22.3616 -22.3580 -22.3580 -22.2944 -22.2944 -22.2744 -22.2744 -8.8060 -8.8060 -8.7932 -8.7932 -8.4827 -8.4827 -8.4710 -8.4710 -8.3677 -8.3676 -8.3555 -8.3555 3.3390 3.3390 3.3462 3.3462 3.6242 3.6242 3.6346 3.6346 4.1238 4.1238 4.1426 4.1426 4.6042 4.6042 4.6183 4.6183 5.1048 5.1048 5.1290 5.1290 5.5903 5.5903 5.6193 5.6193 6.9078 6.9078 6.9126 6.9126 7.0504 7.0504 7.0617 7.0617 7.1505 7.1505 7.1668 7.1668 11.2588 11.2588 11.2900 11.2900 12.0974 12.0974 12.1164 12.1164 12.3312 12.3312 12.3515 12.3515 15.6527 15.6527 k = 0.5000-0.3099-0.2758 ( 12604 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3798 -24.3798 -24.3662 -24.3662 -22.3631 -22.3631 -22.3579 -22.3579 -22.2939 -22.2938 -22.2735 -22.2735 -8.8114 -8.8114 -8.7970 -8.7970 -8.4876 -8.4876 -8.4725 -8.4725 -8.3607 -8.3607 -8.3456 -8.3455 3.3256 3.3256 3.3358 3.3358 3.6245 3.6245 3.6391 3.6391 4.1253 4.1253 4.1451 4.1451 4.6125 4.6125 4.6274 4.6275 5.0855 5.0855 5.1132 5.1133 5.6173 5.6173 5.6480 5.6480 6.8966 6.8966 6.9038 6.9038 7.0405 7.0405 7.0539 7.0539 7.1546 7.1546 7.1743 7.1743 11.2526 11.2526 11.2867 11.2868 12.0962 12.0962 12.1235 12.1235 12.3320 12.3320 12.3593 12.3593 15.6442 15.6461 k = 0.5000-0.3001-0.2901 ( 12588 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3799 -24.3799 -24.3662 -24.3662 -22.3647 -22.3647 -22.3580 -22.3580 -22.2931 -22.2931 -22.2724 -22.2724 -8.8186 -8.8186 -8.8024 -8.8023 -8.4926 -8.4926 -8.4749 -8.4749 -8.3511 -8.3511 -8.3334 -8.3334 3.3086 3.3086 3.3211 3.3211 3.6257 3.6257 3.6437 3.6437 4.1274 4.1274 4.1484 4.1484 4.6237 4.6237 4.6396 4.6396 5.0633 5.0633 5.0944 5.0944 5.6518 5.6518 5.6840 5.6840 6.8811 6.8811 6.8908 6.8908 7.0301 7.0301 7.0438 7.0438 7.1598 7.1598 7.1815 7.1815 11.2445 11.2445 11.2821 11.2821 12.0960 12.0960 12.1311 12.1311 12.3344 12.3344 12.3690 12.3690 15.6319 15.6343 k = 0.5000-0.2903-0.3044 ( 12594 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3800 -24.3800 -24.3661 -24.3661 -22.3665 -22.3665 -22.3585 -22.3585 -22.2921 -22.2921 -22.2710 -22.2710 -8.8273 -8.8272 -8.8093 -8.8092 -8.4975 -8.4974 -8.4777 -8.4777 -8.3394 -8.3394 -8.3196 -8.3196 3.2884 3.2884 3.3026 3.3027 3.6274 3.6274 3.6481 3.6481 4.1302 4.1302 4.1521 4.1522 4.6371 4.6371 4.6540 4.6540 5.0409 5.0409 5.0750 5.0750 5.6917 5.6917 5.7249 5.7249 6.8616 6.8616 6.8736 6.8736 7.0197 7.0197 7.0326 7.0326 7.1651 7.1651 7.1880 7.1880 11.2351 11.2351 11.2763 11.2763 12.0967 12.0967 12.1390 12.1390 12.3387 12.3387 12.3803 12.3803 15.6170 15.6170 k = 0.5000-0.2805-0.3187 ( 12594 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3802 -24.3802 -24.3661 -24.3661 -22.3683 -22.3683 -22.3592 -22.3592 -22.2909 -22.2909 -22.2693 -22.2693 -8.8370 -8.8370 -8.8176 -8.8175 -8.5019 -8.5019 -8.4806 -8.4806 -8.3262 -8.3262 -8.3046 -8.3046 3.2656 3.2656 3.2812 3.2812 3.6293 3.6293 3.6520 3.6520 4.1337 4.1337 4.1563 4.1563 4.6521 4.6521 4.6700 4.6700 5.0202 5.0202 5.0572 5.0572 5.7353 5.7353 5.7691 5.7691 6.8382 6.8382 6.8524 6.8524 7.0093 7.0093 7.0210 7.0210 7.1699 7.1699 7.1934 7.1934 11.2247 11.2247 11.2694 11.2694 12.0980 12.0980 12.1465 12.1465 12.3448 12.3448 12.3932 12.3932 15.6000 15.6000 k = 0.5000-0.2706-0.3330 ( 12596 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3804 -24.3804 -24.3661 -24.3661 -22.3703 -22.3703 -22.3601 -22.3601 -22.2895 -22.2895 -22.2676 -22.2676 -8.8478 -8.8478 -8.8271 -8.8271 -8.5059 -8.5059 -8.4834 -8.4834 -8.3119 -8.3119 -8.2886 -8.2886 3.2408 3.2408 3.2572 3.2572 3.6311 3.6311 3.6551 3.6551 4.1380 4.1380 4.1608 4.1608 4.6674 4.6674 4.6862 4.6862 5.0033 5.0033 5.0430 5.0430 5.7813 5.7813 5.8153 5.8153 6.8114 6.8114 6.8274 6.8274 6.9987 6.9987 7.0092 7.0092 7.1740 7.1740 7.1976 7.1977 11.2137 11.2137 11.2618 11.2618 12.0997 12.0998 12.1536 12.1536 12.3528 12.3528 12.4074 12.4074 15.5810 15.5810 k = 0.5000-0.2608-0.3473 ( 12596 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3806 -24.3806 -24.3661 -24.3661 -22.3723 -22.3723 -22.3613 -22.3613 -22.2880 -22.2880 -22.2656 -22.2656 -8.8592 -8.8592 -8.8376 -8.8376 -8.5093 -8.5093 -8.4861 -8.4861 -8.2968 -8.2968 -8.2721 -8.2721 3.2145 3.2146 3.2314 3.2314 3.6324 3.6324 3.6572 3.6572 4.1430 4.1430 4.1658 4.1658 4.6817 4.6817 4.7013 4.7013 4.9922 4.9922 5.0343 5.0343 5.8285 5.8286 5.8626 5.8626 6.7817 6.7817 6.7993 6.7993 6.9878 6.9878 6.9972 6.9972 7.1771 7.1771 7.2007 7.2007 11.2025 11.2025 11.2537 11.2537 12.1017 12.1017 12.1598 12.1598 12.3626 12.3626 12.4228 12.4228 15.5606 15.5606 k = 0.5000-0.2510-0.3616 ( 12596 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3808 -24.3808 -24.3660 -24.3660 -22.3744 -22.3744 -22.3626 -22.3626 -22.2863 -22.2863 -22.2636 -22.2636 -8.8712 -8.8712 -8.8490 -8.8489 -8.5123 -8.5123 -8.4884 -8.4884 -8.2811 -8.2811 -8.2551 -8.2551 3.1872 3.1872 3.2042 3.2042 3.6330 3.6331 3.6581 3.6581 4.1489 4.1489 4.1712 4.1712 4.6939 4.6939 4.7137 4.7137 4.9885 4.9885 5.0327 5.0327 5.8762 5.8762 5.9100 5.9100 6.7496 6.7496 6.7685 6.7685 6.9761 6.9761 6.9848 6.9848 7.1792 7.1792 7.2026 7.2026 11.1914 11.1914 11.2455 11.2455 12.1036 12.1036 12.1650 12.1650 12.3740 12.3740 12.4390 12.4390 15.5393 15.5402 k = 0.5000-0.2412-0.3759 ( 12590 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3810 -24.3810 -24.3660 -24.3660 -22.3764 -22.3764 -22.3641 -22.3641 -22.2846 -22.2846 -22.2615 -22.2615 -8.8835 -8.8835 -8.8609 -8.8609 -8.5149 -8.5149 -8.4905 -8.4905 -8.2651 -8.2651 -8.2379 -8.2379 3.1591 3.1591 3.1761 3.1761 3.6328 3.6328 3.6576 3.6576 4.1558 4.1558 4.1773 4.1773 4.7028 4.7028 4.7223 4.7223 4.9936 4.9936 5.0390 5.0390 5.9234 5.9234 5.9567 5.9568 6.7155 6.7156 6.7356 6.7356 6.9635 6.9635 6.9718 6.9719 7.1803 7.1803 7.2034 7.2034 11.1808 11.1808 11.2374 11.2374 12.1055 12.1055 12.1692 12.1692 12.3867 12.3867 12.4558 12.4558 15.5172 15.5172 k = 0.5000-0.2314-0.3902 ( 12582 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3813 -24.3813 -24.3660 -24.3660 -22.3785 -22.3785 -22.3656 -22.3656 -22.2827 -22.2827 -22.2594 -22.2594 -8.8960 -8.8960 -8.8733 -8.8733 -8.5171 -8.5170 -8.4924 -8.4924 -8.2490 -8.2490 -8.2207 -8.2207 3.1308 3.1308 3.1476 3.1476 3.6314 3.6314 3.6556 3.6557 4.1637 4.1637 4.1842 4.1842 4.7083 4.7083 4.7269 4.7269 5.0078 5.0078 5.0533 5.0533 5.9693 5.9694 6.0022 6.0022 6.6801 6.6801 6.7012 6.7012 6.9498 6.9498 6.9583 6.9583 7.1806 7.1806 7.2032 7.2032 11.1709 11.1709 11.2297 11.2297 12.1071 12.1071 12.1724 12.1724 12.4004 12.4004 12.4731 12.4731 15.4950 15.4950 k = 0.5000-0.2216-0.4045 ( 12588 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3815 -24.3815 -24.3659 -24.3659 -22.3805 -22.3805 -22.3673 -22.3673 -22.2808 -22.2808 -22.2573 -22.2573 -8.9086 -8.9086 -8.8859 -8.8859 -8.5189 -8.5189 -8.4940 -8.4939 -8.2328 -8.2328 -8.2036 -8.2035 3.1024 3.1024 3.1188 3.1188 3.6288 3.6288 3.6522 3.6522 4.1726 4.1726 4.1920 4.1920 4.7109 4.7109 4.7282 4.7282 5.0302 5.0302 5.0751 5.0751 6.0133 6.0133 6.0454 6.0454 6.6437 6.6437 6.6658 6.6658 6.9348 6.9349 6.9440 6.9440 7.1800 7.1800 7.2022 7.2022 11.1620 11.1620 11.2227 11.2227 12.1084 12.1084 12.1747 12.1747 12.4148 12.4148 12.4904 12.4904 15.4728 15.4729 k = 0.5000-0.2118-0.4188 ( 12590 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3818 -24.3818 -24.3659 -24.3659 -22.3825 -22.3825 -22.3689 -22.3689 -22.2789 -22.2789 -22.2552 -22.2552 -8.9210 -8.9210 -8.8986 -8.8986 -8.5204 -8.5204 -8.4953 -8.4953 -8.2168 -8.2168 -8.1866 -8.1866 3.0744 3.0744 3.0903 3.0903 3.6249 3.6249 3.6472 3.6472 4.1826 4.1826 4.2009 4.2009 4.7115 4.7115 4.7276 4.7276 5.0592 5.0592 5.1031 5.1031 6.0544 6.0544 6.0855 6.0855 6.6072 6.6072 6.6304 6.6304 6.9187 6.9188 6.9289 6.9289 7.1786 7.1786 7.2003 7.2003 11.1542 11.1542 11.2167 11.2167 12.1095 12.1095 12.1762 12.1762 12.4295 12.4295 12.5076 12.5076 15.4511 15.4511 k = 0.5000-0.2019-0.4331 ( 12586 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3820 -24.3820 -24.3659 -24.3659 -22.3844 -22.3844 -22.3706 -22.3706 -22.2769 -22.2769 -22.2531 -22.2531 -8.9333 -8.9333 -8.9112 -8.9112 -8.5217 -8.5217 -8.4964 -8.4964 -8.2011 -8.2011 -8.1700 -8.1700 3.0469 3.0469 3.0622 3.0622 3.6197 3.6197 3.6409 3.6409 4.1935 4.1935 4.2107 4.2107 4.7112 4.7113 4.7265 4.7265 5.0932 5.0932 5.1360 5.1360 6.0914 6.0914 6.1213 6.1213 6.5715 6.5715 6.5959 6.5959 6.9016 6.9016 6.9131 6.9131 7.1765 7.1765 7.1978 7.1978 11.1478 11.1478 11.2117 11.2117 12.1102 12.1102 12.1770 12.1770 12.4442 12.4442 12.5243 12.5243 15.4301 15.4301 k = 0.5000-0.1921-0.4474 ( 12582 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3823 -24.3823 -24.3659 -24.3659 -22.3862 -22.3862 -22.3723 -22.3723 -22.2750 -22.2750 -22.2510 -22.2510 -8.9453 -8.9453 -8.9237 -8.9237 -8.5227 -8.5227 -8.4974 -8.4974 -8.1857 -8.1857 -8.1539 -8.1539 3.0202 3.0202 3.0349 3.0349 3.6133 3.6133 3.6333 3.6333 4.2052 4.2052 4.2216 4.2216 4.7111 4.7111 4.7261 4.7261 5.1309 5.1309 5.1724 5.1725 6.1230 6.1230 6.1514 6.1514 6.5376 6.5376 6.5635 6.5635 6.8837 6.8837 6.8969 6.8969 7.1737 7.1737 7.1946 7.1946 11.1429 11.1429 11.2081 11.2081 12.1106 12.1106 12.1771 12.1771 12.4587 12.4587 12.5405 12.5405 15.4099 15.4099 k = 0.5000-0.1823-0.4617 ( 12582 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3826 -24.3826 -24.3659 -24.3659 -22.3880 -22.3880 -22.3740 -22.3740 -22.2731 -22.2731 -22.2491 -22.2491 -8.9570 -8.9570 -8.9359 -8.9359 -8.5236 -8.5236 -8.4982 -8.4982 -8.1708 -8.1708 -8.1383 -8.1383 2.9945 2.9945 3.0085 3.0085 3.6058 3.6058 3.6246 3.6246 4.2174 4.2174 4.2335 4.2335 4.7119 4.7119 4.7270 4.7270 5.1710 5.1710 5.2115 5.2115 6.1474 6.1474 6.1739 6.1739 6.5072 6.5072 6.5347 6.5347 6.8653 6.8654 6.8805 6.8805 7.1702 7.1703 7.1908 7.1908 11.1396 11.1396 11.2059 11.2059 12.1107 12.1107 12.1767 12.1768 12.4727 12.4727 12.5559 12.5559 15.3909 15.3909 k = 0.5000-0.1725-0.4760 ( 12576 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3828 -24.3828 -24.3659 -24.3659 -22.3897 -22.3897 -22.3757 -22.3756 -22.2713 -22.2713 -22.2472 -22.2472 -8.9682 -8.9682 -8.9477 -8.9477 -8.5243 -8.5243 -8.4988 -8.4988 -8.1565 -8.1565 -8.1233 -8.1233 2.9701 2.9701 2.9834 2.9834 3.5974 3.5974 3.6151 3.6151 4.2300 4.2300 4.2460 4.2460 4.7141 4.7141 4.7298 4.7298 5.2128 5.2128 5.2523 5.2523 6.1626 6.1626 6.1866 6.1866 6.4821 6.4821 6.5112 6.5112 6.8470 6.8471 6.8643 6.8643 7.1662 7.1662 7.1864 7.1864 11.1380 11.1381 11.2052 11.2052 12.1105 12.1105 12.1759 12.1759 12.4861 12.4861 12.5705 12.5705 15.3731 15.3732 k = 0.5000-0.1627-0.4903 ( 12564 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3830 -24.3830 -24.3658 -24.3658 -22.3912 -22.3912 -22.3772 -22.3772 -22.2695 -22.2695 -22.2454 -22.2454 -8.9789 -8.9789 -8.9591 -8.9590 -8.5249 -8.5249 -8.4994 -8.4994 -8.1428 -8.1428 -8.1090 -8.1090 2.9472 2.9472 2.9596 2.9596 3.5882 3.5882 3.6050 3.6050 4.2427 4.2427 4.2591 4.2591 4.7183 4.7183 4.7346 4.7346 5.2555 5.2555 5.2941 5.2941 6.1668 6.1668 6.1880 6.1880 6.4636 6.4636 6.4941 6.4941 6.8295 6.8295 6.8491 6.8491 7.1614 7.1614 7.1815 7.1815 11.1383 11.1383 11.2062 11.2062 12.1101 12.1101 12.1746 12.1746 12.4986 12.4986 12.5840 12.5840 15.3568 15.3568 k = 0.5000-0.1529-0.5046 ( 12560 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3833 -24.3833 -24.3658 -24.3658 -22.3927 -22.3927 -22.3788 -22.3788 -22.2678 -22.2678 -22.2437 -22.2437 -8.9891 -8.9891 -8.9699 -8.9699 -8.5254 -8.5254 -8.4998 -8.4998 -8.1299 -8.1299 -8.0956 -8.0956 2.9258 2.9258 2.9374 2.9374 3.5785 3.5785 3.5945 3.5946 4.2552 4.2552 4.2723 4.2723 4.7246 4.7246 4.7416 4.7416 5.2984 5.2984 5.3361 5.3361 6.1600 6.1600 6.1781 6.1781 6.4516 6.4516 6.4830 6.4830 6.8134 6.8134 6.8355 6.8355 7.1561 7.1561 7.1761 7.1761 11.1403 11.1403 11.2088 11.2088 12.1095 12.1095 12.1730 12.1730 12.5103 12.5103 12.5964 12.5964 15.3419 15.3419 k = 0.5000-0.1431-0.5189 ( 12556 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3835 -24.3835 -24.3659 -24.3659 -22.3940 -22.3940 -22.3802 -22.3802 -22.2662 -22.2662 -22.2421 -22.2421 -8.9986 -8.9986 -8.9801 -8.9801 -8.5257 -8.5257 -8.5001 -8.5001 -8.1177 -8.1177 -8.0829 -8.0829 2.9062 2.9062 2.9170 2.9170 3.5685 3.5685 3.5840 3.5840 4.2675 4.2675 4.2855 4.2855 4.7332 4.7332 4.7507 4.7507 5.3410 5.3410 5.3778 5.3778 6.1435 6.1435 6.1589 6.1589 6.4441 6.4441 6.4755 6.4755 6.7997 6.7997 6.8241 6.8241 7.1502 7.1502 7.1703 7.1703 11.1441 11.1441 11.2132 11.2132 12.1087 12.1087 12.1712 12.1712 12.5209 12.5210 12.6077 12.6077 15.3286 15.3286 k = 0.5000-0.1332-0.5332 ( 12554 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3837 -24.3837 -24.3659 -24.3659 -22.3953 -22.3953 -22.3816 -22.3816 -22.2647 -22.2647 -22.2406 -22.2406 -9.0075 -9.0075 -8.9897 -8.9897 -8.5260 -8.5260 -8.5003 -8.5003 -8.1065 -8.1065 -8.0712 -8.0712 2.8885 2.8885 2.8984 2.8984 3.5584 3.5584 3.5735 3.5735 4.2793 4.2793 4.2982 4.2982 4.7439 4.7439 4.7619 4.7619 5.3826 5.3826 5.4184 5.4184 6.1201 6.1201 6.1336 6.1337 6.4378 6.4378 6.4688 6.4688 6.7892 6.7892 6.8157 6.8157 7.1437 7.1437 7.1640 7.1640 11.1498 11.1498 11.2192 11.2192 12.1079 12.1079 12.1691 12.1691 12.5306 12.5306 12.6178 12.6178 15.3169 15.3170 k = 0.5000-0.1234-0.5475 ( 12550 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3839 -24.3839 -24.3659 -24.3659 -22.3964 -22.3964 -22.3828 -22.3828 -22.2633 -22.2633 -22.2393 -22.2393 -9.0158 -9.0158 -8.9986 -8.9986 -8.5261 -8.5261 -8.5004 -8.5004 -8.0961 -8.0961 -8.0605 -8.0605 2.8729 2.8729 2.8820 2.8820 3.5485 3.5485 3.5633 3.5633 4.2904 4.2905 4.3104 4.3104 4.7567 4.7567 4.7749 4.7749 5.4225 5.4225 5.4573 5.4573 6.0927 6.0927 6.1054 6.1054 6.4302 6.4302 6.4603 6.4603 6.7823 6.7823 6.8103 6.8104 7.1368 7.1368 7.1573 7.1573 11.1574 11.1574 11.2270 11.2270 12.1070 12.1070 12.1669 12.1669 12.5392 12.5392 12.6267 12.6267 15.3069 15.3069 k = 0.5000-0.1136-0.5618 ( 12558 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3840 -24.3840 -24.3659 -24.3659 -22.3973 -22.3973 -22.3840 -22.3840 -22.2620 -22.2620 -22.2381 -22.2381 -9.0233 -9.0233 -9.0067 -9.0067 -8.5262 -8.5262 -8.5004 -8.5004 -8.0868 -8.0868 -8.0508 -8.0508 2.8594 2.8594 2.8677 2.8677 3.5390 3.5390 3.5535 3.5535 4.3010 4.3010 4.3218 4.3218 4.7710 4.7710 4.7893 4.7893 5.4601 5.4601 5.4936 5.4936 6.0637 6.0637 6.0766 6.0766 6.4198 6.4198 6.4484 6.4484 6.7789 6.7789 6.8079 6.8079 7.1296 7.1296 7.1503 7.1503 11.1667 11.1667 11.2365 11.2365 12.1062 12.1062 12.1646 12.1646 12.5468 12.5468 12.6344 12.6344 15.2984 15.2984 k = 0.5000-0.1038-0.5761 ( 12558 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3841 -24.3841 -24.3659 -24.3659 -22.3982 -22.3982 -22.3850 -22.3850 -22.2608 -22.2608 -22.2371 -22.2371 -9.0301 -9.0301 -9.0140 -9.0140 -8.5263 -8.5263 -8.5004 -8.5004 -8.0785 -8.0785 -8.0421 -8.0421 2.8482 2.8482 2.8558 2.8558 3.5301 3.5301 3.5444 3.5444 4.3107 4.3108 4.3323 4.3323 4.7864 4.7864 4.8045 4.8045 5.4945 5.4945 5.5266 5.5266 6.0351 6.0351 6.0492 6.0492 6.4062 6.4062 6.4332 6.4332 6.7783 6.7783 6.8077 6.8077 7.1221 7.1221 7.1431 7.1431 11.1777 11.1777 11.2477 11.2477 12.1054 12.1054 12.1623 12.1623 12.5534 12.5534 12.6410 12.6410 15.2915 15.2915 k = 0.5000-0.0940-0.5904 ( 12556 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3842 -24.3842 -24.3659 -24.3659 -22.3989 -22.3989 -22.3860 -22.3860 -22.2597 -22.2597 -22.2362 -22.2362 -9.0362 -9.0362 -9.0205 -9.0205 -8.5262 -8.5262 -8.5003 -8.5003 -8.0712 -8.0712 -8.0346 -8.0346 2.8394 2.8394 2.8463 2.8463 3.5219 3.5219 3.5361 3.5362 4.3198 4.3198 4.3420 4.3420 4.8023 4.8023 4.8200 4.8200 5.5250 5.5250 5.5553 5.5553 6.0085 6.0085 6.0246 6.0246 6.3901 6.3901 6.4152 6.4152 6.7793 6.7793 6.8086 6.8086 7.1148 7.1148 7.1360 7.1360 11.1904 11.1904 11.2604 11.2604 12.1049 12.1049 12.1601 12.1601 12.5589 12.5589 12.6465 12.6465 15.2862 15.2862 k = 0.5000-0.0842-0.6047 ( 12548 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3843 -24.3843 -24.3659 -24.3659 -22.3994 -22.3994 -22.3868 -22.3868 -22.2588 -22.2588 -22.2355 -22.2355 -9.0415 -9.0415 -9.0262 -9.0262 -8.5261 -8.5261 -8.5002 -8.5002 -8.0651 -8.0651 -8.0283 -8.0282 2.8330 2.8330 2.8393 2.8393 3.5146 3.5146 3.5288 3.5288 4.3282 4.3282 4.3508 4.3508 4.8178 4.8178 4.8349 4.8349 5.5507 5.5507 5.5790 5.5790 5.9851 5.9851 6.0036 6.0037 6.3725 6.3725 6.3957 6.3957 6.7807 6.7807 6.8097 6.8097 7.1078 7.1078 7.1291 7.1291 11.2047 11.2047 11.2746 11.2746 12.1045 12.1045 12.1580 12.1580 12.5634 12.5634 12.6509 12.6509 15.2824 15.2824 k = 0.5000-0.0744-0.6190 ( 12552 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3844 -24.3844 -24.3660 -24.3660 -22.3998 -22.3998 -22.3875 -22.3875 -22.2581 -22.2581 -22.2349 -22.2349 -9.0461 -9.0461 -9.0309 -9.0309 -8.5260 -8.5260 -8.5000 -8.5000 -8.0601 -8.0601 -8.0231 -8.0231 2.8292 2.8292 2.8350 2.8350 3.5083 3.5083 3.5224 3.5224 4.3358 4.3358 4.3589 4.3589 4.8320 4.8320 4.8484 4.8485 5.5714 5.5714 5.5973 5.5973 5.9656 5.9656 5.9865 5.9866 6.3549 6.3549 6.3763 6.3763 6.7812 6.7812 6.8098 6.8098 7.1014 7.1014 7.1227 7.1227 11.2204 11.2204 11.2903 11.2903 12.1045 12.1045 12.1562 12.1562 12.5669 12.5669 12.6543 12.6543 15.2800 15.2800 k = 0.5000-0.0645-0.6333 ( 12558 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3844 -24.3844 -24.3660 -24.3660 -22.4001 -22.4001 -22.3880 -22.3880 -22.2574 -22.2574 -22.2345 -22.2345 -9.0499 -9.0499 -9.0348 -9.0348 -8.5258 -8.5258 -8.4997 -8.4997 -8.0563 -8.0563 -8.0191 -8.0191 2.8279 2.8279 2.8334 2.8334 3.5032 3.5032 3.5172 3.5172 4.3429 4.3429 4.3662 4.3662 4.8441 4.8441 4.8597 4.8597 5.5869 5.5869 5.6104 5.6104 5.9498 5.9498 5.9727 5.9728 6.3389 6.3389 6.3588 6.3588 6.7798 6.7799 6.8081 6.8081 7.0959 7.0959 7.1171 7.1171 11.2376 11.2376 11.3072 11.3072 12.1048 12.1048 12.1547 12.1547 12.5695 12.5695 12.6567 12.6567 15.2790 15.2791 k = 0.5000-0.0547-0.6476 ( 12562 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3844 -24.3844 -24.3660 -24.3660 -22.4002 -22.4002 -22.3884 -22.3884 -22.2570 -22.2570 -22.2342 -22.2342 -9.0529 -9.0529 -9.0378 -9.0377 -8.5255 -8.5255 -8.4994 -8.4994 -8.0537 -8.0537 -8.0164 -8.0164 2.8292 2.8292 2.8346 2.8346 3.4992 3.4992 3.5132 3.5133 4.3494 4.3495 4.3729 4.3730 4.8530 4.8530 4.8677 4.8677 5.5979 5.5979 5.6192 5.6192 5.9368 5.9368 5.9608 5.9608 6.3261 6.3261 6.3447 6.3447 6.7760 6.7760 6.8040 6.8040 7.0916 7.0916 7.1125 7.1125 11.2560 11.2560 11.3254 11.3254 12.1056 12.1056 12.1535 12.1535 12.5711 12.5711 12.6582 12.6582 15.2794 15.2794 k = 0.7645 0.0854-0.2840 ( 12562 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3844 -24.3844 -24.3660 -24.3660 -22.4002 -22.4002 -22.3884 -22.3884 -22.2570 -22.2570 -22.2342 -22.2342 -9.0529 -9.0529 -9.0378 -9.0377 -8.5255 -8.5255 -8.4994 -8.4994 -8.0537 -8.0537 -8.0164 -8.0164 2.8292 2.8292 2.8346 2.8346 3.4992 3.4992 3.5133 3.5133 4.3494 4.3494 4.3730 4.3730 4.8530 4.8530 4.8677 4.8677 5.5979 5.5979 5.6192 5.6192 5.9368 5.9368 5.9608 5.9608 6.3261 6.3261 6.3447 6.3447 6.7760 6.7760 6.8040 6.8040 7.0916 7.0916 7.1125 7.1125 11.2560 11.2560 11.3254 11.3254 12.1056 12.1056 12.1535 12.1535 12.5711 12.5711 12.6582 12.6582 15.2794 15.2794 k = 0.7565 0.0909-0.2699 ( 12550 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3843 -24.3843 -24.3661 -24.3661 -22.4001 -22.4001 -22.3887 -22.3887 -22.2566 -22.2566 -22.2342 -22.2342 -9.0551 -9.0551 -9.0398 -9.0397 -8.5252 -8.5252 -8.4991 -8.4991 -8.0523 -8.0523 -8.0149 -8.0149 2.8332 2.8332 2.8385 2.8385 3.4967 3.4967 3.5106 3.5106 4.3554 4.3554 4.3791 4.3791 4.8578 4.8578 4.8717 4.8717 5.6054 5.6054 5.6249 5.6249 5.9252 5.9252 5.9493 5.9493 6.3176 6.3176 6.3357 6.3357 6.7695 6.7695 6.7972 6.7972 7.0887 7.0887 7.1089 7.1090 11.2752 11.2752 11.3445 11.3445 12.1068 12.1068 12.1527 12.1527 12.5718 12.5718 12.6587 12.6587 15.2811 15.2811 k = 0.7485 0.0963-0.2557 ( 12556 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3843 -24.3843 -24.3661 -24.3661 -22.3999 -22.3999 -22.3889 -22.3889 -22.2564 -22.2564 -22.2343 -22.2343 -9.0565 -9.0565 -9.0409 -9.0408 -8.5248 -8.5248 -8.4987 -8.4987 -8.0520 -8.0520 -8.0146 -8.0146 2.8397 2.8398 2.8451 2.8451 3.4954 3.4954 3.5092 3.5092 4.3610 4.3610 4.3847 4.3848 4.8580 4.8580 4.8710 4.8710 5.6105 5.6105 5.6287 5.6288 5.9135 5.9135 5.9367 5.9367 6.3140 6.3140 6.3325 6.3325 6.7601 6.7601 6.7877 6.7877 7.0871 7.0871 7.1065 7.1065 11.2955 11.2955 11.3645 11.3645 12.1085 12.1086 12.1525 12.1525 12.5716 12.5716 12.6584 12.6584 15.2840 15.2840 k = 0.7405 0.1017-0.2416 ( 12554 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3842 -24.3842 -24.3662 -24.3662 -22.3996 -22.3996 -22.3889 -22.3889 -22.2564 -22.2564 -22.2345 -22.2345 -9.0572 -9.0572 -9.0411 -9.0411 -8.5244 -8.5244 -8.4982 -8.4982 -8.0529 -8.0529 -8.0155 -8.0155 2.8490 2.8490 2.8546 2.8546 3.4955 3.4956 3.5093 3.5093 4.3661 4.3661 4.3900 4.3900 4.8533 4.8533 4.8655 4.8655 5.6135 5.6135 5.6314 5.6314 5.9014 5.9015 5.9230 5.9230 6.3152 6.3152 6.3348 6.3348 6.7484 6.7484 6.7758 6.7758 7.0866 7.0866 7.1051 7.1051 11.3166 11.3166 11.3854 11.3854 12.1108 12.1108 12.1527 12.1527 12.5705 12.5705 12.6572 12.6572 15.2881 15.2882 k = 0.7324 0.1072-0.2275 ( 12552 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3840 -24.3840 -24.3662 -24.3662 -22.3991 -22.3991 -22.3888 -22.3888 -22.2565 -22.2565 -22.2349 -22.2349 -9.0570 -9.0570 -9.0404 -9.0404 -8.5239 -8.5239 -8.4977 -8.4977 -8.0550 -8.0550 -8.0176 -8.0176 2.8609 2.8609 2.8668 2.8668 3.4971 3.4971 3.5107 3.5107 4.3710 4.3710 4.3950 4.3950 4.8436 4.8436 4.8549 4.8549 5.6140 5.6140 5.6322 5.6322 5.8898 5.8898 5.9093 5.9093 6.3204 6.3204 6.3416 6.3416 6.7349 6.7349 6.7620 6.7620 7.0871 7.0871 7.1046 7.1046 11.3385 11.3385 11.4071 11.4071 12.1136 12.1136 12.1534 12.1534 12.5685 12.5685 12.6551 12.6551 15.2935 15.2935 k = 0.7244 0.1126-0.2134 ( 12562 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3839 -24.3839 -24.3663 -24.3663 -22.3985 -22.3985 -22.3886 -22.3886 -22.2568 -22.2568 -22.2355 -22.2355 -9.0561 -9.0561 -9.0388 -9.0388 -8.5234 -8.5234 -8.4971 -8.4971 -8.0582 -8.0582 -8.0210 -8.0210 2.8754 2.8754 2.8817 2.8817 3.5001 3.5001 3.5135 3.5135 4.3755 4.3755 4.3996 4.3996 4.8291 4.8291 4.8397 4.8397 5.6106 5.6106 5.6294 5.6294 5.8805 5.8805 5.8979 5.8979 6.3283 6.3283 6.3510 6.3510 6.7207 6.7207 6.7473 6.7473 7.0884 7.0884 7.1047 7.1047 11.3611 11.3611 11.4295 11.4295 12.1169 12.1169 12.1547 12.1547 12.5656 12.5656 12.6522 12.6522 15.3001 15.3002 k = 0.7164 0.1181-0.1993 ( 12564 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3837 -24.3837 -24.3663 -24.3663 -22.3978 -22.3978 -22.3883 -22.3883 -22.2571 -22.2571 -22.2363 -22.2363 -9.0544 -9.0544 -9.0364 -9.0364 -8.5228 -8.5228 -8.4965 -8.4965 -8.0625 -8.0625 -8.0255 -8.0255 2.8926 2.8926 2.8994 2.8994 3.5046 3.5046 3.5178 3.5178 4.3797 4.3797 4.4039 4.4040 4.8103 4.8103 4.8202 4.8202 5.6013 5.6013 5.6209 5.6209 5.8760 5.8760 5.8915 5.8915 6.3371 6.3371 6.3611 6.3611 6.7071 6.7071 6.7329 6.7329 7.0901 7.0901 7.1054 7.1054 11.3843 11.3843 11.4525 11.4525 12.1208 12.1208 12.1565 12.1565 12.5618 12.5618 12.6485 12.6485 15.3081 15.3115 k = 0.7084 0.1235-0.1852 ( 12568 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3834 -24.3834 -24.3664 -24.3664 -22.3969 -22.3969 -22.3878 -22.3878 -22.2577 -22.2577 -22.2372 -22.2372 -9.0520 -9.0520 -9.0332 -9.0332 -8.5222 -8.5222 -8.4959 -8.4959 -8.0680 -8.0680 -8.0311 -8.0311 2.9125 2.9125 2.9196 2.9197 3.5106 3.5106 3.5236 3.5236 4.3836 4.3836 4.4080 4.4080 4.7879 4.7879 4.7972 4.7972 5.5846 5.5846 5.6046 5.6046 5.8779 5.8779 5.8920 5.8920 6.3451 6.3451 6.3696 6.3696 6.6957 6.6957 6.7202 6.7202 7.0922 7.0922 7.1063 7.1063 11.4080 11.4080 11.4760 11.4760 12.1250 12.1250 12.1588 12.1588 12.5571 12.5571 12.6440 12.6440 15.3172 15.3172 k = 0.7004 0.1289-0.1710 ( 12576 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3832 -24.3832 -24.3665 -24.3665 -22.3958 -22.3958 -22.3872 -22.3872 -22.2583 -22.2583 -22.2383 -22.2383 -9.0488 -9.0488 -9.0291 -9.0291 -8.5215 -8.5215 -8.4951 -8.4951 -8.0744 -8.0744 -8.0379 -8.0379 2.9349 2.9349 2.9425 2.9425 3.5180 3.5180 3.5309 3.5309 4.3872 4.3872 4.4118 4.4118 4.7626 4.7626 4.7714 4.7715 5.5604 5.5605 5.5804 5.5804 5.8860 5.8860 5.8995 5.8995 6.3506 6.3507 6.3746 6.3746 6.6880 6.6880 6.7107 6.7107 7.0943 7.0943 7.1074 7.1074 11.4321 11.4321 11.4999 11.4999 12.1297 12.1297 12.1616 12.1616 12.5515 12.5515 12.6385 12.6385 15.3278 15.3278 k = 0.6924 0.1344-0.1569 ( 12580 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3829 -24.3829 -24.3665 -24.3665 -22.3947 -22.3947 -22.3864 -22.3864 -22.2591 -22.2591 -22.2395 -22.2395 -9.0448 -9.0448 -9.0243 -9.0243 -8.5207 -8.5207 -8.4943 -8.4943 -8.0820 -8.0820 -8.0458 -8.0458 2.9599 2.9599 2.9680 2.9680 3.5269 3.5269 3.5396 3.5396 4.3903 4.3903 4.4152 4.4152 4.7351 4.7351 4.7438 4.7438 5.5297 5.5297 5.5492 5.5492 5.8984 5.8984 5.9124 5.9124 6.3526 6.3527 6.3751 6.3751 6.6854 6.6855 6.7059 6.7059 7.0964 7.0964 7.1085 7.1085 11.4566 11.4566 11.5242 11.5242 12.1347 12.1347 12.1648 12.1648 12.5450 12.5450 12.6322 12.6322 15.3398 15.3402 k = 0.6843 0.1398-0.1428 ( 12592 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3826 -24.3826 -24.3666 -24.3666 -22.3934 -22.3934 -22.3856 -22.3856 -22.2600 -22.2600 -22.2409 -22.2409 -9.0401 -9.0401 -9.0188 -9.0188 -8.5198 -8.5198 -8.4934 -8.4934 -8.0905 -8.0905 -8.0547 -8.0547 2.9874 2.9874 2.9958 2.9958 3.5373 3.5373 3.5497 3.5497 4.3930 4.3930 4.4181 4.4181 4.7061 4.7062 4.7151 4.7151 5.4937 5.4937 5.5127 5.5127 5.9124 5.9124 5.9281 5.9281 6.3512 6.3512 6.3710 6.3710 6.6884 6.6884 6.7066 6.7067 7.0984 7.0984 7.1097 7.1097 11.4814 11.4814 11.5489 11.5489 12.1399 12.1399 12.1683 12.1683 12.5376 12.5376 12.6250 12.6250 15.3533 15.3536 k = 0.6763 0.1453-0.1287 ( 12594 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3823 -24.3823 -24.3667 -24.3667 -22.3919 -22.3919 -22.3846 -22.3846 -22.2611 -22.2611 -22.2424 -22.2424 -9.0347 -9.0347 -9.0125 -9.0125 -8.5188 -8.5188 -8.4925 -8.4925 -8.0999 -8.0999 -8.0647 -8.0647 3.0172 3.0172 3.0260 3.0261 3.5492 3.5492 3.5613 3.5613 4.3949 4.3949 4.4205 4.4205 4.6763 4.6764 4.6861 4.6861 5.4539 5.4539 5.4723 5.4723 5.9250 5.9250 5.9433 5.9433 6.3478 6.3478 6.3640 6.3640 6.6965 6.6965 6.7129 6.7129 7.1002 7.1002 7.1108 7.1108 11.5065 11.5065 11.5739 11.5739 12.1452 12.1452 12.1721 12.1721 12.5293 12.5293 12.6169 12.6169 15.3684 15.3709 k = 0.6683 0.1507-0.1146 ( 12596 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3819 -24.3819 -24.3668 -24.3668 -22.3904 -22.3904 -22.3835 -22.3835 -22.2622 -22.2622 -22.2441 -22.2441 -9.0287 -9.0287 -9.0056 -9.0056 -8.5178 -8.5178 -8.4914 -8.4914 -8.1102 -8.1102 -8.0756 -8.0756 3.0493 3.0493 3.0585 3.0585 3.5624 3.5624 3.5742 3.5743 4.3960 4.3960 4.4220 4.4220 4.6465 4.6465 4.6577 4.6577 5.4113 5.4113 5.4292 5.4292 5.9328 5.9328 5.9546 5.9546 6.3450 6.3450 6.3571 6.3572 6.7086 6.7086 6.7238 6.7238 7.1018 7.1018 7.1118 7.1118 11.5318 11.5318 11.5991 11.5991 12.1505 12.1505 12.1761 12.1761 12.5201 12.5201 12.6079 12.6079 15.3854 15.3902 k = 0.6603 0.1561-0.1005 ( 12586 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3816 -24.3816 -24.3669 -24.3669 -22.3887 -22.3887 -22.3823 -22.3823 -22.2635 -22.2635 -22.2458 -22.2458 -9.0220 -9.0219 -8.9981 -8.9981 -8.5166 -8.5166 -8.4903 -8.4903 -8.1213 -8.1213 -8.0874 -8.0874 3.0836 3.0836 3.0931 3.0931 3.5770 3.5770 3.5886 3.5886 4.3957 4.3957 4.4223 4.4223 4.6174 4.6174 4.6307 4.6307 5.3668 5.3669 5.3842 5.3842 5.9329 5.9329 5.9588 5.9588 6.3456 6.3456 6.3541 6.3541 6.7237 6.7237 6.7383 6.7383 7.1032 7.1032 7.1127 7.1127 11.5574 11.5574 11.6246 11.6246 12.1558 12.1558 12.1801 12.1801 12.5100 12.5100 12.5979 12.5979 15.4036 15.4148 k = 0.6523 0.1616-0.0864 ( 12588 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3812 -24.3812 -24.3670 -24.3670 -22.3870 -22.3870 -22.3811 -22.3811 -22.2649 -22.2649 -22.2478 -22.2478 -9.0146 -9.0146 -8.9900 -8.9900 -8.5153 -8.5153 -8.4890 -8.4890 -8.1332 -8.1332 -8.1001 -8.1001 3.1199 3.1199 3.1296 3.1296 3.5929 3.5929 3.6042 3.6042 4.3937 4.3937 4.4207 4.4207 4.5901 4.5901 4.6060 4.6060 5.3211 5.3211 5.3379 5.3380 5.9232 5.9232 5.9530 5.9530 6.3514 6.3514 6.3583 6.3584 6.7406 6.7406 6.7550 6.7550 7.1044 7.1044 7.1136 7.1136 11.5831 11.5831 11.6503 11.6503 12.1609 12.1609 12.1841 12.1841 12.4990 12.4990 12.5870 12.5870 15.4239 15.4269 k = 0.6443 0.1670-0.0722 ( 12582 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3807 -24.3807 -24.3672 -24.3672 -22.3851 -22.3851 -22.3797 -22.3797 -22.2663 -22.2663 -22.2498 -22.2498 -9.0068 -9.0067 -8.9814 -8.9814 -8.5138 -8.5138 -8.4876 -8.4876 -8.1458 -8.1458 -8.1136 -8.1136 3.1580 3.1580 3.1680 3.1680 3.6101 3.6101 3.6210 3.6210 4.3892 4.3892 4.4164 4.4164 4.5659 4.5659 4.5845 4.5845 5.2746 5.2746 5.2910 5.2910 5.9031 5.9031 5.9361 5.9361 6.3633 6.3633 6.3714 6.3715 6.7586 6.7586 6.7731 6.7731 7.1054 7.1054 7.1144 7.1144 11.6090 11.6090 11.6762 11.6762 12.1657 12.1657 12.1880 12.1880 12.4872 12.4873 12.5751 12.5751 15.4459 15.4461 k = 0.6363 0.1725-0.0581 ( 12582 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3803 -24.3803 -24.3673 -24.3673 -22.3832 -22.3832 -22.3782 -22.3782 -22.2679 -22.2679 -22.2519 -22.2519 -8.9984 -8.9983 -8.9724 -8.9724 -8.5122 -8.5122 -8.4861 -8.4861 -8.1590 -8.1590 -8.1278 -8.1278 3.1979 3.1979 3.2080 3.2080 3.6284 3.6284 3.6389 3.6389 4.3816 4.3816 4.4083 4.4083 4.5463 4.5463 4.5672 4.5672 5.2277 5.2277 5.2437 5.2437 5.8734 5.8734 5.9087 5.9087 6.3817 6.3818 6.3919 6.3919 6.7771 6.7771 6.7917 6.7917 7.1063 7.1063 7.1152 7.1152 11.6350 11.6350 11.7022 11.7022 12.1702 12.1702 12.1916 12.1916 12.4747 12.4747 12.5623 12.5623 15.4699 15.4700 k = 0.6282 0.1779-0.0440 ( 12586 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3799 -24.3799 -24.3675 -24.3675 -22.3812 -22.3812 -22.3767 -22.3767 -22.2695 -22.2695 -22.2541 -22.2541 -8.9895 -8.9895 -8.9631 -8.9631 -8.5104 -8.5104 -8.4844 -8.4844 -8.1728 -8.1728 -8.1426 -8.1426 3.2392 3.2392 3.2494 3.2494 3.6477 3.6477 3.6578 3.6578 4.3705 4.3705 4.3955 4.3955 4.5323 4.5323 4.5547 4.5547 5.1809 5.1809 5.1964 5.1964 5.8359 5.8359 5.8724 5.8724 6.4058 6.4058 6.4177 6.4177 6.7955 6.7955 6.8102 6.8103 7.1070 7.1070 7.1158 7.1159 11.6611 11.6611 11.7283 11.7283 12.1743 12.1743 12.1949 12.1949 12.4614 12.4614 12.5487 12.5487 15.4969 15.5061 k = 0.6202 0.1833-0.0299 ( 12586 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3794 -24.3794 -24.3676 -24.3676 -22.3791 -22.3791 -22.3751 -22.3751 -22.2711 -22.2711 -22.2564 -22.2564 -8.9803 -8.9802 -8.9535 -8.9535 -8.5083 -8.5083 -8.4825 -8.4825 -8.1870 -8.1870 -8.1580 -8.1580 3.2819 3.2819 3.2921 3.2921 3.6679 3.6679 3.6776 3.6776 4.3560 4.3560 4.3784 4.3784 4.5242 4.5242 4.5469 4.5469 5.1343 5.1343 5.1495 5.1495 5.7921 5.7921 5.8293 5.8293 6.4337 6.4337 6.4469 6.4469 6.8137 6.8137 6.8284 6.8284 7.1076 7.1076 7.1164 7.1164 11.6873 11.6873 11.7545 11.7545 12.1779 12.1779 12.1979 12.1979 12.4475 12.4475 12.5341 12.5341 15.5235 15.5239 k = 0.6122 0.1888-0.0158 ( 12594 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3789 -24.3789 -24.3678 -24.3678 -22.3770 -22.3770 -22.3734 -22.3734 -22.2728 -22.2728 -22.2588 -22.2588 -8.9707 -8.9707 -8.9437 -8.9437 -8.5060 -8.5060 -8.4804 -8.4804 -8.2015 -8.2015 -8.1740 -8.1740 3.3257 3.3257 3.3358 3.3358 3.6888 3.6888 3.6981 3.6981 4.3388 4.3388 4.3580 4.3580 4.5210 4.5210 4.5435 4.5435 5.0884 5.0884 5.1032 5.1032 5.7437 5.7437 5.7810 5.7810 6.4640 6.4640 6.4781 6.4781 6.8313 6.8313 6.8460 6.8460 7.1080 7.1080 7.1169 7.1169 11.7135 11.7135 11.7807 11.7807 12.1810 12.1811 12.2005 12.2005 12.4330 12.4330 12.5187 12.5187 15.5576 15.5604 k = 0.6042 0.1942-0.0017 ( 12584 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3784 -24.3784 -24.3680 -24.3680 -22.3748 -22.3748 -22.3717 -22.3717 -22.2745 -22.2745 -22.2612 -22.2612 -8.9609 -8.9608 -8.9339 -8.9339 -8.5034 -8.5034 -8.4781 -8.4781 -8.2163 -8.2163 -8.1903 -8.1903 3.3703 3.3703 3.3803 3.3803 3.7102 3.7102 3.7191 3.7191 4.3196 4.3196 4.3356 4.3356 4.5216 4.5217 4.5437 4.5437 5.0435 5.0435 5.0578 5.0578 5.6919 5.6919 5.7289 5.7289 6.4953 6.4953 6.5101 6.5101 6.8484 6.8484 6.8629 6.8629 7.1083 7.1083 7.1171 7.1171 11.7397 11.7397 11.8068 11.8068 12.1837 12.1837 12.2026 12.2026 12.4181 12.4181 12.5025 12.5025 15.5845 15.5902 k = 0.5962 0.1997 0.0124 ( 12580 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3779 -24.3779 -24.3682 -24.3682 -22.3727 -22.3727 -22.3700 -22.3700 -22.2762 -22.2762 -22.2637 -22.2637 -8.9509 -8.9509 -8.9241 -8.9241 -8.5004 -8.5004 -8.4755 -8.4755 -8.2314 -8.2313 -8.2069 -8.2069 3.4155 3.4155 3.4253 3.4254 3.7319 3.7319 3.7403 3.7403 4.2992 4.2992 4.3125 4.3125 4.5254 4.5254 4.5469 4.5469 4.9998 4.9998 5.0136 5.0137 5.6376 5.6376 5.6742 5.6742 6.5265 6.5265 6.5419 6.5419 6.8649 6.8649 6.8792 6.8792 7.1084 7.1084 7.1171 7.1171 11.7658 11.7658 11.8328 11.8328 12.1858 12.1858 12.2044 12.2044 12.4027 12.4027 12.4857 12.4857 15.6183 15.6212 k = 0.5882 0.2051 0.0266 ( 12582 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3774 -24.3774 -24.3685 -24.3685 -22.3705 -22.3705 -22.3682 -22.3682 -22.2779 -22.2779 -22.2662 -22.2662 -8.9408 -8.9408 -8.9145 -8.9145 -8.4971 -8.4970 -8.4727 -8.4727 -8.2464 -8.2464 -8.2238 -8.2237 3.4609 3.4610 3.4706 3.4706 3.7536 3.7536 3.7615 3.7615 4.2782 4.2782 4.2892 4.2892 4.5316 4.5316 4.5526 4.5526 4.9577 4.9577 4.9711 4.9711 5.5818 5.5818 5.6177 5.6177 6.5570 6.5570 6.5726 6.5726 6.8809 6.8809 6.8948 6.8948 7.1082 7.1082 7.1166 7.1166 11.7917 11.7917 11.8584 11.8584 12.1873 12.1873 12.2059 12.2059 12.3871 12.3871 12.4681 12.4681 15.6533 15.6575 k = 0.5802 0.2105 0.0407 ( 12580 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1712 -35.1712 -24.3769 -24.3769 -24.3687 -24.3687 -22.3683 -22.3683 -22.3665 -22.3665 -22.2796 -22.2796 -22.2686 -22.2686 -8.9308 -8.9308 -8.9052 -8.9052 -8.4932 -8.4932 -8.4695 -8.4695 -8.2615 -8.2614 -8.2407 -8.2407 3.5064 3.5064 3.5158 3.5158 3.7749 3.7749 3.7823 3.7823 4.2570 4.2570 4.2663 4.2664 4.5401 4.5401 4.5606 4.5606 4.9175 4.9175 4.9304 4.9304 5.5251 5.5251 5.5602 5.5602 6.5860 6.5860 6.6017 6.6017 6.8965 6.8965 6.9100 6.9100 7.1075 7.1075 7.1156 7.1157 11.8173 11.8173 11.8836 11.8836 12.1882 12.1882 12.2071 12.2071 12.3713 12.3713 12.4500 12.4500 15.6887 15.6920 k = 0.5721 0.2160 0.0548 ( 12578 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3764 -24.3764 -24.3690 -24.3690 -22.3662 -22.3662 -22.3648 -22.3648 -22.2812 -22.2812 -22.2711 -22.2711 -8.9210 -8.9210 -8.8964 -8.8964 -8.4889 -8.4889 -8.4661 -8.4661 -8.2763 -8.2763 -8.2577 -8.2577 3.5515 3.5515 3.5606 3.5606 3.7954 3.7954 3.8023 3.8023 4.2358 4.2358 4.2440 4.2440 4.5507 4.5507 4.5706 4.5706 4.8797 4.8797 4.8919 4.8919 5.4682 5.4682 5.5023 5.5023 6.6130 6.6130 6.6285 6.6285 6.9119 6.9119 6.9249 6.9249 7.1063 7.1063 7.1140 7.1140 11.8425 11.8425 11.9080 11.9080 12.1886 12.1886 12.2082 12.2082 12.3556 12.3556 12.4314 12.4314 15.7257 15.7359 k = 0.5641 0.2214 0.0689 ( 12582 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3759 -24.3759 -24.3693 -24.3693 -22.3642 -22.3642 -22.3631 -22.3631 -22.2827 -22.2827 -22.2735 -22.2735 -8.9114 -8.9114 -8.8882 -8.8882 -8.4840 -8.4840 -8.4623 -8.4623 -8.2909 -8.2909 -8.2745 -8.2745 3.5959 3.5959 3.6046 3.6046 3.8148 3.8148 3.8213 3.8213 4.2146 4.2146 4.2223 4.2223 4.5634 4.5634 4.5827 4.5827 4.8446 4.8446 4.8561 4.8561 5.4119 5.4119 5.4447 5.4447 6.6376 6.6377 6.6527 6.6527 6.9273 6.9273 6.9395 6.9395 7.1044 7.1044 7.1117 7.1117 11.8672 11.8672 11.9316 11.9316 12.1884 12.1884 12.2094 12.2094 12.3401 12.3401 12.4124 12.4124 15.7641 15.7699 k = 0.5561 0.2269 0.0830 ( 12584 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3754 -24.3754 -24.3696 -24.3696 -22.3623 -22.3623 -22.3615 -22.3615 -22.2840 -22.2840 -22.2758 -22.2758 -8.9022 -8.9022 -8.8808 -8.8808 -8.4785 -8.4785 -8.4581 -8.4581 -8.3051 -8.3051 -8.2910 -8.2910 3.6392 3.6392 3.6475 3.6476 3.8326 3.8326 3.8387 3.8387 4.1935 4.1935 4.2012 4.2012 4.5782 4.5782 4.5967 4.5968 4.8126 4.8126 4.8232 4.8232 5.3570 5.3570 5.3882 5.3882 6.6597 6.6597 6.6739 6.6739 6.9427 6.9427 6.9541 6.9541 7.1018 7.1018 7.1084 7.1084 11.8913 11.8913 11.9538 11.9538 12.1877 12.1877 12.2108 12.2108 12.3251 12.3251 12.3932 12.3932 15.8032 15.8078 k = 0.5481 0.2323 0.0971 ( 12576 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3749 -24.3749 -24.3699 -24.3699 -22.3606 -22.3606 -22.3601 -22.3601 -22.2852 -22.2852 -22.2780 -22.2780 -8.8936 -8.8936 -8.8743 -8.8743 -8.4724 -8.4724 -8.4536 -8.4536 -8.3187 -8.3187 -8.3071 -8.3071 3.6809 3.6809 3.6889 3.6889 3.8484 3.8484 3.8543 3.8544 4.1727 4.1727 4.1805 4.1805 4.5948 4.5948 4.6125 4.6125 4.7841 4.7842 4.7937 4.7937 5.3043 5.3043 5.3336 5.3337 6.6789 6.6789 6.6918 6.6919 6.9582 6.9582 6.9686 6.9686 7.0981 7.0981 7.1041 7.1041 11.9145 11.9145 11.9742 11.9742 12.1867 12.1867 12.2126 12.2126 12.3109 12.3109 12.3739 12.3739 15.8423 15.8494 k = 0.5401 0.2377 0.1112 ( 12586 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3745 -24.3745 -24.3702 -24.3702 -22.3591 -22.3591 -22.3587 -22.3587 -22.2862 -22.2862 -22.2801 -22.2801 -8.8857 -8.8856 -8.8689 -8.8688 -8.4657 -8.4657 -8.4488 -8.4488 -8.3316 -8.3316 -8.3225 -8.3225 3.7204 3.7204 3.7280 3.7280 3.8619 3.8619 3.8678 3.8678 4.1523 4.1523 4.1602 4.1602 4.6131 4.6131 4.6296 4.6296 4.7596 4.7596 4.7679 4.7679 5.2551 5.2551 5.2820 5.2820 6.6952 6.6952 6.7066 6.7066 6.9738 6.9738 6.9829 6.9829 7.0935 7.0935 7.0987 7.0987 11.9366 11.9366 11.9920 11.9920 12.1856 12.1856 12.2150 12.2150 12.2979 12.2979 12.3547 12.3547 15.8825 15.8900 k = 0.5321 0.2432 0.1254 ( 12592 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3740 -24.3740 -24.3706 -24.3706 -22.3577 -22.3577 -22.3575 -22.3575 -22.2870 -22.2870 -22.2819 -22.2819 -8.8785 -8.8785 -8.8646 -8.8646 -8.4585 -8.4584 -8.4438 -8.4438 -8.3435 -8.3435 -8.3370 -8.3370 3.7570 3.7570 3.7641 3.7641 3.8726 3.8726 3.8788 3.8788 4.1328 4.1328 4.1405 4.1405 4.6323 4.6323 4.6471 4.6471 4.7391 4.7392 4.7461 4.7461 5.2107 5.2107 5.2344 5.2344 6.7086 6.7086 6.7181 6.7181 6.9892 6.9892 6.9969 6.9969 7.0876 7.0876 7.0923 7.0923 11.9573 11.9573 12.0065 12.0066 12.1847 12.1847 12.2180 12.2180 12.2865 12.2865 12.3359 12.3359 15.9207 15.9347 k = 0.5240 0.2486 0.1395 ( 12604 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3735 -24.3735 -24.3709 -24.3709 -22.3567 -22.3567 -22.3566 -22.3566 -22.2874 -22.2874 -22.2836 -22.2836 -8.8724 -8.8724 -8.8616 -8.8616 -8.4510 -8.4510 -8.4391 -8.4390 -8.3540 -8.3540 -8.3501 -8.3501 3.7897 3.7897 3.7960 3.7961 3.8803 3.8803 3.8871 3.8871 4.1149 4.1149 4.1219 4.1219 4.6515 4.6515 4.6638 4.6638 4.7230 4.7230 4.7284 4.7284 5.1731 5.1731 5.1927 5.1927 6.7192 6.7192 6.7265 6.7265 7.0042 7.0042 7.0104 7.0104 7.0807 7.0807 7.0848 7.0848 11.9761 11.9761 12.0168 12.0168 12.1843 12.1843 12.2216 12.2216 12.2776 12.2776 12.3180 12.3180 15.9588 15.9633 k = 0.5160 0.2541 0.1536 ( 12604 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3730 -24.3730 -24.3713 -24.3713 -22.3559 -22.3559 -22.3558 -22.3558 -22.2876 -22.2876 -22.2850 -22.2850 -8.8673 -8.8673 -8.8600 -8.8600 -8.4437 -8.4436 -8.4350 -8.4350 -8.3628 -8.3628 -8.3610 -8.3610 3.8168 3.8168 3.8221 3.8221 3.8849 3.8849 3.8924 3.8924 4.1002 4.1002 4.1057 4.1057 4.6691 4.6691 4.6780 4.6780 4.7111 4.7111 4.7148 4.7148 5.1447 5.1447 5.1589 5.1589 6.7270 6.7271 6.7320 6.7320 7.0183 7.0183 7.0228 7.0228 7.0726 7.0726 7.0768 7.0768 11.9928 11.9928 12.0220 12.0220 12.1843 12.1843 12.2256 12.2256 12.2722 12.2722 12.3015 12.3015 15.9954 15.9956 k = 0.5080 0.2595 0.1677 ( 12620 PWs) bands (ev): -46.7045 -46.7045 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3726 -24.3726 -24.3717 -24.3717 -22.3554 -22.3554 -22.3554 -22.3554 -22.2875 -22.2875 -22.2861 -22.2861 -8.8635 -8.8635 -8.8598 -8.8598 -8.4374 -8.4374 -8.4327 -8.4327 -8.3688 -8.3688 -8.3686 -8.3686 3.8362 3.8362 3.8395 3.8395 3.8868 3.8868 3.8948 3.8948 4.0906 4.0906 4.0937 4.0938 4.6837 4.6837 4.6884 4.6884 4.7026 4.7026 4.7048 4.7048 5.1278 5.1278 5.1354 5.1354 6.7322 6.7322 6.7347 6.7347 7.0305 7.0305 7.0330 7.0330 7.0643 7.0643 7.0692 7.0692 12.0064 12.0064 12.0218 12.0218 12.1847 12.1847 12.2289 12.2289 12.2716 12.2716 12.2873 12.2873 16.0298 16.0306 k = 0.5000 0.2649 0.1818 ( 12616 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3722 -24.3722 -24.3722 -24.3722 -22.3553 -22.3553 -22.3552 -22.3552 -22.2870 -22.2870 -22.2870 -22.2870 -8.8610 -8.8610 -8.8609 -8.8609 -8.4334 -8.4334 -8.4334 -8.4334 -8.3714 -8.3714 -8.3709 -8.3709 3.8446 3.8446 3.8447 3.8447 3.8872 3.8872 3.8953 3.8953 4.0883 4.0883 4.0883 4.0883 4.6931 4.6931 4.6932 4.6932 4.6966 4.6966 4.6992 4.6992 5.1246 5.1246 5.1246 5.1246 6.7348 6.7348 6.7348 6.7348 7.0371 7.0371 7.0371 7.0371 7.0595 7.0595 7.0654 7.0654 12.0164 12.0164 12.0164 12.0164 12.1849 12.1849 12.2302 12.2302 12.2768 12.2768 12.2768 12.2768 16.0557 16.0558 k = 0.5000 0.2649 0.1818 ( 12616 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3722 -24.3722 -24.3722 -24.3722 -22.3553 -22.3553 -22.3552 -22.3552 -22.2870 -22.2870 -22.2870 -22.2870 -8.8610 -8.8610 -8.8609 -8.8609 -8.4334 -8.4334 -8.4334 -8.4334 -8.3714 -8.3714 -8.3709 -8.3709 3.8446 3.8446 3.8447 3.8447 3.8872 3.8872 3.8953 3.8953 4.0883 4.0883 4.0883 4.0883 4.6931 4.6931 4.6932 4.6932 4.6966 4.6966 4.6992 4.6992 5.1246 5.1246 5.1246 5.1246 6.7348 6.7348 6.7348 6.7348 7.0371 7.0371 7.0371 7.0371 7.0595 7.0595 7.0654 7.0654 12.0164 12.0164 12.0164 12.0164 12.1849 12.1849 12.2302 12.2302 12.2768 12.2768 12.2768 12.2768 16.0558 16.0559 k = 0.4857 0.2574 0.1766 ( 12616 PWs) bands (ev): -46.7048 -46.7048 -46.7041 -46.7041 -35.1713 -35.1713 -35.1712 -35.1712 -24.3751 -24.3751 -24.3692 -24.3692 -22.3594 -22.3593 -22.3512 -22.3511 -22.2914 -22.2914 -22.2825 -22.2825 -8.8958 -8.8958 -8.8260 -8.8260 -8.4578 -8.4578 -8.4088 -8.4088 -8.3979 -8.3975 -8.3447 -8.3443 3.7938 3.7938 3.8334 3.8420 3.8962 3.8962 3.9417 3.9494 4.0459 4.0459 4.1311 4.1311 4.6255 4.6255 4.6278 4.6312 4.7614 4.7614 4.7659 4.7679 5.0675 5.0675 5.1828 5.1828 6.7144 6.7144 6.7543 6.7543 7.0161 7.0161 7.0386 7.0446 7.0580 7.0580 7.0803 7.0860 11.9895 11.9895 12.0421 12.0421 12.1408 12.1877 12.2275 12.2358 12.2358 12.2713 12.3177 12.3177 15.9954 15.9954 k = 0.4714 0.2498 0.1714 ( 12598 PWs) bands (ev): -46.7052 -46.7052 -46.7037 -46.7037 -35.1714 -35.1714 -35.1711 -35.1711 -24.3781 -24.3781 -24.3662 -24.3662 -22.3634 -22.3634 -22.3471 -22.3470 -22.2959 -22.2959 -22.2780 -22.2780 -8.9305 -8.9305 -8.7909 -8.7909 -8.4820 -8.4820 -8.4242 -8.4238 -8.3841 -8.3841 -8.3180 -8.3176 3.7438 3.7438 3.7807 3.7897 3.9478 3.9478 3.9970 4.0041 4.0042 4.0042 4.1741 4.1741 4.5587 4.5587 4.5599 4.5639 4.8300 4.8300 4.8356 4.8369 5.0117 5.0117 5.2419 5.2419 6.6933 6.6933 6.7730 6.7730 6.9952 6.9952 7.0177 7.0239 7.0788 7.0788 7.1010 7.1066 11.9621 11.9621 12.0649 12.0649 12.0956 12.1439 12.1968 12.1968 12.2686 12.3107 12.3578 12.3578 15.9358 15.9361 k = 0.4571 0.2422 0.1662 ( 12586 PWs) bands (ev): -46.7055 -46.7055 -46.7034 -46.7034 -35.1714 -35.1714 -35.1711 -35.1711 -24.3811 -24.3811 -24.3632 -24.3632 -22.3675 -22.3675 -22.3430 -22.3429 -22.3003 -22.3003 -22.2735 -22.2735 -8.9649 -8.9649 -8.7560 -8.7560 -8.5059 -8.5059 -8.4504 -8.4499 -8.3594 -8.3594 -8.2913 -8.2908 3.6947 3.6947 3.7290 3.7384 3.9607 3.9607 4.0018 4.0018 4.0525 4.0592 4.2175 4.2175 4.4930 4.4930 4.4931 4.4977 4.8977 4.8977 4.9056 4.9062 4.9583 4.9583 5.3017 5.3017 6.6716 6.6716 6.7908 6.7908 6.9743 6.9744 6.9969 7.0032 7.0994 7.0994 7.1213 7.1268 11.9345 11.9345 12.0493 12.0774 12.0774 12.0989 12.1671 12.1671 12.3081 12.3484 12.3965 12.3965 15.8772 15.8772 k = 0.4429 0.2347 0.1610 ( 12580 PWs) bands (ev): -46.7059 -46.7059 -46.7030 -46.7030 -35.1715 -35.1715 -35.1710 -35.1710 -24.3840 -24.3840 -24.3603 -24.3603 -22.3715 -22.3715 -22.3389 -22.3389 -22.3047 -22.3047 -22.2690 -22.2690 -8.9990 -8.9990 -8.7212 -8.7212 -8.5295 -8.5295 -8.4762 -8.4758 -8.3346 -8.3346 -8.2646 -8.2641 3.6466 3.6466 3.6785 3.6883 3.9200 3.9200 4.0531 4.0531 4.1078 4.1140 4.2611 4.2611 4.4278 4.4291 4.4291 4.4332 4.9009 4.9009 4.9711 4.9711 4.9756 4.9758 5.3621 5.3621 6.6493 6.6493 6.8076 6.8076 6.9538 6.9538 6.9763 6.9827 7.1196 7.1196 7.1414 7.1467 11.9067 11.9067 12.0021 12.0529 12.0638 12.0638 12.1629 12.1629 12.3457 12.3841 12.4336 12.4336 15.8198 15.8199 k = 0.4286 0.2271 0.1558 ( 12595 PWs) bands (ev): -46.7062 -46.7062 -46.7027 -46.7027 -35.1715 -35.1715 -35.1709 -35.1709 -24.3869 -24.3869 -24.3573 -24.3573 -22.3755 -22.3755 -22.3348 -22.3348 -22.3090 -22.3090 -22.2645 -22.2645 -9.0327 -9.0327 -8.6868 -8.6868 -8.5525 -8.5525 -8.5017 -8.5013 -8.3098 -8.3098 -8.2379 -8.2375 3.5997 3.5997 3.6292 3.6394 3.8791 3.8791 4.1033 4.1033 4.1611 4.1668 4.3048 4.3048 4.3662 4.3682 4.3682 4.3721 4.8501 4.8501 5.0394 5.0394 5.0451 5.0460 5.4230 5.4230 6.6264 6.6264 6.8233 6.8233 6.9336 6.9336 6.9559 6.9624 7.1394 7.1394 7.1611 7.1663 11.8788 11.8788 11.9542 12.0061 12.0284 12.0284 12.1799 12.1799 12.3814 12.4178 12.4689 12.4689 15.7637 15.7638 k = 0.4143 0.2195 0.1507 ( 12598 PWs) bands (ev): -46.7066 -46.7066 -46.7023 -46.7023 -35.1716 -35.1716 -35.1709 -35.1709 -24.3897 -24.3897 -24.3544 -24.3544 -22.3794 -22.3794 -22.3308 -22.3308 -22.3133 -22.3133 -22.2601 -22.2601 -9.0660 -9.0660 -8.6534 -8.6534 -8.5743 -8.5743 -8.5269 -8.5265 -8.2852 -8.2852 -8.2115 -8.2110 3.5540 3.5540 3.5813 3.5919 3.8385 3.8385 4.1476 4.1476 4.2043 4.2082 4.3132 4.3133 4.3172 4.3226 4.3501 4.3501 4.8000 4.8000 5.1086 5.1086 5.1144 5.1160 5.4841 5.4841 6.6031 6.6031 6.8378 6.8378 6.9139 6.9140 6.9359 6.9425 7.1588 7.1588 7.1802 7.1853 11.8507 11.8507 11.9057 11.9585 11.9859 11.9859 12.2039 12.2039 12.4149 12.4492 12.5021 12.5021 15.7092 15.7096 k = 0.4000 0.2119 0.1455 ( 12598 PWs) bands (ev): -46.7069 -46.7069 -46.7020 -46.7020 -35.1717 -35.1717 -35.1708 -35.1708 -24.3926 -24.3926 -24.3515 -24.3515 -22.3833 -22.3833 -22.3268 -22.3268 -22.3175 -22.3175 -22.2557 -22.2557 -9.0987 -9.0987 -8.6251 -8.6251 -8.5910 -8.5910 -8.5516 -8.5512 -8.2607 -8.2607 -8.1852 -8.1847 3.5096 3.5096 3.5348 3.5457 3.7984 3.7984 4.1677 4.1677 4.1996 4.2018 4.2852 4.2852 4.3198 4.3200 4.3940 4.3940 4.7515 4.7515 5.1778 5.1778 5.1834 5.1859 5.5453 5.5453 6.5794 6.5794 6.8506 6.8506 6.8954 6.8954 6.9162 6.9230 7.1775 7.1775 7.1988 7.2037 11.8222 11.8222 11.8567 11.9105 11.9414 11.9414 12.2300 12.2300 12.4461 12.4783 12.5332 12.5332 15.6566 15.6566 k = 0.3857 0.2044 0.1403 ( 12595 PWs) bands (ev): -46.7072 -46.7072 -46.7016 -46.7016 -35.1717 -35.1717 -35.1708 -35.1708 -24.3954 -24.3954 -24.3487 -24.3487 -22.3871 -22.3871 -22.3229 -22.3229 -22.3216 -22.3216 -22.2514 -22.2514 -9.1308 -9.1308 -8.6274 -8.6273 -8.5771 -8.5771 -8.5759 -8.5755 -8.2364 -8.2364 -8.1592 -8.1587 3.4666 3.4666 3.4897 3.5009 3.7587 3.7587 4.1394 4.1394 4.1490 4.1543 4.3063 4.3063 4.3638 4.3655 4.4386 4.4386 4.7048 4.7048 5.2466 5.2466 5.2521 5.2553 5.6065 5.6065 6.5555 6.5555 6.8589 6.8589 6.8809 6.8809 6.8971 6.9039 7.1957 7.1957 7.2168 7.2216 11.7929 11.7929 11.8075 11.8620 11.8969 11.8969 12.2568 12.2568 12.4749 12.5050 12.5619 12.5619 15.6059 15.6059 k = 0.3714 0.1968 0.1351 ( 12586 PWs) bands (ev): -46.7076 -46.7076 -46.7013 -46.7013 -35.1718 -35.1718 -35.1707 -35.1707 -24.3981 -24.3981 -24.3459 -24.3459 -22.3909 -22.3909 -22.3257 -22.3257 -22.3190 -22.3190 -22.2471 -22.2471 -9.1622 -9.1622 -8.6465 -8.6465 -8.5996 -8.5993 -8.5463 -8.5462 -8.2123 -8.2123 -8.1334 -8.1330 3.4249 3.4249 3.4461 3.4577 3.7195 3.7195 4.0887 4.0887 4.0909 4.0974 4.3507 4.3508 4.4184 4.4201 4.4833 4.4833 4.6600 4.6600 5.3151 5.3151 5.3202 5.3242 5.6675 5.6675 6.5314 6.5314 6.8514 6.8514 6.8786 6.8816 6.8816 6.8855 7.2131 7.2131 7.2340 7.2387 11.7581 11.7622 11.7622 11.8132 11.8535 11.8535 12.2839 12.2839 12.5012 12.5290 12.5881 12.5881 15.5574 15.5574 k = 0.3571 0.1892 0.1299 ( 12598 PWs) bands (ev): -46.7079 -46.7079 -46.7010 -46.7010 -35.1718 -35.1718 -35.1706 -35.1706 -24.4008 -24.4008 -24.3431 -24.3431 -22.3945 -22.3945 -22.3297 -22.3297 -22.3152 -22.3152 -22.2429 -22.2429 -9.1930 -9.1930 -8.6670 -8.6670 -8.6229 -8.6225 -8.5141 -8.5141 -8.1885 -8.1885 -8.1081 -8.1076 3.3848 3.3848 3.4041 3.4159 3.6808 3.6808 4.0319 4.0332 4.0332 4.0392 4.4007 4.4007 4.4754 4.4769 4.5281 4.5281 4.6175 4.6175 5.3830 5.3830 5.3877 5.3925 5.7282 5.7282 6.5071 6.5071 6.8357 6.8357 6.8608 6.8677 6.8902 6.8902 7.2297 7.2297 7.2505 7.2550 11.7088 11.7291 11.7291 11.7644 11.8128 11.8128 12.3109 12.3109 12.5249 12.5503 12.6118 12.6118 15.5112 15.5112 k = 0.3429 0.1817 0.1247 ( 12616 PWs) bands (ev): -46.7082 -46.7082 -46.7007 -46.7007 -35.1719 -35.1719 -35.1706 -35.1706 -24.4034 -24.4034 -24.3404 -24.3404 -22.3981 -22.3981 -22.3335 -22.3335 -22.3115 -22.3115 -22.2388 -22.2388 -9.2230 -9.2230 -8.6874 -8.6874 -8.6455 -8.6452 -8.4821 -8.4821 -8.1650 -8.1650 -8.0831 -8.0827 3.3461 3.3461 3.3637 3.3758 3.6428 3.6428 3.9735 3.9770 3.9770 3.9814 4.4512 4.4512 4.5332 4.5342 4.5697 4.5697 4.5810 4.5810 5.4502 5.4502 5.4544 5.4600 5.7883 5.7883 6.4828 6.4828 6.8194 6.8194 6.8437 6.8507 6.8989 6.8989 7.2455 7.2455 7.2661 7.2705 11.6597 11.6929 11.6929 11.7156 11.7758 11.7758 12.3378 12.3378 12.5458 12.5689 12.6328 12.6328 15.4675 15.4675 k = 0.3286 0.1741 0.1195 ( 12622 PWs) bands (ev): -46.7086 -46.7086 -46.7004 -46.7004 -35.1719 -35.1719 -35.1705 -35.1705 -24.4059 -24.4059 -24.3378 -24.3378 -22.4016 -22.4016 -22.3373 -22.3373 -22.3079 -22.3079 -22.2347 -22.2347 -9.2522 -9.2522 -8.7074 -8.7074 -8.6675 -8.6672 -8.4506 -8.4506 -8.1420 -8.1420 -8.0587 -8.0583 3.3090 3.3090 3.3250 3.3373 3.6054 3.6054 3.9161 3.9215 3.9215 3.9245 4.4962 4.4962 4.5444 4.5444 4.5911 4.5915 4.6192 4.6192 5.5165 5.5165 5.5202 5.5266 5.8477 5.8477 6.4586 6.4586 6.8037 6.8037 6.8274 6.8344 6.9069 6.9069 7.2603 7.2603 7.2807 7.2850 11.6110 11.6532 11.6532 11.6671 11.7429 11.7429 12.3643 12.3643 12.5639 12.5846 12.6510 12.6510 15.4265 15.4265 k = 0.3143 0.1665 0.1143 ( 12610 PWs) bands (ev): -46.7088 -46.7088 -46.7001 -46.7001 -35.1720 -35.1720 -35.1705 -35.1705 -24.4084 -24.4084 -24.3352 -24.3352 -22.4050 -22.4050 -22.3410 -22.3410 -22.3043 -22.3043 -22.2308 -22.2308 -9.2806 -9.2806 -8.7268 -8.7268 -8.6889 -8.6886 -8.4198 -8.4198 -8.1194 -8.1194 -8.0348 -8.0344 3.2735 3.2735 3.2879 3.3005 3.5688 3.5688 3.8601 3.8670 3.8670 3.8689 4.4911 4.4911 4.5639 4.5639 4.6486 4.6488 4.6643 4.6643 5.5819 5.5819 5.5849 5.5921 5.9063 5.9063 6.4346 6.4346 6.7887 6.7888 6.8121 6.8191 6.9138 6.9138 7.2742 7.2742 7.2944 7.2986 11.5628 11.6109 11.6109 11.6189 11.7138 11.7138 12.3904 12.3904 12.5792 12.5975 12.6666 12.6666 15.3882 15.3883 k = 0.3000 0.1590 0.1091 ( 12598 PWs) bands (ev): -46.7091 -46.7091 -46.6997 -46.6997 -35.1720 -35.1720 -35.1704 -35.1704 -24.4108 -24.4108 -24.3327 -24.3327 -22.4083 -22.4083 -22.3445 -22.3445 -22.3009 -22.3008 -22.2270 -22.2270 -9.3080 -9.3080 -8.7456 -8.7456 -8.7096 -8.7092 -8.3898 -8.3898 -8.0972 -8.0972 -8.0114 -8.0110 3.2396 3.2396 3.2526 3.2654 3.5330 3.5330 3.8055 3.8139 3.8139 3.8147 4.4588 4.4588 4.6114 4.6114 4.7050 4.7058 4.7096 4.7096 5.6461 5.6461 5.6484 5.6564 5.9639 5.9639 6.4108 6.4108 6.7748 6.7748 6.7977 6.8047 6.9196 6.9196 7.2870 7.2870 7.3071 7.3111 11.5153 11.5672 11.5672 11.5713 11.6874 11.6874 12.4159 12.4159 12.5916 12.6075 12.6793 12.6793 15.3528 15.3528 k = 0.2857 0.1514 0.1039 ( 12592 PWs) bands (ev): -46.7094 -46.7094 -46.6995 -46.6995 -35.1721 -35.1721 -35.1704 -35.1704 -24.4131 -24.4131 -24.3303 -24.3303 -22.4115 -22.4115 -22.3479 -22.3479 -22.2975 -22.2975 -22.2232 -22.2232 -9.3344 -9.3344 -8.7638 -8.7638 -8.7295 -8.7292 -8.3606 -8.3606 -8.0757 -8.0757 -7.9888 -7.9884 3.2074 3.2074 3.2191 3.2320 3.4980 3.4980 3.7525 3.7621 3.7623 3.7623 4.4263 4.4263 4.6599 4.6599 4.7549 4.7549 4.7606 4.7620 5.7090 5.7090 5.7105 5.7193 6.0203 6.0203 6.3874 6.3874 6.7619 6.7619 6.7844 6.7913 6.9243 6.9243 7.2987 7.2987 7.3187 7.3226 11.4687 11.5228 11.5228 11.5243 11.6631 11.6631 12.4407 12.4407 12.6012 12.6148 12.6895 12.6895 15.3202 15.3202 k = 0.2714 0.1438 0.0987 ( 12580 PWs) bands (ev): -46.7097 -46.7097 -46.6992 -46.6992 -35.1721 -35.1721 -35.1703 -35.1703 -24.4154 -24.4154 -24.3280 -24.3280 -22.4146 -22.4145 -22.3512 -22.3512 -22.2943 -22.2943 -22.2196 -22.2196 -9.3599 -9.3599 -8.7813 -8.7813 -8.7487 -8.7484 -8.3325 -8.3324 -8.0547 -8.0547 -7.9668 -7.9664 3.1769 3.1769 3.1874 3.2004 3.4640 3.4640 3.7013 3.7111 3.7123 3.7123 4.3952 4.3952 4.7075 4.7075 4.8000 4.8000 4.8152 4.8172 5.7705 5.7705 5.7712 5.7808 6.0754 6.0754 6.3644 6.3644 6.7500 6.7500 6.7722 6.7789 6.9280 6.9280 7.3093 7.3093 7.3292 7.3329 11.4231 11.4783 11.4785 11.4785 11.6405 11.6405 12.4648 12.4648 12.6081 12.6193 12.6970 12.6970 15.2904 15.2904 k = 0.2571 0.1363 0.0935 ( 12598 PWs) bands (ev): -46.7099 -46.7099 -46.6989 -46.6989 -35.1722 -35.1722 -35.1703 -35.1703 -24.4175 -24.4175 -24.3257 -24.3257 -22.4175 -22.4175 -22.3544 -22.3544 -22.2912 -22.2911 -22.2161 -22.2161 -9.3843 -9.3843 -8.7981 -8.7981 -8.7671 -8.7668 -8.3053 -8.3053 -8.0344 -8.0344 -7.9456 -7.9452 3.1482 3.1482 3.1575 3.1705 3.4311 3.4311 3.6518 3.6619 3.6641 3.6641 4.3658 4.3658 4.7537 4.7537 4.8448 4.8448 4.8684 4.8710 5.8303 5.8304 5.8304 5.8406 6.1290 6.1290 6.3419 6.3419 6.7393 6.7393 6.7610 6.7676 6.9305 6.9305 7.3188 7.3188 7.3385 7.3421 11.3788 11.4332 11.4348 11.4348 11.6193 11.6193 12.4878 12.4878 12.6123 12.6213 12.7022 12.7022 15.2636 15.2671 k = 0.2429 0.1287 0.0883 ( 12595 PWs) bands (ev): -46.7102 -46.7102 -46.6987 -46.6987 -35.1722 -35.1722 -35.1702 -35.1702 -24.4196 -24.4196 -24.3236 -24.3236 -22.4203 -22.4203 -22.3574 -22.3574 -22.2882 -22.2882 -22.2128 -22.2128 -9.4076 -9.4076 -8.8142 -8.8142 -8.7846 -8.7844 -8.2792 -8.2792 -8.0148 -8.0148 -7.9251 -7.9248 3.1211 3.1211 3.1295 3.1425 3.3993 3.3993 3.6042 3.6146 3.6177 3.6177 4.3383 4.3383 4.7981 4.7981 4.8891 4.8891 4.9202 4.9233 5.8878 5.8886 5.8886 5.8988 6.1809 6.1809 6.3201 6.3201 6.7298 6.7298 6.7510 6.7574 6.9319 6.9319 7.3270 7.3271 7.3467 7.3501 11.3359 11.3893 11.3920 11.3920 11.5994 11.5994 12.5098 12.5098 12.6139 12.6209 12.7053 12.7053 15.2394 15.2395 k = 0.2286 0.1211 0.0831 ( 12586 PWs) bands (ev): -46.7104 -46.7104 -46.6984 -46.6984 -35.1722 -35.1722 -35.1702 -35.1702 -24.4215 -24.4215 -24.3215 -24.3215 -22.4230 -22.4230 -22.3602 -22.3602 -22.2853 -22.2853 -22.2096 -22.2096 -9.4299 -9.4299 -8.8294 -8.8294 -8.8013 -8.8011 -8.2543 -8.2543 -7.9959 -7.9959 -7.9056 -7.9052 3.0959 3.0959 3.1033 3.1164 3.3688 3.3688 3.5586 3.5691 3.5732 3.5732 4.3126 4.3126 4.8408 4.8408 4.9326 4.9326 4.9703 4.9739 5.9433 5.9450 5.9450 5.9550 6.2310 6.2310 6.2991 6.2991 6.7214 6.7214 6.7422 6.7482 6.9323 6.9323 7.3341 7.3341 7.3536 7.3568 11.2945 11.3468 11.3503 11.3503 11.5807 11.5807 12.5304 12.5304 12.6133 12.6182 12.7065 12.7065 15.2178 15.2178 k = 0.2143 0.1135 0.0779 ( 12574 PWs) bands (ev): -46.7107 -46.7107 -46.6982 -46.6982 -35.1723 -35.1723 -35.1701 -35.1701 -24.4234 -24.4234 -24.3195 -24.3195 -22.4255 -22.4255 -22.3630 -22.3630 -22.2826 -22.2826 -22.2066 -22.2066 -9.4509 -9.4509 -8.8439 -8.8439 -8.8171 -8.8169 -8.2306 -8.2306 -7.9778 -7.9778 -7.8869 -7.8866 3.0723 3.0723 3.0790 3.0920 3.3395 3.3395 3.5151 3.5257 3.5308 3.5308 4.2887 4.2887 4.8815 4.8815 4.9750 4.9750 5.0185 5.0225 5.9970 5.9995 5.9995 6.0092 6.2751 6.2751 6.2830 6.2830 6.7142 6.7142 6.7345 6.7402 6.9316 6.9316 7.3400 7.3400 7.3594 7.3624 11.2549 11.3057 11.3101 11.3101 11.5632 11.5632 12.5494 12.5494 12.6104 12.6136 12.7064 12.7064 15.1981 15.1985 k = 0.2000 0.1060 0.0727 ( 12574 PWs) bands (ev): -46.7109 -46.7109 -46.6980 -46.6980 -35.1723 -35.1723 -35.1701 -35.1701 -24.4251 -24.4251 -24.3177 -24.3177 -22.4279 -22.4279 -22.3655 -22.3655 -22.2800 -22.2800 -22.2037 -22.2037 -9.4707 -9.4707 -8.8575 -8.8575 -8.8321 -8.8319 -8.2082 -8.2082 -7.9607 -7.9607 -7.8692 -7.8689 3.0506 3.0506 3.0566 3.0695 3.3117 3.3117 3.4737 3.4843 3.4904 3.4905 4.2666 4.2666 4.9202 4.9202 5.0161 5.0161 5.0645 5.0689 6.0487 6.0517 6.0517 6.0614 6.2589 6.2589 6.3261 6.3261 6.7080 6.7080 6.7278 6.7331 6.9300 6.9300 7.3448 7.3448 7.3640 7.3668 11.2172 11.2663 11.2715 11.2715 11.5469 11.5469 12.5663 12.5663 12.6057 12.6072 12.7054 12.7055 15.1738 15.1741 k = 0.1857 0.0984 0.0675 ( 12574 PWs) bands (ev): -46.7111 -46.7111 -46.6978 -46.6978 -35.1723 -35.1723 -35.1701 -35.1701 -24.4268 -24.4268 -24.3159 -24.3159 -22.4302 -22.4302 -22.3679 -22.3679 -22.2776 -22.2776 -22.2010 -22.2010 -9.4894 -9.4894 -8.8703 -8.8703 -8.8461 -8.8459 -8.1872 -8.1872 -7.9444 -7.9444 -7.8525 -7.8522 3.0306 3.0306 3.0361 3.0488 3.2854 3.2854 3.4345 3.4451 3.4523 3.4523 4.2463 4.2463 4.9569 4.9569 5.0555 5.0555 5.1082 5.1129 6.0982 6.1017 6.1017 6.1114 6.2406 6.2406 6.3701 6.3701 6.7029 6.7029 6.7221 6.7269 6.9275 6.9275 7.3484 7.3484 7.3675 7.3701 11.1815 11.2288 11.2348 11.2348 11.5317 11.5317 12.5807 12.5807 12.5994 12.5995 12.7044 12.7044 15.1241 15.1241 k = 0.1714 0.0908 0.0623 ( 12580 PWs) bands (ev): -46.7113 -46.7113 -46.6976 -46.6976 -35.1724 -35.1724 -35.1700 -35.1700 -24.4283 -24.4283 -24.3143 -24.3143 -22.4323 -22.4323 -22.3702 -22.3702 -22.2753 -22.2753 -22.1985 -22.1985 -9.5067 -9.5067 -8.8822 -8.8822 -8.8591 -8.8589 -8.1675 -8.1675 -7.9291 -7.9291 -7.8369 -7.8366 3.0124 3.0124 3.0175 3.0300 3.2606 3.2606 3.3976 3.4082 3.4164 3.4164 4.2277 4.2277 4.9914 4.9914 5.0931 5.0931 5.1493 5.1542 6.1456 6.1490 6.1490 6.1590 6.2237 6.2237 6.4119 6.4119 6.6986 6.6986 6.7173 6.7216 6.9241 6.9241 7.3509 7.3509 7.3699 7.3723 11.1481 11.1931 11.2001 11.2001 11.5178 11.5178 12.5906 12.5917 12.5920 12.5920 12.7042 12.7042 15.0710 15.0710 k = 0.1571 0.0833 0.0571 ( 12586 PWs) bands (ev): -46.7115 -46.7115 -46.6974 -46.6974 -35.1724 -35.1724 -35.1700 -35.1700 -24.4298 -24.4298 -24.3128 -24.3128 -22.4343 -22.4342 -22.3723 -22.3723 -22.2732 -22.2732 -22.1961 -22.1961 -9.5228 -9.5228 -8.8932 -8.8932 -8.8712 -8.8710 -8.1492 -8.1492 -7.9148 -7.9148 -7.8223 -7.8220 2.9959 2.9959 3.0008 3.0129 3.2376 3.2376 3.3632 3.3735 3.3828 3.3828 4.2107 4.2107 5.0237 5.0237 5.1284 5.1284 5.1876 5.1927 6.1897 6.1897 6.1907 6.2043 6.2121 6.2121 6.4514 6.4514 6.6951 6.6951 6.7133 6.7169 6.9199 6.9199 7.3525 7.3525 7.3713 7.3735 11.1171 11.1596 11.1676 11.1676 11.5050 11.5050 12.5809 12.5830 12.5994 12.5994 12.7056 12.7056 15.0203 15.0203 k = 0.1429 0.0757 0.0519 ( 12586 PWs) bands (ev): -46.7116 -46.7116 -46.6973 -46.6973 -35.1724 -35.1724 -35.1700 -35.1700 -24.4311 -24.4311 -24.3114 -24.3114 -22.4360 -22.4360 -22.3742 -22.3742 -22.2713 -22.2713 -22.1939 -22.1939 -9.5376 -9.5376 -8.9034 -8.9034 -8.8823 -8.8821 -8.1324 -8.1324 -7.9015 -7.9015 -7.8089 -7.8086 2.9811 2.9811 2.9859 2.9976 3.2162 3.2162 3.3312 3.3413 3.3516 3.3516 4.1954 4.1954 5.0536 5.0536 5.1614 5.1614 5.2231 5.2282 6.1887 6.1887 6.2334 6.2408 6.2408 6.2470 6.4883 6.4883 6.6921 6.6922 6.7097 6.7128 6.9150 6.9150 7.3531 7.3531 7.3718 7.3738 11.0886 11.1283 11.1373 11.1373 11.4933 11.4933 12.5707 12.5736 12.6028 12.6028 12.7091 12.7091 14.9730 14.9730 k = 0.1286 0.0681 0.0468 ( 12586 PWs) bands (ev): -46.7118 -46.7118 -46.6971 -46.6971 -35.1725 -35.1725 -35.1699 -35.1699 -24.4323 -24.4323 -24.3101 -24.3101 -22.4377 -22.4377 -22.3759 -22.3759 -22.2695 -22.2695 -22.1920 -22.1920 -9.5510 -9.5510 -8.9126 -8.9126 -8.8924 -8.8923 -8.1170 -8.1170 -7.8894 -7.8894 -7.7966 -7.7964 2.9680 2.9680 2.9729 2.9840 3.1967 3.1967 3.3018 3.3115 3.3230 3.3230 4.1817 4.1817 5.0811 5.0811 5.1919 5.1919 5.2556 5.2605 6.1757 6.1757 6.2737 6.2800 6.2800 6.2871 6.5228 6.5228 6.6896 6.6896 6.7066 6.7089 6.9095 6.9095 7.3530 7.3530 7.3715 7.3732 11.0627 11.0994 11.1096 11.1096 11.4829 11.4829 12.5604 12.5638 12.6027 12.6027 12.7145 12.7145 14.9293 14.9293 k = 0.1143 0.0606 0.0416 ( 12592 PWs) bands (ev): -46.7119 -46.7119 -46.6970 -46.6970 -35.1725 -35.1725 -35.1699 -35.1699 -24.4333 -24.4333 -24.3090 -24.3090 -22.4391 -22.4391 -22.3775 -22.3775 -22.2679 -22.2679 -22.1902 -22.1902 -9.5631 -9.5631 -8.9209 -8.9209 -8.9015 -8.9013 -8.1033 -8.1033 -7.8784 -7.8784 -7.7855 -7.7853 2.9566 2.9566 2.9616 2.9721 3.1791 3.1791 3.2752 3.2844 3.2969 3.2969 4.1695 4.1695 5.1061 5.1061 5.2195 5.2195 5.2849 5.2896 6.1633 6.1633 6.3114 6.3172 6.3172 6.3245 6.5545 6.5545 6.6873 6.6873 6.7036 6.7052 6.9035 6.9035 7.3522 7.3522 7.3706 7.3721 11.0395 11.0729 11.0844 11.0844 11.4736 11.4736 12.5503 12.5540 12.5999 12.5999 12.7213 12.7213 14.8895 14.8895 k = 0.1000 0.0530 0.0364 ( 12598 PWs) bands (ev): -46.7121 -46.7121 -46.6968 -46.6968 -35.1725 -35.1725 -35.1699 -35.1699 -24.4343 -24.4343 -24.3080 -24.3080 -22.4405 -22.4404 -22.3789 -22.3789 -22.2665 -22.2665 -22.1886 -22.1886 -9.5738 -9.5738 -8.9282 -8.9282 -8.9095 -8.9094 -8.0910 -8.0910 -7.8686 -7.8686 -7.7756 -7.7755 2.9467 2.9467 2.9521 2.9617 3.1634 3.1634 3.2514 3.2599 3.2736 3.2736 4.1589 4.1589 5.1283 5.1283 5.2443 5.2443 5.3109 5.3153 6.1521 6.1521 6.3464 6.3515 6.3515 6.3589 6.5835 6.5835 6.6850 6.6850 6.7006 6.7015 6.8971 6.8971 7.3510 7.3510 7.3692 7.3705 11.0191 11.0490 11.0620 11.0620 11.4654 11.4654 12.5407 12.5444 12.5954 12.5954 12.7285 12.7285 14.8538 14.8538 k = 0.0857 0.0454 0.0312 ( 12593 PWs) bands (ev): -46.7122 -46.7122 -46.6967 -46.6967 -35.1725 -35.1725 -35.1699 -35.1699 -24.4351 -24.4351 -24.3071 -24.3071 -22.4416 -22.4416 -22.3801 -22.3801 -22.2653 -22.2653 -22.1872 -22.1872 -9.5831 -9.5831 -8.9346 -8.9346 -8.9165 -8.9164 -8.0804 -8.0804 -7.8600 -7.8600 -7.7671 -7.7669 2.9383 2.9383 2.9442 2.9529 3.1497 3.1497 3.2305 3.2382 3.2531 3.2531 4.1497 4.1497 5.1479 5.1479 5.2660 5.2660 5.3336 5.3376 6.1422 6.1422 6.3785 6.3826 6.3826 6.3901 6.6096 6.6096 6.6827 6.6827 6.6974 6.6977 6.8904 6.8904 7.3494 7.3494 7.3675 7.3686 11.0017 11.0278 11.0423 11.0423 11.4584 11.4584 12.5318 12.5354 12.5902 12.5902 12.7357 12.7357 14.8224 14.8224 k = 0.0714 0.0378 0.0260 ( 12581 PWs) bands (ev): -46.7122 -46.7122 -46.6966 -46.6966 -35.1725 -35.1725 -35.1699 -35.1699 -24.4358 -24.4358 -24.3063 -24.3063 -22.4425 -22.4425 -22.3811 -22.3811 -22.2643 -22.2643 -22.1860 -22.1860 -9.5910 -9.5910 -8.9400 -8.9400 -8.9224 -8.9223 -8.0713 -8.0713 -7.8527 -7.8527 -7.7597 -7.7596 2.9314 2.9314 2.9379 2.9455 3.1380 3.1380 3.2127 3.2195 3.2355 3.2355 4.1420 4.1420 5.1645 5.1645 5.2846 5.2846 5.3529 5.3564 6.1338 6.1338 6.4073 6.4103 6.4103 6.4178 6.6326 6.6326 6.6802 6.6802 6.6937 6.6940 6.8838 6.8838 7.3477 7.3477 7.3657 7.3665 10.9872 11.0093 11.0256 11.0256 11.4526 11.4526 12.5239 12.5272 12.5848 12.5848 12.7422 12.7422 14.7955 14.7955 k = 0.0571 0.0303 0.0208 ( 12566 PWs) bands (ev): -46.7123 -46.7123 -46.6966 -46.6966 -35.1725 -35.1725 -35.1698 -35.1698 -24.4364 -24.4364 -24.3057 -24.3057 -22.4433 -22.4433 -22.3819 -22.3819 -22.2634 -22.2634 -22.1851 -22.1851 -9.5974 -9.5974 -8.9444 -8.9444 -8.9273 -8.9272 -8.0639 -8.0639 -7.8467 -7.8467 -7.7537 -7.7536 2.9259 2.9259 2.9331 2.9394 3.1285 3.1285 3.1981 3.2037 3.2209 3.2209 4.1358 4.1358 5.1783 5.1783 5.2999 5.2999 5.3689 5.3718 6.1268 6.1268 6.4325 6.4342 6.4342 6.4416 6.6521 6.6521 6.6776 6.6776 6.6897 6.6904 6.8774 6.8774 7.3460 7.3460 7.3639 7.3646 10.9757 10.9936 11.0117 11.0117 11.4478 11.4478 12.5172 12.5200 12.5799 12.5799 12.7479 12.7479 14.7733 14.7733 k = 0.0429 0.0227 0.0156 ( 12569 PWs) bands (ev): -46.7124 -46.7124 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4368 -24.4368 -24.3052 -24.3052 -22.4439 -22.4439 -22.3826 -22.3826 -22.2627 -22.2627 -22.1843 -22.1843 -9.6025 -9.6025 -8.9479 -8.9479 -8.9311 -8.9310 -8.0581 -8.0581 -7.8420 -7.8420 -7.7490 -7.7489 2.9217 2.9217 2.9297 2.9346 3.1210 3.1210 3.1867 3.1912 3.2095 3.2095 4.1309 4.1309 5.1890 5.1890 5.3119 5.3119 5.3814 5.3836 6.1214 6.1214 6.4535 6.4537 6.4537 6.4609 6.6673 6.6673 6.6758 6.6758 6.6859 6.6868 6.8716 6.8716 7.3445 7.3445 7.3623 7.3628 10.9673 10.9809 11.0009 11.0009 11.4441 11.4441 12.5119 12.5141 12.5756 12.5756 12.7525 12.7525 14.7558 14.7558 k = 0.0286 0.0151 0.0104 ( 12581 PWs) bands (ev): -46.7124 -46.7124 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4372 -24.4372 -24.3049 -24.3049 -22.4444 -22.4444 -22.3830 -22.3830 -22.2623 -22.2623 -22.1838 -22.1838 -9.6061 -9.6061 -8.9504 -8.9504 -8.9338 -8.9337 -8.0540 -8.0540 -7.8386 -7.8386 -7.7456 -7.7456 2.9187 2.9187 2.9276 2.9309 3.1156 3.1156 3.1788 3.1819 3.2012 3.2012 4.1275 4.1275 5.1968 5.1968 5.3206 5.3206 5.3904 5.3919 6.1175 6.1175 6.4683 6.4683 6.4698 6.4750 6.6711 6.6711 6.6816 6.6816 6.6827 6.6835 6.8669 6.8669 7.3434 7.3434 7.3611 7.3614 10.9619 10.9710 10.9932 10.9932 11.4414 11.4414 12.5081 12.5097 12.5725 12.5725 12.7559 12.7559 14.7433 14.7433 k = 0.0143 0.0076 0.0052 ( 12581 PWs) bands (ev): -46.7124 -46.7124 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4374 -24.4374 -24.3047 -24.3047 -22.4447 -22.4447 -22.3833 -22.3833 -22.2620 -22.2620 -22.1835 -22.1835 -9.6083 -9.6083 -8.9519 -8.9519 -8.9354 -8.9354 -8.0515 -8.0515 -7.8366 -7.8366 -7.7436 -7.7436 2.9170 2.9170 2.9267 2.9284 3.1124 3.1124 3.1744 3.1759 3.1962 3.1962 4.1254 4.1254 5.2014 5.2014 5.3257 5.3257 5.3960 5.3967 6.1151 6.1151 6.4773 6.4773 6.4806 6.4833 6.6699 6.6699 6.6806 6.6811 6.6886 6.6886 6.8637 6.8637 7.3426 7.3426 7.3604 7.3605 10.9596 10.9642 10.9885 10.9885 11.4399 11.4399 12.5060 12.5068 12.5705 12.5705 12.7579 12.7579 14.7358 14.7358 k = 0.0000 0.0000 0.0000 ( 12581 PWs) bands (ev): -46.7124 -46.7124 -46.6964 -46.6964 -35.1726 -35.1726 -35.1698 -35.1698 -24.4374 -24.4374 -24.3046 -24.3046 -22.4447 -22.4447 -22.3834 -22.3834 -22.2619 -22.2619 -22.1833 -22.1833 -9.6090 -9.6090 -8.9524 -8.9524 -8.9359 -8.9359 -8.0507 -8.0507 -7.8359 -7.8359 -7.7429 -7.7429 2.9164 2.9164 2.9270 2.9270 3.1113 3.1113 3.1734 3.1734 3.1946 3.1946 4.1247 4.1247 5.2029 5.2029 5.3275 5.3275 5.3981 5.3981 6.1143 6.1143 6.4804 6.4804 6.4852 6.4852 6.6694 6.6694 6.6800 6.6800 6.6911 6.6911 6.8627 6.8627 7.3424 7.3424 7.3602 7.3602 10.9604 10.9604 10.9870 10.9870 11.4393 11.4393 12.5055 12.5055 12.5698 12.5698 12.7586 12.7586 14.7333 14.7333 k = 0.0000 0.0000 0.0000 ( 12581 PWs) bands (ev): -46.7124 -46.7124 -46.6964 -46.6964 -35.1726 -35.1726 -35.1698 -35.1698 -24.4374 -24.4374 -24.3046 -24.3046 -22.4447 -22.4447 -22.3834 -22.3834 -22.2619 -22.2619 -22.1833 -22.1833 -9.6090 -9.6090 -8.9524 -8.9524 -8.9359 -8.9359 -8.0507 -8.0507 -7.8359 -7.8359 -7.7429 -7.7429 2.9164 2.9164 2.9270 2.9270 3.1113 3.1113 3.1734 3.1734 3.1946 3.1946 4.1247 4.1247 5.2029 5.2029 5.3275 5.3275 5.3981 5.3981 6.1143 6.1143 6.4804 6.4804 6.4852 6.4852 6.6694 6.6694 6.6800 6.6800 6.6911 6.6911 6.8627 6.8627 7.3424 7.3424 7.3602 7.3602 10.9604 10.9604 10.9870 10.9870 11.4393 11.4393 12.5055 12.5055 12.5698 12.5698 12.7586 12.7586 14.7333 14.7333 k = 0.0082-0.0055-0.0144 ( 12583 PWs) bands (ev): -46.7124 -46.7124 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4377 -24.4371 -24.3050 -24.3044 -22.4447 -22.4447 -22.3838 -22.3829 -22.2620 -22.2620 -22.1839 -22.1830 -9.6086 -9.6080 -8.9527 -8.9512 -8.9355 -8.9355 -8.0542 -8.0480 -7.8391 -7.8341 -7.7436 -7.7436 2.9136 2.9168 2.9259 2.9263 3.1109 3.1160 3.1753 3.1757 3.1959 3.1973 4.1249 4.1250 5.1974 5.2048 5.3219 5.3289 5.3962 5.3965 6.1120 6.1147 6.4776 6.4808 6.4844 6.4856 6.6652 6.6666 6.6774 6.6778 6.6997 6.7006 6.8639 6.8641 7.3410 7.3415 7.3590 7.3590 10.9603 10.9606 10.9854 10.9897 11.4364 11.4404 12.5063 12.5065 12.5656 12.5758 12.7545 12.7613 14.7353 14.7357 k = 0.0163-0.0111-0.0288 ( 12577 PWs) bands (ev): -46.7124 -46.7124 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4378 -24.4366 -24.3054 -24.3043 -22.4445 -22.4445 -22.3840 -22.3821 -22.2622 -22.2622 -22.1846 -22.1828 -9.6066 -9.6055 -8.9523 -8.9494 -8.9343 -8.9341 -8.0585 -8.0461 -7.8436 -7.8335 -7.7458 -7.7457 2.9079 2.9153 2.9227 2.9251 3.1147 3.1235 3.1803 3.1836 3.2009 3.2047 4.1256 4.1257 5.1882 5.2027 5.3120 5.3260 5.3901 5.3922 6.1081 6.1134 6.4717 6.4770 6.4834 6.4886 6.6562 6.6574 6.6799 6.6812 6.7144 6.7159 6.8679 6.8683 7.3373 7.3383 7.3554 7.3554 10.9597 10.9616 10.9858 10.9933 11.4316 11.4398 12.5076 12.5095 12.5640 12.5833 12.7489 12.7626 14.7419 14.7426 k = 0.0245-0.0166-0.0432 ( 12571 PWs) bands (ev): -46.7124 -46.7124 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4379 -24.4360 -24.3060 -24.3043 -22.4441 -22.4441 -22.3841 -22.3812 -22.2627 -22.2627 -22.1855 -22.1828 -9.6033 -9.6016 -8.9511 -8.9469 -8.9324 -8.9315 -8.0638 -8.0451 -7.8496 -7.8342 -7.7495 -7.7490 2.9003 2.9113 2.9188 2.9237 3.1215 3.1319 3.1878 3.1980 3.2086 3.2184 4.1269 4.1271 5.1753 5.1961 5.2979 5.3186 5.3799 5.3866 6.1029 6.1107 6.4621 6.4695 6.4847 6.4933 6.6465 6.6475 6.6857 6.6883 6.7308 6.7331 6.8747 6.8749 7.3315 7.3329 7.3495 7.3496 10.9578 10.9637 10.9886 10.9975 11.4254 11.4377 12.5070 12.5138 12.5667 12.5926 12.7420 12.7628 14.7528 14.7539 k = 0.0327-0.0222-0.0576 ( 12569 PWs) bands (ev): -46.7123 -46.7123 -46.6965 -46.6965 -35.1726 -35.1726 -35.1698 -35.1698 -24.4378 -24.4353 -24.3067 -24.3045 -22.4437 -22.4436 -22.3839 -22.3801 -22.2634 -22.2633 -22.1865 -22.1830 -9.5985 -9.5962 -8.9492 -8.9440 -8.9297 -8.9277 -8.0699 -8.0449 -7.8571 -7.8361 -7.7547 -7.7534 2.8919 2.9051 2.9155 2.9220 3.1300 3.1406 3.1973 3.2168 3.2199 3.2388 4.1288 4.1291 5.1585 5.1842 5.2793 5.3059 5.3670 5.3808 6.0969 6.1069 6.4496 6.4591 6.4882 6.4998 6.6367 6.6377 6.6936 6.6975 6.7479 6.7510 6.8838 6.8839 7.3238 7.3253 7.3415 7.3417 10.9548 10.9669 10.9933 11.0029 11.4182 11.4347 12.5030 12.5183 12.5744 12.6043 12.7338 12.7623 14.7679 14.7694 k = 0.0409-0.0277-0.0720 ( 12561 PWs) bands (ev): -46.7123 -46.7123 -46.6966 -46.6966 -35.1725 -35.1725 -35.1698 -35.1698 -24.4376 -24.4345 -24.3076 -24.3047 -22.4431 -22.4430 -22.3837 -22.3789 -22.2642 -22.2641 -22.1877 -22.1834 -9.5922 -9.5895 -8.9467 -8.9405 -8.9263 -8.9226 -8.0769 -8.0456 -7.8661 -7.8393 -7.7614 -7.7588 2.8839 2.8981 2.9125 2.9201 3.1396 3.1497 3.2085 3.2286 3.2451 3.2655 4.1315 4.1320 5.1377 5.1660 5.2566 5.2861 5.3540 5.3755 6.0906 6.1027 6.4353 6.4467 6.4940 6.5079 6.6264 6.6276 6.7028 6.7079 6.7650 6.7691 6.8945 6.8952 7.3143 7.3158 7.3316 7.3317 10.9511 10.9710 10.9989 11.0101 11.4105 11.4312 12.4953 12.5215 12.5858 12.6185 12.7250 12.7616 14.7868 14.7887 k = 0.0490-0.0333-0.0863 ( 12557 PWs) bands (ev): -46.7122 -46.7122 -46.6967 -46.6967 -35.1725 -35.1725 -35.1699 -35.1699 -24.4373 -24.4336 -24.3085 -24.3051 -22.4425 -22.4422 -22.3832 -22.3774 -22.2653 -22.2650 -22.1891 -22.1840 -9.5846 -9.5814 -8.9438 -8.9364 -8.9220 -8.9161 -8.0849 -8.0471 -7.8768 -7.8438 -7.7693 -7.7651 2.8769 2.8917 2.9096 2.9180 3.1504 3.1598 3.2211 3.2408 3.2754 3.2973 4.1351 4.1359 5.1130 5.1411 5.2298 5.2580 5.3433 5.3712 6.0844 6.0984 6.4197 6.4330 6.5019 6.5178 6.6155 6.6169 6.7126 6.7189 6.7819 6.7869 6.9063 6.9080 7.3032 7.3046 7.3199 7.3202 10.9471 10.9759 11.0049 11.0198 11.4031 11.4279 12.4845 12.5225 12.5989 12.6344 12.7166 12.7613 14.8090 14.8114 k = 0.0572-0.0388-0.1007 ( 12567 PWs) bands (ev): -46.7121 -46.7121 -46.6968 -46.6968 -35.1725 -35.1725 -35.1699 -35.1699 -24.4369 -24.4326 -24.3096 -24.3056 -22.4417 -22.4413 -22.3825 -22.3758 -22.2665 -22.2662 -22.1906 -22.1847 -9.5756 -9.5719 -8.9405 -8.9317 -8.9167 -8.9083 -8.0938 -8.0495 -7.8891 -7.8495 -7.7786 -7.7720 2.8713 2.8864 2.9067 2.9156 3.1626 3.1711 3.2347 3.2541 3.3094 3.3330 4.1398 4.1410 5.0843 5.1096 5.1991 5.2219 5.3355 5.3679 6.0786 6.0943 6.4035 6.4185 6.5117 6.5291 6.6037 6.6054 6.7225 6.7300 6.7982 6.8040 6.9182 6.9214 7.2904 7.2926 7.3066 7.3079 10.9431 10.9809 11.0118 11.0317 11.3964 11.4253 12.4710 12.5207 12.6115 12.6495 12.7108 12.7624 14.8337 14.8367 k = 0.0654-0.0444-0.1151 ( 12573 PWs) bands (ev): -46.7120 -46.7120 -46.6969 -46.6969 -35.1725 -35.1725 -35.1699 -35.1699 -24.4364 -24.4315 -24.3107 -24.3063 -22.4409 -22.4402 -22.3817 -22.3740 -22.2680 -22.2675 -22.1922 -22.1856 -9.5653 -9.5611 -8.9369 -8.9264 -8.9103 -8.8993 -8.1037 -8.0528 -7.9031 -7.8567 -7.7888 -7.7794 2.8675 2.8828 2.9040 2.9133 3.1764 3.1839 3.2494 3.2681 3.3465 3.3719 4.1459 4.1475 5.0510 5.0727 5.1645 5.1799 5.3303 5.3656 6.0732 6.0904 6.3870 6.4036 6.5232 6.5417 6.5908 6.5929 6.7320 6.7405 6.8138 6.8204 6.9289 6.9341 7.2758 7.2804 7.2921 7.2956 10.9393 10.9856 11.0205 11.0458 11.3911 11.4240 12.4550 12.5155 12.6214 12.6591 12.7124 12.7659 14.8597 14.8635 k = 0.0735-0.0499-0.1295 ( 12571 PWs) bands (ev): -46.7119 -46.7119 -46.6970 -46.6970 -35.1725 -35.1725 -35.1699 -35.1699 -24.4358 -24.4304 -24.3120 -24.3070 -22.4399 -22.4390 -22.3807 -22.3720 -22.2697 -22.2689 -22.1940 -22.1867 -9.5538 -9.5491 -8.9329 -8.9206 -8.9028 -8.8893 -8.1147 -8.0571 -7.9190 -7.8654 -7.7998 -7.7873 2.8653 2.8807 2.9018 2.9113 3.1918 3.1982 3.2648 3.2828 3.3862 3.4134 4.1534 4.1558 5.0116 5.0325 5.1229 5.1370 5.3267 5.3639 6.0682 6.0866 6.3706 6.3886 6.5360 6.5539 6.5775 6.5799 6.7406 6.7501 6.8286 6.8359 6.9375 6.9451 7.2599 7.2674 7.2779 7.2842 10.9360 10.9896 11.0313 11.0616 11.3875 11.4242 12.4366 12.5067 12.6265 12.6601 12.7241 12.7727 14.8848 14.8899 k = 0.0817-0.0555-0.1439 ( 12575 PWs) bands (ev): -46.7117 -46.7117 -46.6971 -46.6971 -35.1725 -35.1725 -35.1699 -35.1699 -24.4351 -24.4291 -24.3134 -24.3079 -22.4389 -22.4377 -22.3795 -22.3698 -22.2716 -22.2705 -22.1958 -22.1879 -9.5410 -9.5358 -8.9284 -8.9143 -8.8940 -8.8781 -8.1267 -8.0625 -7.9365 -7.8759 -7.8112 -7.7954 2.8646 2.8803 2.9005 2.9099 3.2086 3.2138 3.2809 3.2980 3.4281 3.4571 4.1627 4.1660 4.9647 4.9911 5.0729 5.0971 5.3243 5.3628 6.0636 6.0829 6.3544 6.3738 6.5485 6.5551 6.5644 6.5770 6.7480 6.7585 6.8425 6.8502 6.9430 6.9534 7.2428 7.2521 7.2665 7.2749 10.9335 10.9932 11.0444 11.0793 11.3860 11.4262 12.4158 12.4941 12.6262 12.6566 12.7415 12.7828 14.9065 14.9137 k = 0.0899-0.0610-0.1583 ( 12575 PWs) bands (ev): -46.7116 -46.7116 -46.6973 -46.6973 -35.1725 -35.1725 -35.1700 -35.1700 -24.4342 -24.4277 -24.3149 -24.3089 -22.4378 -22.4363 -22.3782 -22.3675 -22.2737 -22.2723 -22.1978 -22.1892 -9.5271 -9.5215 -8.9234 -8.9075 -8.8840 -8.8659 -8.1398 -8.0688 -7.9558 -7.8883 -7.8226 -7.8037 2.8651 2.8809 2.9006 2.9099 3.2265 3.2310 3.2977 3.3138 3.4719 3.5026 4.1740 4.1782 4.9114 4.9473 5.0196 5.0573 5.3226 5.3618 6.0589 6.0790 6.3385 6.3593 6.5400 6.5439 6.5673 6.5897 6.7539 6.7655 6.8548 6.8628 6.9453 6.9586 7.2249 7.2344 7.2592 7.2687 10.9320 10.9966 11.0597 11.0985 11.3868 11.4303 12.3927 12.4775 12.6218 12.6518 12.7600 12.7952 14.9220 14.9321 k = 0.0981-0.0666-0.1727 ( 12573 PWs) bands (ev): -46.7114 -46.7114 -46.6974 -46.6974 -35.1724 -35.1724 -35.1700 -35.1700 -24.4333 -24.4263 -24.3165 -24.3100 -22.4367 -22.4347 -22.3766 -22.3650 -22.2760 -22.2742 -22.1998 -22.1907 -9.5122 -9.5061 -8.9179 -8.9001 -8.8729 -8.8527 -8.1539 -8.0763 -7.9768 -7.9028 -7.8338 -7.8121 2.8658 2.8819 2.9028 2.9124 3.2450 3.2496 3.3150 3.3300 3.5172 3.5497 4.1872 4.1927 4.8536 4.8987 4.9671 5.0168 5.3212 5.3608 6.0540 6.0746 6.3230 6.3450 6.5216 6.5260 6.5817 6.6046 6.7580 6.7707 6.8646 6.8723 6.9455 6.9614 7.2063 7.2154 7.2556 7.2660 10.9317 11.0002 11.0770 11.1192 11.3899 11.4364 12.3674 12.4572 12.6150 12.6458 12.7776 12.8088 14.9305 14.9438 k = 0.1062-0.0721-0.1871 ( 12575 PWs) bands (ev): -46.7113 -46.7113 -46.6976 -46.6976 -35.1724 -35.1724 -35.1700 -35.1700 -24.4323 -24.4248 -24.3181 -24.3112 -22.4355 -22.4330 -22.3749 -22.3622 -22.2786 -22.2763 -22.2019 -22.1923 -9.4962 -9.4896 -8.9117 -8.8922 -8.8606 -8.8386 -8.1691 -8.0849 -7.9993 -7.9196 -7.8444 -7.8205 2.8662 2.8824 2.9081 2.9181 3.2635 3.2695 3.3329 3.3469 3.5640 3.5981 4.2026 4.2094 4.7924 4.8435 4.9180 4.9756 5.3199 5.3597 6.0486 6.0694 6.3076 6.3307 6.5013 6.5058 6.5966 6.6193 6.7601 6.7740 6.8703 6.8765 6.9464 6.9636 7.1875 7.1957 7.2554 7.2667 10.9330 11.0044 11.0959 11.1413 11.3954 11.4447 12.3400 12.4335 12.6072 12.6386 12.7932 12.8222 14.9329 14.9493 k = 0.1144-0.0777-0.2015 ( 12571 PWs) bands (ev): -46.7111 -46.7111 -46.6977 -46.6977 -35.1724 -35.1724 -35.1701 -35.1701 -24.4311 -24.4232 -24.3199 -24.3125 -22.4342 -22.4313 -22.3730 -22.3593 -22.2813 -22.2786 -22.2041 -22.1940 -9.4794 -9.4723 -8.9050 -8.8837 -8.8472 -8.8236 -8.1854 -8.0948 -8.0234 -7.9385 -7.8544 -7.8289 2.8659 2.8821 2.9168 2.9275 3.2820 3.2901 3.3514 3.3648 3.6119 3.6477 4.2199 4.2282 4.7292 4.7825 4.8725 4.9340 5.3186 5.3583 6.0423 6.0632 6.2923 6.3162 6.4794 6.4837 6.6110 6.6331 6.7599 6.7750 6.8706 6.8739 6.9509 6.9676 7.1687 7.1758 7.2582 7.2699 10.9358 11.0094 11.1164 11.1646 11.4030 11.4551 12.3109 12.4070 12.5989 12.6304 12.8063 12.8343 14.9314 14.9504 k = 0.1226-0.0832-0.2159 ( 12579 PWs) bands (ev): -46.7109 -46.7109 -46.6979 -46.6979 -35.1724 -35.1724 -35.1701 -35.1701 -24.4299 -24.4215 -24.3217 -24.3139 -22.4329 -22.4295 -22.3709 -22.3563 -22.2843 -22.2810 -22.2063 -22.1958 -9.4618 -9.4541 -8.8975 -8.8745 -8.8328 -8.8078 -8.2028 -8.1059 -8.0487 -7.9593 -7.8639 -7.8373 2.8651 2.8810 2.9289 2.9402 3.3001 3.3107 3.3708 3.3838 3.6610 3.6982 4.2389 4.2487 4.6647 4.7179 4.8298 4.8924 5.3172 5.3565 6.0349 6.0558 6.2764 6.3008 6.4562 6.4601 6.6242 6.6447 6.7572 6.7735 6.8654 6.8671 6.9594 6.9746 7.1501 7.1561 7.2632 7.2750 10.9404 11.0156 11.1382 11.1890 11.4128 11.4675 12.2802 12.3783 12.5902 12.6211 12.8165 12.8446 14.9276 14.9487 k = 0.1308-0.0887-0.2303 ( 12583 PWs) bands (ev): -46.7107 -46.7107 -46.6981 -46.6981 -35.1723 -35.1723 -35.1701 -35.1701 -24.4286 -24.4198 -24.3236 -24.3154 -22.4316 -22.4276 -22.3686 -22.3530 -22.2874 -22.2836 -22.2085 -22.1977 -9.4435 -9.4352 -8.8893 -8.8645 -8.8174 -8.7911 -8.2212 -8.1185 -8.0751 -7.9818 -7.8729 -7.8457 2.8639 2.8796 2.9441 2.9558 3.3177 3.3305 3.3914 3.4043 3.7110 3.7496 4.2587 4.2697 4.6004 4.6518 4.7893 4.8512 5.3155 5.3542 6.0261 6.0468 6.2595 6.2837 6.4322 6.4357 6.6354 6.6531 6.7518 6.7693 6.8563 6.8606 6.9701 6.9839 7.1322 7.1369 7.2695 7.2811 10.9469 11.0232 11.1609 11.2141 11.4246 11.4817 12.2484 12.3479 12.5809 12.6111 12.8237 12.8525 14.9228 14.9457 k = 0.1389-0.0943-0.2447 ( 12575 PWs) bands (ev): -46.7105 -46.7105 -46.6983 -46.6983 -35.1723 -35.1723 -35.1702 -35.1702 -24.4272 -24.4180 -24.3256 -24.3170 -22.4302 -22.4256 -22.3661 -22.3496 -22.2908 -22.2863 -22.2108 -22.1997 -9.4247 -9.4157 -8.8803 -8.8538 -8.8010 -8.7737 -8.2407 -8.1330 -8.1020 -8.0058 -7.8814 -7.8539 2.8626 2.8781 2.9622 2.9742 3.3346 3.3490 3.4135 3.4263 3.7618 3.8017 4.2778 4.2891 4.5385 4.5863 4.7510 4.8111 5.3135 5.3514 6.0153 6.0359 6.2407 6.2637 6.4084 6.4113 6.6438 6.6567 6.7440 6.7629 6.8488 6.8553 6.9816 6.9942 7.1154 7.1188 7.2765 7.2875 10.9553 11.0321 11.1843 11.2395 11.4382 11.4978 12.2160 12.3165 12.5709 12.6004 12.8277 12.8577 14.9178 14.9424 k = 0.1471-0.0998-0.2590 ( 12579 PWs) bands (ev): -46.7103 -46.7103 -46.6985 -46.6985 -35.1723 -35.1723 -35.1702 -35.1702 -24.4257 -24.4161 -24.3277 -24.3187 -22.4288 -22.4236 -22.3634 -22.3460 -22.2943 -22.2892 -22.2131 -22.2017 -9.4054 -9.3957 -8.8704 -8.8422 -8.7838 -8.7557 -8.2612 -8.1506 -8.1281 -8.0311 -7.8895 -7.8621 2.8612 2.8766 2.9830 2.9951 3.3509 3.3659 3.4372 3.4495 3.8135 3.8544 4.2929 4.3016 4.4836 4.5245 4.7157 4.7731 5.3110 5.3479 6.0022 6.0226 6.2192 6.2398 6.3856 6.3885 6.6483 6.6542 6.7340 6.7553 6.8452 6.8530 6.9926 7.0041 7.1000 7.1023 7.2833 7.2937 10.9656 11.0426 11.2080 11.2650 11.4534 11.5155 12.1835 12.2847 12.5603 12.5890 12.8287 12.8600 14.9134 14.9393 k = 0.1553-0.1054-0.2734 ( 12583 PWs) bands (ev): -46.7101 -46.7101 -46.6988 -46.6988 -35.1722 -35.1722 -35.1702 -35.1702 -24.4242 -24.4142 -24.3298 -24.3204 -22.4274 -22.4215 -22.3606 -22.3423 -22.2980 -22.2922 -22.2154 -22.2038 -9.3858 -9.3753 -8.8596 -8.8298 -8.7658 -8.7370 -8.2826 -8.1736 -8.1508 -8.0574 -7.8973 -7.8701 2.8600 2.8750 3.0062 3.0184 3.3666 3.3816 3.4623 3.4735 3.8658 3.9074 4.2928 4.3005 4.4450 4.4735 4.6851 4.7387 5.3080 5.3437 5.9860 6.0063 6.1947 6.2114 6.3649 6.3682 6.6453 6.6482 6.7229 6.7480 6.8457 6.8542 7.0019 7.0125 7.0872 7.0884 7.2897 7.2991 10.9777 11.0546 11.2315 11.2899 11.4702 11.5348 12.1516 12.2532 12.5489 12.5770 12.8267 12.8597 14.9099 14.9370 k = 0.1634-0.1109-0.2878 ( 12572 PWs) bands (ev): -46.7098 -46.7098 -46.6990 -46.6990 -35.1722 -35.1722 -35.1703 -35.1703 -24.4225 -24.4123 -24.3320 -24.3223 -22.4259 -22.4195 -22.3575 -22.3384 -22.3019 -22.2953 -22.2177 -22.2059 -9.3660 -9.3546 -8.8478 -8.8165 -8.7469 -8.7178 -8.3049 -8.2018 -8.1702 -8.0847 -7.9047 -7.8781 2.8588 2.8736 3.0316 3.0439 3.3820 3.3963 3.4882 3.4980 3.9185 3.9605 4.2599 4.2841 4.4234 4.4477 4.6619 4.7103 5.3044 5.3386 5.9657 5.9861 6.1675 6.1795 6.3470 6.3508 6.6315 6.6423 6.7123 6.7411 6.8496 6.8583 7.0083 7.0180 7.0779 7.0784 7.2952 7.3037 10.9916 11.0681 11.2542 11.3134 11.4884 11.5555 12.1211 12.2227 12.5367 12.5646 12.8219 12.8566 14.9076 14.9357 k = 0.1716-0.1165-0.3022 ( 12584 PWs) bands (ev): -46.7096 -46.7096 -46.6992 -46.6992 -35.1722 -35.1722 -35.1703 -35.1703 -24.4208 -24.4103 -24.3342 -24.3242 -22.4245 -22.4174 -22.3543 -22.3345 -22.3060 -22.2986 -22.2200 -22.2080 -9.3461 -9.3338 -8.8349 -8.8022 -8.7273 -8.6982 -8.3280 -8.2326 -8.1888 -8.1127 -7.9120 -7.8859 2.8576 2.8721 3.0591 3.0714 3.3973 3.4106 3.5143 3.5222 3.9711 4.0124 4.2093 4.2455 4.4099 4.4433 4.6496 4.6913 5.3001 5.3326 5.9403 5.9609 6.1389 6.1464 6.3321 6.3360 6.6143 6.6308 6.7038 6.7343 6.8557 6.8641 7.0106 7.0197 7.0724 7.0746 7.2996 7.3070 11.0072 11.0830 11.2755 11.3347 11.5081 11.5775 12.0930 12.1939 12.5237 12.5516 12.8145 12.8511 14.9069 14.9359 k = 0.1798-0.1220-0.3166 ( 12586 PWs) bands (ev): -46.7094 -46.7094 -46.6995 -46.6995 -35.1721 -35.1721 -35.1704 -35.1704 -24.4190 -24.4083 -24.3365 -24.3262 -22.4229 -22.4153 -22.3509 -22.3304 -22.3101 -22.3021 -22.2223 -22.2102 -9.3262 -9.3130 -8.8210 -8.7870 -8.7071 -8.6782 -8.3518 -8.2647 -8.2076 -8.1413 -7.9190 -7.8937 2.8565 2.8707 3.0886 3.1007 3.4129 3.4250 3.5395 3.5454 4.0212 4.0592 4.1558 4.1991 4.3986 4.4381 4.6513 4.6848 5.2947 5.3254 5.9089 5.9294 6.1094 6.1158 6.3197 6.3233 6.5950 6.6149 6.6974 6.7274 6.8621 6.8697 7.0096 7.0184 7.0718 7.0753 7.3026 7.3089 11.0242 11.0991 11.2946 11.3528 11.5291 11.6007 12.0683 12.1678 12.5099 12.5383 12.8047 12.8433 14.9078 14.9376 k = 0.1880-0.1276-0.3310 ( 12586 PWs) bands (ev): -46.7091 -46.7091 -46.6997 -46.6997 -35.1721 -35.1721 -35.1704 -35.1704 -24.4172 -24.4063 -24.3388 -24.3282 -22.4214 -22.4132 -22.3473 -22.3262 -22.3144 -22.3056 -22.2246 -22.2123 -9.3065 -9.2924 -8.8059 -8.7708 -8.6864 -8.6581 -8.3761 -8.2974 -8.2269 -8.1703 -7.9258 -7.9013 2.8554 2.8693 3.1197 3.1315 3.4289 3.4398 3.5627 3.5667 4.0511 4.0779 4.1243 4.1751 4.3843 4.4247 4.6664 4.6916 5.2879 5.3166 5.8714 5.8914 6.0806 6.0899 6.3093 6.3121 6.5747 6.5962 6.6927 6.7204 6.8672 6.8734 7.0083 7.0165 7.0742 7.0784 7.3043 7.3095 11.0424 11.1165 11.3106 11.3664 11.5516 11.6250 12.0483 12.1452 12.4954 12.5246 12.7929 12.8336 14.9105 14.9410 k = 0.1961-0.1331-0.3454 ( 12586 PWs) bands (ev): -46.7088 -46.7088 -46.7000 -46.7000 -35.1721 -35.1720 -35.1705 -35.1705 -24.4153 -24.4042 -24.3411 -24.3304 -22.4199 -22.4111 -22.3436 -22.3224 -22.3183 -22.3093 -22.2268 -22.2144 -9.2871 -9.2721 -8.7897 -8.7538 -8.6652 -8.6382 -8.4006 -8.3305 -8.2468 -8.1995 -7.9324 -7.9089 2.8543 2.8678 3.1522 3.1636 3.4457 3.4555 3.5820 3.5849 4.0196 4.0468 4.1545 4.2024 4.3683 4.4045 4.6909 4.7090 5.2791 5.3055 5.8291 5.8478 6.0551 6.0676 6.3004 6.3020 6.5538 6.5761 6.6890 6.7134 6.8695 6.8738 7.0093 7.0164 7.0778 7.0820 7.3044 7.3085 11.0618 11.1348 11.3227 11.3746 11.5754 11.6503 12.0339 12.1271 12.4802 12.5106 12.7795 12.8222 14.9151 14.9462 k = 0.2043-0.1387-0.3598 ( 12586 PWs) bands (ev): -46.7086 -46.7086 -46.7002 -46.7002 -35.1720 -35.1720 -35.1705 -35.1705 -24.4134 -24.4021 -24.3434 -24.3325 -22.4183 -22.4090 -22.3398 -22.3239 -22.3170 -22.3130 -22.2290 -22.2165 -9.2681 -9.2521 -8.7722 -8.7358 -8.6439 -8.6189 -8.4249 -8.3635 -8.2672 -8.2288 -7.9389 -7.9164 2.8532 2.8662 3.1859 3.1965 3.4635 3.4724 3.5950 3.5983 3.9728 4.0001 4.2041 4.2427 4.3576 4.3822 4.7204 4.7335 5.2674 5.2914 5.7842 5.8010 6.0330 6.0479 6.2924 6.2929 6.5330 6.5555 6.6858 6.7067 6.8680 6.8702 7.0135 7.0194 7.0814 7.0854 7.3028 7.3059 11.0820 11.1540 11.3301 11.3767 11.6005 11.6763 12.0262 12.1144 12.4645 12.4963 12.7646 12.8094 14.9216 14.9531 k = 0.2125-0.1442-0.3742 ( 12584 PWs) bands (ev): -46.7083 -46.7083 -46.7005 -46.7005 -35.1720 -35.1720 -35.1706 -35.1706 -24.4114 -24.4000 -24.3458 -24.3347 -22.4167 -22.4069 -22.3358 -22.3283 -22.3171 -22.3125 -22.2311 -22.2186 -9.2494 -9.2327 -8.7536 -8.7172 -8.6227 -8.6013 -8.4479 -8.3960 -8.2880 -8.2580 -7.9453 -7.9238 2.8519 2.8645 3.2203 3.2299 3.4822 3.4907 3.6002 3.6036 3.9313 3.9550 4.2520 4.2672 4.3632 4.3699 4.7516 4.7619 5.2516 5.2732 5.7394 5.7541 6.0138 6.0303 6.2836 6.2859 6.5125 6.5352 6.6827 6.7004 6.8626 6.8634 7.0202 7.0254 7.0847 7.0881 7.2996 7.3018 11.1029 11.1738 11.3320 11.3723 11.6265 11.7031 12.0257 12.1076 12.4484 12.4818 12.7487 12.7957 14.9301 14.9619 k = 0.2206-0.1498-0.3886 ( 12584 PWs) bands (ev): -46.7080 -46.7080 -46.7008 -46.7008 -35.1719 -35.1719 -35.1706 -35.1706 -24.4094 -24.3979 -24.3481 -24.3369 -22.4151 -22.4049 -22.3331 -22.3317 -22.3208 -22.3080 -22.2332 -22.2207 -9.2313 -9.2139 -8.7340 -8.6981 -8.6026 -8.5872 -8.4675 -8.4270 -8.3091 -8.2869 -7.9516 -7.9311 2.8505 2.8626 3.2550 3.2632 3.5010 3.5101 3.5963 3.5984 3.8995 3.9164 4.2680 4.2821 4.3685 4.4082 4.7822 4.7918 5.2302 5.2495 5.6975 5.7102 5.9967 6.0142 6.2750 6.2796 6.4927 6.5158 6.6791 6.6948 6.8530 6.8549 7.0276 7.0336 7.0879 7.0907 7.2945 7.2963 11.1241 11.1940 11.3279 11.3621 11.6534 11.7304 12.0323 12.1071 12.4319 12.4672 12.7321 12.7813 14.9403 14.9725 k = 0.2288-0.1553-0.4030 ( 12578 PWs) bands (ev): -46.7078 -46.7078 -46.7010 -46.7010 -35.1719 -35.1719 -35.1707 -35.1707 -24.4074 -24.3959 -24.3505 -24.3392 -22.4135 -22.4029 -22.3377 -22.3288 -22.3237 -22.3035 -22.2353 -22.2227 -9.2138 -9.1959 -8.7135 -8.6793 -8.5860 -8.5797 -8.4796 -8.4543 -8.3304 -8.3153 -7.9578 -7.9383 2.8490 2.8606 3.2893 3.2957 3.5161 3.5269 3.5845 3.5877 3.8777 3.8853 4.2625 4.2831 4.4068 4.4605 4.8109 4.8213 5.2015 5.2192 5.6610 5.6724 5.9812 5.9994 6.2666 6.2735 6.4742 6.4980 6.6746 6.6902 6.8415 6.8443 7.0335 7.0421 7.0913 7.0943 7.2876 7.2894 11.1453 11.2146 11.3175 11.3471 11.6806 11.7580 12.0456 12.1129 12.4153 12.4524 12.7153 12.7666 14.9524 14.9848 k = 0.2370-0.1608-0.4173 ( 12576 PWs) bands (ev): -46.7075 -46.7075 -46.7013 -46.7013 -35.1718 -35.1718 -35.1707 -35.1707 -24.4053 -24.3938 -24.3528 -24.3415 -22.4119 -22.4009 -22.3424 -22.3305 -22.3218 -22.2989 -22.2373 -22.2247 -9.1969 -9.1785 -8.6925 -8.6624 -8.5854 -8.5734 -8.4818 -8.4716 -8.3516 -8.3428 -7.9639 -7.9455 2.8473 2.8584 3.3223 3.3264 3.5147 3.5239 3.5830 3.5880 3.8588 3.8646 4.2602 4.2768 4.4591 4.5168 4.8369 4.8486 5.1650 5.1820 5.6319 5.6426 5.9670 5.9855 6.2582 6.2674 6.4576 6.4824 6.6689 6.6862 6.8289 6.8323 7.0363 7.0484 7.0959 7.1004 7.2791 7.2810 11.1661 11.2352 11.3009 11.3291 11.7082 11.7859 12.0648 12.1244 12.3987 12.4374 12.6987 12.7519 14.9663 14.9988 k = 0.2452-0.1664-0.4317 ( 12576 PWs) bands (ev): -46.7072 -46.7072 -46.7016 -46.7016 -35.1718 -35.1718 -35.1708 -35.1708 -24.4032 -24.3918 -24.3551 -24.3438 -22.4103 -22.3990 -22.3472 -22.3344 -22.3176 -22.2942 -22.2392 -22.2267 -9.1806 -9.1620 -8.6722 -8.6528 -8.5933 -8.5750 -8.4806 -8.4675 -8.3725 -8.3686 -7.9700 -7.9526 2.8455 2.8560 3.3516 3.3533 3.4911 3.4969 3.6028 3.6084 3.8368 3.8528 4.2649 4.2753 4.5145 4.5738 4.8594 4.8725 5.1212 5.1388 5.6109 5.6212 5.9539 5.9724 6.2494 6.2609 6.4435 6.4697 6.6621 6.6826 6.8156 6.8192 7.0353 7.0505 7.1029 7.1091 7.2691 7.2712 11.1855 11.2556 11.2788 11.3099 11.7357 11.8137 12.0887 12.1410 12.3824 12.4224 12.6827 12.7376 14.9817 15.0142 k = 0.2533-0.1719-0.4461 ( 12578 PWs) bands (ev): -46.7069 -46.7069 -46.7018 -46.7018 -35.1717 -35.1717 -35.1708 -35.1708 -24.4011 -24.3898 -24.3574 -24.3461 -22.4086 -22.3972 -22.3519 -22.3386 -22.3131 -22.2896 -22.2410 -22.2286 -9.1650 -9.1462 -8.6602 -8.6561 -8.5986 -8.5779 -8.4705 -8.4554 -8.3922 -8.3906 -7.9760 -7.9596 2.8434 2.8534 3.3677 3.3714 3.4645 3.4703 3.6307 3.6376 3.8153 3.8408 4.2773 4.2819 4.5690 4.6290 4.8774 4.8916 5.0729 5.0930 5.5975 5.6073 5.9419 5.9602 6.2399 6.2535 6.4329 6.4605 6.6543 6.6787 6.8019 6.8056 7.0308 7.0485 7.1118 7.1192 7.2580 7.2601 11.2017 11.2519 11.2762 11.2919 11.7631 11.8413 12.1162 12.1614 12.3667 12.4073 12.6677 12.7239 14.9987 15.0312 k = 0.2615-0.1775-0.4605 ( 12570 PWs) bands (ev): -46.7066 -46.7066 -46.7021 -46.7021 -35.1717 -35.1717 -35.1709 -35.1709 -24.3990 -24.3879 -24.3595 -24.3484 -22.4070 -22.3953 -22.3567 -22.3429 -22.3085 -22.2851 -22.2427 -22.2304 -9.1500 -9.1313 -8.6808 -8.6580 -8.5976 -8.5661 -8.4574 -8.4494 -8.4059 -8.4029 -7.9819 -7.9665 2.8412 2.8506 3.3556 3.3628 3.4598 3.4660 3.6613 3.6691 3.7947 3.8283 4.2966 4.2975 4.6192 4.6783 4.8892 4.9052 5.0255 5.0508 5.5903 5.5992 5.9308 5.9487 6.2296 6.2446 6.4264 6.4554 6.6456 6.6742 6.7881 6.7916 7.0235 7.0432 7.1211 7.1295 7.2464 7.2482 11.2085 11.2238 11.2795 11.2964 11.7902 11.8686 12.1460 12.1841 12.3523 12.3924 12.6542 12.7112 15.0169 15.0494 k = 0.2697-0.1830-0.4749 ( 12560 PWs) bands (ev): -46.7064 -46.7064 -46.7024 -46.7024 -35.1716 -35.1716 -35.1709 -35.1709 -24.3970 -24.3861 -24.3616 -24.3507 -22.4053 -22.3936 -22.3614 -22.3473 -22.3039 -22.2806 -22.2442 -22.2322 -9.1358 -9.1172 -8.7077 -8.6792 -8.5829 -8.5494 -8.4600 -8.4529 -8.4059 -8.3945 -7.9878 -7.9733 2.8389 2.8476 3.3200 3.3283 3.4768 3.4833 3.6880 3.6973 3.7802 3.8193 4.3193 4.3234 4.6589 4.7121 4.8938 4.9139 4.9880 5.0219 5.5876 5.5954 5.9208 5.9382 6.2182 6.2342 6.4245 6.4547 6.6359 6.6686 6.7740 6.7774 7.0142 7.0357 7.1286 7.1384 7.2350 7.2365 11.1897 11.2044 11.2813 11.3157 11.8169 11.8955 12.1767 12.2071 12.3404 12.3783 12.6426 12.6998 15.0364 15.0687 k = 0.2779-0.1886-0.4893 ( 12552 PWs) bands (ev): -46.7061 -46.7061 -46.7026 -46.7026 -35.1716 -35.1716 -35.1710 -35.1710 -24.3949 -24.3845 -24.3635 -24.3530 -22.4037 -22.3919 -22.3660 -22.3518 -22.2992 -22.2763 -22.2456 -22.2339 -9.1221 -9.1038 -8.7370 -8.7077 -8.5653 -8.5366 -8.4710 -8.4612 -8.3892 -8.3767 -7.9936 -7.9800 2.8363 2.8445 3.2765 3.2853 3.4993 3.5069 3.6970 3.7126 3.7864 3.8243 4.3473 4.3545 4.6762 4.7140 4.9005 4.9260 4.9699 5.0119 5.5877 5.5942 5.9119 5.9286 6.2057 6.2220 6.4275 6.4583 6.6251 6.6616 6.7598 6.7632 7.0036 7.0268 7.1322 7.1440 7.2246 7.2274 11.1591 11.1845 11.2935 11.3344 11.8429 11.9217 12.2054 12.2280 12.3328 12.3668 12.6332 12.6900 15.0569 15.0891 k = 0.2860-0.1941-0.5037 ( 12560 PWs) bands (ev): -46.7058 -46.7058 -46.7029 -46.7029 -35.1716 -35.1715 -35.1710 -35.1710 -24.3929 -24.3830 -24.3652 -24.3552 -22.4021 -22.3902 -22.3706 -22.3562 -22.2945 -22.2722 -22.2468 -22.2355 -9.1091 -9.0911 -8.7674 -8.7384 -8.5546 -8.5360 -8.4736 -8.4620 -8.3665 -8.3562 -7.9993 -7.9867 2.8337 2.8413 3.2314 3.2404 3.5208 3.5289 3.6872 3.7099 3.8169 3.8498 4.3780 4.3883 4.6618 4.6804 4.9219 4.9532 4.9669 5.0179 5.5892 5.5943 5.9042 5.9200 6.1924 6.2084 6.4350 6.4661 6.6131 6.6528 6.7456 6.7492 6.9922 7.0168 7.1296 7.1433 7.2180 7.2227 11.1280 11.1606 11.3093 11.3524 11.8683 11.9471 12.2235 12.2481 12.3296 12.3637 12.6264 12.6820 15.0783 15.1102 k = 0.2942-0.1997-0.5181 ( 12558 PWs) bands (ev): -46.7056 -46.7056 -46.7032 -46.7032 -35.1715 -35.1715 -35.1711 -35.1711 -24.3910 -24.3819 -24.3666 -24.3574 -22.4005 -22.3887 -22.3750 -22.3606 -22.2898 -22.2684 -22.2476 -22.2371 -9.0967 -9.0792 -8.7982 -8.7697 -8.5609 -8.5440 -8.4667 -8.4464 -8.3420 -8.3347 -8.0050 -7.9932 2.8309 2.8379 3.1867 3.1958 3.5369 3.5429 3.6769 3.7005 3.8582 3.8883 4.4062 4.4213 4.6263 4.6293 4.9547 4.9695 4.9869 5.0415 5.5912 5.5947 5.8976 5.9126 6.1785 6.1938 6.4465 6.4773 6.5996 6.6418 6.7314 6.7357 6.9803 7.0064 7.1200 7.1345 7.2171 7.2229 11.0976 11.1354 11.3260 11.3695 11.8927 11.9717 12.2251 12.2657 12.3303 12.3757 12.6222 12.6761 15.1004 15.1320 k = 0.3024-0.2052-0.5325 ( 12560 PWs) bands (ev): -46.7053 -46.7053 -46.7034 -46.7034 -35.1715 -35.1715 -35.1711 -35.1711 -24.3891 -24.3813 -24.3675 -24.3594 -22.3989 -22.3874 -22.3791 -22.3650 -22.2852 -22.2652 -22.2479 -22.2385 -9.0849 -9.0679 -8.8291 -8.8011 -8.5784 -8.5573 -8.4493 -8.4238 -8.3172 -8.3125 -8.0106 -7.9996 2.8280 2.8344 3.1434 3.1525 3.5403 3.5433 3.6792 3.6972 3.9038 3.9329 4.4192 4.4419 4.5827 4.5946 4.9726 4.9801 5.0264 5.0843 5.5930 5.5950 5.8923 5.9063 6.1643 6.1786 6.4610 6.4912 6.5843 6.6282 6.7175 6.7231 6.9683 6.9957 7.1049 7.1189 7.2206 7.2265 11.0684 11.1104 11.3424 11.3857 11.9161 11.9951 12.2172 12.2680 12.3436 12.3990 12.6209 12.6724 15.1230 15.1543 k = 0.3105-0.2108-0.5469 ( 12550 PWs) bands (ev): -46.7050 -46.7050 -46.7037 -46.7037 -35.1714 -35.1714 -35.1712 -35.1712 -24.3873 -24.3812 -24.3678 -24.3614 -22.3974 -22.3870 -22.3824 -22.3693 -22.2806 -22.2628 -22.2474 -22.2397 -9.0737 -9.0573 -8.8598 -8.8323 -8.5987 -8.5745 -8.4267 -8.3987 -8.2936 -8.2888 -8.0160 -8.0058 2.8250 2.8308 3.1019 3.1109 3.5238 3.5338 3.6960 3.7070 3.9515 3.9803 4.3981 4.4222 4.5743 4.5922 4.9769 4.9913 5.0762 5.1361 5.5940 5.5949 5.8884 5.9014 6.1501 6.1632 6.4774 6.5062 6.5672 6.6120 6.7041 6.7116 6.9566 6.9849 7.0862 7.0991 7.2260 7.2319 11.0409 11.0862 11.3583 11.4010 11.9384 12.0172 12.2050 12.2572 12.3675 12.4275 12.6221 12.6711 15.1459 15.1769 k = 0.3187-0.2163-0.5613 ( 12548 PWs) bands (ev): -46.7048 -46.7048 -46.7039 -46.7039 -35.1714 -35.1714 -35.1712 -35.1712 -24.3857 -24.3817 -24.3675 -24.3632 -22.3960 -22.3891 -22.3829 -22.3736 -22.2762 -22.2615 -22.2461 -22.2406 -9.0630 -9.0472 -8.8901 -8.8630 -8.6196 -8.5932 -8.4022 -8.3724 -8.2716 -8.2637 -8.0214 -8.0119 2.8219 2.8270 3.0627 3.0716 3.4977 3.5133 3.7210 3.7294 3.9999 4.0290 4.3466 4.3651 4.6026 4.6185 4.9811 4.9980 5.1293 5.1901 5.5932 5.5955 5.8860 5.8979 6.1363 6.1482 6.4939 6.5191 6.5498 6.5940 6.6917 6.7016 6.9450 6.9743 7.0657 7.0769 7.2319 7.2376 11.0154 11.0635 11.3734 11.4152 11.9592 12.0378 12.1910 12.2413 12.3940 12.4579 12.6257 12.6725 15.1688 15.1995 k = 0.3269-0.2219-0.5757 ( 12562 PWs) bands (ev): -46.7046 -46.7046 -46.7042 -46.7042 -35.1713 -35.1713 -35.1713 -35.1712 -24.3844 -24.3827 -24.3668 -24.3647 -22.3953 -22.3920 -22.3820 -22.3777 -22.2721 -22.2610 -22.2446 -22.2406 -9.0529 -9.0377 -8.9198 -8.8932 -8.6402 -8.6124 -8.3773 -8.3455 -8.2504 -8.2383 -8.0265 -8.0177 2.8188 2.8232 3.0259 3.0347 3.4675 3.4861 3.7501 3.7597 4.0477 4.0775 4.2828 4.2970 4.6430 4.6573 4.9857 5.0035 5.1827 5.2435 5.5913 5.5960 5.8854 5.8961 6.1232 6.1340 6.5047 6.5169 6.5437 6.5790 6.6806 6.6931 6.9334 6.9634 7.0448 7.0538 7.2374 7.2430 10.9922 11.0425 11.3876 11.4285 11.9785 12.0564 12.1766 12.2238 12.4200 12.4886 12.6312 12.6767 15.1917 15.2221 k = 0.3351-0.2274-0.5900 ( 12558 PWs) bands (ev): -46.7044 -46.7044 -46.7043 -46.7043 -35.1713 -35.1713 -35.1713 -35.1713 -24.3839 -24.3833 -24.3660 -24.3657 -22.3975 -22.3922 -22.3822 -22.3804 -22.2683 -22.2611 -22.2440 -22.2387 -9.0433 -9.0288 -8.9487 -8.9227 -8.6603 -8.6316 -8.3525 -8.3185 -8.2297 -8.2132 -8.0315 -8.0233 2.8155 2.8192 2.9919 3.0005 3.4356 3.4557 3.7822 3.7940 4.0900 4.1205 4.2197 4.2311 4.6866 4.7000 4.9914 5.0091 5.2347 5.2947 5.5888 5.5964 5.8869 5.8962 6.1111 6.1210 6.4885 6.5078 6.5490 6.5775 6.6711 6.6862 6.9213 6.9521 7.0247 7.0309 7.2420 7.2477 10.9716 11.0237 11.4008 11.4407 11.9960 12.0726 12.1626 12.2060 12.4444 12.5184 12.6381 12.6837 15.2142 15.2441 k = 0.3432-0.2330-0.6044 ( 12564 PWs) bands (ev): -46.7046 -46.7046 -46.7041 -46.7041 -35.1713 -35.1713 -35.1712 -35.1712 -24.3853 -24.3827 -24.3668 -24.3645 -22.4010 -22.3915 -22.3855 -22.3795 -22.2651 -22.2614 -22.2439 -22.2359 -9.0343 -9.0204 -8.9768 -8.9515 -8.6797 -8.6506 -8.3282 -8.2917 -8.2095 -8.1885 -8.0363 -8.0287 2.8121 2.8150 2.9608 2.9691 3.4032 3.4239 3.8165 3.8306 4.0991 4.1155 4.1963 4.2046 4.7299 4.7426 4.9993 5.0162 5.2844 5.3424 5.5858 5.5970 5.8908 5.8984 6.1002 6.1100 6.4599 6.4853 6.5595 6.5860 6.6633 6.6807 6.9080 6.9394 7.0059 7.0111 7.2455 7.2513 10.9537 11.0073 11.4132 11.4520 12.0113 12.0852 12.1501 12.1891 12.4668 12.5467 12.6460 12.6933 15.2358 15.2653 k = 0.3514-0.2385-0.6188 ( 12562 PWs) bands (ev): -46.7049 -46.7049 -46.7039 -46.7039 -35.1714 -35.1714 -35.1712 -35.1712 -24.3868 -24.3826 -24.3670 -24.3633 -22.4045 -22.3923 -22.3873 -22.3784 -22.2634 -22.2610 -22.2433 -22.2326 -9.0260 -9.0128 -9.0034 -8.9793 -8.6983 -8.6691 -8.3045 -8.2653 -8.1898 -8.1646 -8.0407 -8.0336 2.8086 2.8105 2.9328 2.9409 3.3709 3.3916 3.8519 3.8685 4.0468 4.0538 4.2248 4.2446 4.7709 4.7823 5.0104 5.0263 5.3308 5.3857 5.5826 5.5982 5.8973 5.9030 6.0910 6.1017 6.4275 6.4540 6.5700 6.5943 6.6574 6.6765 6.8927 6.9250 6.9877 6.9973 7.2477 7.2537 10.9388 10.9934 11.4247 11.4624 12.0240 12.0922 12.1403 12.1744 12.4873 12.5728 12.6549 12.7050 15.2559 15.2843 k = 0.3596-0.2440-0.6332 ( 12560 PWs) bands (ev): -46.7051 -46.7051 -46.7036 -46.7036 -35.1714 -35.1714 -35.1712 -35.1712 -24.3882 -24.3830 -24.3668 -24.3620 -22.4080 -22.3952 -22.3868 -22.3773 -22.2634 -22.2598 -22.2419 -22.2294 -9.0312 -9.0169 -9.0061 -9.0048 -8.7160 -8.6870 -8.2815 -8.2396 -8.1708 -8.1417 -8.0448 -8.0379 2.8047 2.8057 2.9082 2.9159 3.3392 3.3595 3.8853 3.9061 3.9794 3.9879 4.2699 4.2928 4.8072 4.8166 5.0261 5.0410 5.3731 5.4237 5.5793 5.6001 5.9065 5.9102 6.0839 6.0967 6.3923 6.4185 6.5773 6.5986 6.6535 6.6733 6.8755 6.9087 6.9728 6.9884 7.2486 7.2549 10.9270 10.9823 11.4353 11.4718 12.0335 12.0917 12.1333 12.1647 12.5058 12.5959 12.6649 12.7179 15.2725 15.2964 k = 0.3677-0.2496-0.6476 ( 12554 PWs) bands (ev): -46.7053 -46.7053 -46.7034 -46.7034 -35.1715 -35.1715 -35.1711 -35.1711 -24.3897 -24.3839 -24.3662 -24.3608 -22.4112 -22.3987 -22.3857 -22.3763 -22.2640 -22.2590 -22.2398 -22.2262 -9.0557 -9.0323 -9.0093 -8.9980 -8.7328 -8.7042 -8.2594 -8.2150 -8.1524 -8.1203 -8.0483 -8.0412 2.8000 2.8011 2.8870 2.8942 3.3082 3.3280 3.8878 3.9000 3.9517 3.9563 4.3177 4.3418 4.8369 4.8438 5.0471 5.0624 5.4108 5.4558 5.5762 5.6029 5.9182 5.9202 6.0798 6.0959 6.3550 6.3807 6.5798 6.5978 6.6510 6.6708 6.8572 6.8913 6.9620 6.9829 7.2482 7.2547 10.9184 10.9740 11.4451 11.4804 12.0391 12.0851 12.1262 12.1622 12.5227 12.6153 12.6766 12.7314 15.2784 15.2893 k = 0.6323 0.0153-0.4658 ( 12554 PWs) bands (ev): -46.7053 -46.7053 -46.7034 -46.7034 -35.1715 -35.1715 -35.1711 -35.1711 -24.3897 -24.3839 -24.3662 -24.3608 -22.4112 -22.3987 -22.3857 -22.3763 -22.2640 -22.2590 -22.2398 -22.2262 -9.0557 -9.0323 -9.0093 -8.9980 -8.7328 -8.7042 -8.2594 -8.2150 -8.1524 -8.1203 -8.0483 -8.0412 2.8000 2.8011 2.8870 2.8942 3.3082 3.3280 3.8878 3.9000 3.9517 3.9563 4.3177 4.3418 4.8369 4.8438 5.0471 5.0624 5.4108 5.4558 5.5762 5.6029 5.9182 5.9202 6.0798 6.0959 6.3550 6.3807 6.5798 6.5978 6.6510 6.6708 6.8572 6.8913 6.9620 6.9829 7.2482 7.2547 10.9184 10.9740 11.4451 11.4804 12.0391 12.0851 12.1262 12.1622 12.5227 12.6153 12.6766 12.7314 15.2784 15.2893 k = 0.6245 0.0300-0.4658 ( 12566 PWs) bands (ev): -46.7055 -46.7055 -46.7032 -46.7032 -35.1715 -35.1715 -35.1711 -35.1711 -24.3910 -24.3849 -24.3653 -24.3596 -22.4142 -22.4021 -22.3845 -22.3754 -22.2645 -22.2589 -22.2372 -22.2233 -9.0783 -9.0559 -9.0026 -8.9919 -8.7479 -8.7200 -8.2391 -8.1929 -8.1356 -8.1023 -8.0510 -8.0427 2.7946 2.7968 2.8702 2.8769 3.2796 3.2988 3.8327 3.8361 3.9786 3.9915 4.3632 4.3879 4.8578 4.8634 5.0719 5.0891 5.4417 5.4810 5.5734 5.6062 5.9306 5.9326 6.0795 6.0996 6.3181 6.3432 6.5770 6.5919 6.6492 6.6687 6.8403 6.8749 6.9551 6.9798 7.2466 7.2533 10.9132 10.9688 11.4537 11.4877 12.0402 12.0759 12.1194 12.1642 12.5372 12.6301 12.6893 12.7441 15.2577 15.2749 k = 0.6167 0.0447-0.4658 ( 12568 PWs) bands (ev): -46.7057 -46.7057 -46.7031 -46.7031 -35.1715 -35.1715 -35.1710 -35.1710 -24.3923 -24.3861 -24.3642 -24.3585 -22.4170 -22.4053 -22.3833 -22.3746 -22.2651 -22.2591 -22.2344 -22.2204 -9.0998 -9.0784 -8.9963 -8.9862 -8.7620 -8.7350 -8.2198 -8.1724 -8.1199 -8.0880 -8.0526 -8.0408 2.7887 2.7925 2.8567 2.8628 3.2520 3.2706 3.7684 3.7713 4.0151 4.0308 4.4079 4.4331 4.8718 4.8777 5.1005 5.1205 5.4676 5.5018 5.5708 5.6094 5.9441 5.9468 6.0833 6.1083 6.2804 6.3052 6.5689 6.5811 6.6476 6.6669 6.8247 6.8595 6.9504 6.9779 7.2438 7.2508 10.9109 10.9662 11.4617 11.4944 12.0375 12.0655 12.1143 12.1671 12.5505 12.6413 12.7033 12.7563 15.2293 15.2526 k = 0.6089 0.0594-0.4658 ( 12580 PWs) bands (ev): -46.7058 -46.7058 -46.7029 -46.7029 -35.1716 -35.1716 -35.1710 -35.1710 -24.3934 -24.3874 -24.3631 -24.3575 -22.4196 -22.4085 -22.3821 -22.3738 -22.2656 -22.2595 -22.2313 -22.2178 -9.1201 -9.0998 -8.9904 -8.9810 -8.7752 -8.7493 -8.2014 -8.1536 -8.1060 -8.0793 -8.0524 -8.0337 2.7828 2.7880 2.8461 2.8516 3.2256 3.2433 3.7044 3.7079 4.0535 4.0707 4.4514 4.4768 4.8810 4.8879 5.1317 5.1542 5.4886 5.5190 5.5686 5.6119 5.9588 5.9619 6.0918 6.1220 6.2424 6.2673 6.5555 6.5655 6.6461 6.6655 6.8112 6.8455 6.9471 6.9764 7.2399 7.2471 10.9116 10.9662 11.4690 11.5004 12.0319 12.0544 12.1109 12.1692 12.5624 12.6495 12.7179 12.7679 15.2023 15.2274 k = 0.6011 0.0741-0.4658 ( 12568 PWs) bands (ev): -46.7060 -46.7060 -46.7028 -46.7028 -35.1716 -35.1716 -35.1710 -35.1710 -24.3945 -24.3886 -24.3620 -24.3565 -22.4220 -22.4115 -22.3810 -22.3731 -22.2661 -22.2601 -22.2283 -22.2153 -9.1392 -9.1200 -8.9849 -8.9762 -8.7874 -8.7627 -8.1840 -8.1371 -8.0954 -8.0757 -8.0489 -8.0220 2.7774 2.7839 2.8380 2.8431 3.2003 3.2173 3.6420 3.6461 4.0926 4.1109 4.4931 4.5187 4.8873 4.8951 5.1637 5.1883 5.5051 5.5337 5.5666 5.6131 5.9743 5.9776 6.1047 6.1396 6.2050 6.2309 6.5373 6.5458 6.6450 6.6645 6.7996 6.8329 6.9444 6.9748 7.2350 7.2423 10.9150 10.9685 11.4758 11.5058 12.0246 12.0435 12.1079 12.1697 12.5730 12.6552 12.7326 12.7786 15.1783 15.2032 k = 0.5934 0.0888-0.4658 ( 12568 PWs) bands (ev): -46.7061 -46.7061 -46.7026 -46.7026 -35.1716 -35.1716 -35.1710 -35.1710 -24.3956 -24.3899 -24.3608 -24.3556 -22.4242 -22.4144 -22.3798 -22.3725 -22.2665 -22.2607 -22.2253 -22.2130 -9.1570 -9.1390 -8.9799 -8.9719 -8.7986 -8.7753 -8.1678 -8.1230 -8.0891 -8.0745 -8.0408 -8.0082 2.7730 2.7806 2.8319 2.8366 3.1762 3.1925 3.5819 3.5865 4.1319 4.1510 4.5325 4.5582 4.8921 4.9004 5.1952 5.2212 5.5178 5.5458 5.5654 5.6122 5.9899 5.9944 6.1208 6.1562 6.1692 6.2006 6.5151 6.5229 6.6445 6.6642 6.7896 6.8215 6.9416 6.9725 7.2291 7.2365 10.9210 10.9731 11.4821 11.5106 12.0164 12.0335 12.1045 12.1683 12.5824 12.6590 12.7468 12.7884 15.1574 15.1816 k = 0.5856 0.1034-0.4658 ( 12564 PWs) bands (ev): -46.7063 -46.7063 -46.7025 -46.7025 -35.1717 -35.1717 -35.1709 -35.1709 -24.3965 -24.3912 -24.3597 -24.3548 -22.4263 -22.4171 -22.3788 -22.3720 -22.2669 -22.2614 -22.2224 -22.2109 -9.1734 -9.1567 -8.9753 -8.9680 -8.8088 -8.7870 -8.1528 -8.1119 -8.0862 -8.0734 -8.0291 -7.9942 2.7701 2.7785 2.8274 2.8317 3.1533 3.1689 3.5242 3.5292 4.1711 4.1908 4.5692 4.5948 4.8964 4.9049 5.2252 5.2519 5.5274 5.5543 5.5663 5.6092 6.0058 6.0122 6.1280 6.1426 6.1526 6.1994 6.4901 6.4984 6.6445 6.6643 6.7808 6.8107 6.9383 6.9692 7.2224 7.2297 10.9294 10.9798 11.4878 11.5148 12.0078 12.0248 12.1000 12.1648 12.5906 12.6611 12.7603 12.7974 15.1399 15.1627 k = 0.5778 0.1181-0.4658 ( 12572 PWs) bands (ev): -46.7064 -46.7064 -46.7023 -46.7023 -35.1717 -35.1717 -35.1709 -35.1709 -24.3973 -24.3924 -24.3586 -24.3540 -22.4281 -22.4196 -22.3778 -22.3715 -22.2672 -22.2620 -22.2196 -22.2090 -9.1885 -9.1731 -8.9711 -8.9646 -8.8179 -8.7978 -8.1394 -8.1044 -8.0849 -8.0710 -8.0155 -7.9808 2.7691 2.7781 2.8241 2.8280 3.1317 3.1466 3.4694 3.4746 4.2097 4.2298 4.6025 4.6279 4.9012 4.9096 5.2530 5.2797 5.5333 5.5579 5.5717 5.6039 6.0215 6.0293 6.1024 6.1202 6.1662 6.2195 6.4638 6.4739 6.6452 6.6650 6.7726 6.8003 6.9343 6.9648 7.2150 7.2222 10.9399 10.9880 11.4931 11.5184 11.9993 12.0176 12.0939 12.1592 12.5978 12.6619 12.7730 12.8056 15.1255 15.1468 k = 0.5700 0.1328-0.4658 ( 12576 PWs) bands (ev): -46.7065 -46.7065 -46.7022 -46.7022 -35.1717 -35.1717 -35.1709 -35.1709 -24.3981 -24.3935 -24.3575 -24.3534 -22.4297 -22.4220 -22.3768 -22.3711 -22.2674 -22.2627 -22.2170 -22.2073 -9.2021 -9.1881 -8.9675 -8.9616 -8.8259 -8.8076 -8.1279 -8.1007 -8.0838 -8.0665 -8.0016 -7.9684 2.7700 2.7794 2.8216 2.8252 3.1114 3.1255 3.4178 3.4231 4.2475 4.2677 4.6318 4.6566 4.9070 4.9153 5.2784 5.3044 5.5345 5.5605 5.5782 5.5969 6.0340 6.0382 6.0844 6.1004 6.1867 6.2402 6.4379 6.4513 6.6463 6.6660 6.7647 6.7900 6.9295 6.9593 7.2071 7.2140 10.9521 10.9976 11.4979 11.5215 11.9911 12.0121 12.0862 12.1515 12.6039 12.6615 12.7847 12.8130 15.1142 15.1337 k = 0.5622 0.1475-0.4658 ( 12570 PWs) bands (ev): -46.7066 -46.7066 -46.7021 -46.7021 -35.1717 -35.1717 -35.1709 -35.1709 -24.3987 -24.3946 -24.3566 -24.3528 -22.4311 -22.4242 -22.3759 -22.3708 -22.2676 -22.2633 -22.2146 -22.2059 -9.2143 -9.2017 -8.9643 -8.9592 -8.8329 -8.8165 -8.1187 -8.0995 -8.0817 -8.0610 -7.9880 -7.9573 2.7731 2.7827 2.8198 2.8231 3.0921 3.1056 3.3696 3.3749 4.2841 4.3042 4.6565 4.6804 4.9145 4.9227 5.3011 5.3260 5.5312 5.5632 5.5825 5.5906 6.0280 6.0347 6.0850 6.1003 6.2067 6.2561 6.4144 6.4332 6.6480 6.6673 6.7569 6.7796 6.9238 6.9526 7.1990 7.2054 10.9657 11.0081 11.5022 11.5240 11.9838 12.0081 12.0771 12.1421 12.6093 12.6601 12.7955 12.8197 15.1054 15.1230 k = 0.5545 0.1622-0.4658 ( 12570 PWs) bands (ev): -46.7067 -46.7067 -46.7020 -46.7020 -35.1717 -35.1717 -35.1708 -35.1708 -24.3992 -24.3956 -24.3557 -24.3523 -22.4323 -22.4262 -22.3751 -22.3706 -22.2677 -22.2640 -22.2124 -22.2047 -9.2251 -9.2139 -8.9615 -8.9571 -8.8388 -8.8244 -8.1126 -8.0998 -8.0778 -8.0553 -7.9752 -7.9475 2.7782 2.7879 2.8185 2.8216 3.0739 3.0869 3.3255 3.3305 4.3191 4.3387 4.6761 4.6986 4.9240 4.9323 5.3214 5.3447 5.5248 5.5605 5.5818 5.5917 6.0116 6.0228 6.0962 6.1148 6.2253 6.2644 6.3951 6.4225 6.6500 6.6687 6.7491 6.7692 6.9178 6.9451 7.1907 7.1966 10.9801 11.0188 11.5062 11.5260 11.9776 12.0056 12.0667 12.1311 12.6139 12.6580 12.8053 12.8257 15.0991 15.1147 k = 0.5467 0.1768-0.4658 ( 12574 PWs) bands (ev): -46.7068 -46.7068 -46.7019 -46.7019 -35.1718 -35.1718 -35.1708 -35.1708 -24.3997 -24.3965 -24.3548 -24.3519 -22.4333 -22.4280 -22.3743 -22.3704 -22.2678 -22.2645 -22.2103 -22.2037 -9.2343 -9.2247 -8.9592 -8.9555 -8.8436 -8.8313 -8.1091 -8.1006 -8.0724 -8.0502 -7.9635 -7.9391 2.7852 2.7946 2.8177 2.8207 3.0567 3.0691 3.2857 3.2904 4.3519 4.3707 4.6907 4.7113 4.9353 4.9439 5.3393 5.3606 5.5166 5.5493 5.5839 5.5947 5.9981 6.0099 6.1084 6.1287 6.2431 6.2658 6.3815 6.4200 6.6523 6.6701 6.7412 6.7588 6.9116 6.9370 7.1826 7.1879 10.9947 11.0294 11.5098 11.5274 11.9728 12.0043 12.0556 12.1189 12.6179 12.6555 12.8140 12.8308 15.0947 15.1082 k = 0.5389 0.1915-0.4658 ( 12580 PWs) bands (ev): -46.7069 -46.7069 -46.7019 -46.7019 -35.1718 -35.1718 -35.1708 -35.1708 -24.4000 -24.3973 -24.3541 -24.3517 -22.4340 -22.4296 -22.3736 -22.3703 -22.2678 -22.2651 -22.2085 -22.2029 -9.2420 -9.2340 -8.9572 -8.9543 -8.8475 -8.8372 -8.1075 -8.1017 -8.0661 -8.0461 -7.9530 -7.9323 2.7939 2.8024 2.8172 2.8206 3.0404 3.0522 3.2510 3.2551 4.3821 4.3995 4.7006 4.7190 4.9480 4.9568 5.3550 5.3743 5.5071 5.5340 5.5875 5.5969 5.9897 6.0006 6.1149 6.1352 6.2606 6.2674 6.3737 6.4228 6.6548 6.6712 6.7336 6.7487 6.9058 6.9287 7.1750 7.1795 11.0091 11.0391 11.5130 11.5283 11.9696 12.0041 12.0446 12.1059 12.6215 12.6526 12.8216 12.8352 15.0920 15.1033 k = 0.5311 0.2062-0.4658 ( 12562 PWs) bands (ev): -46.7069 -46.7069 -46.7018 -46.7018 -35.1718 -35.1718 -35.1708 -35.1708 -24.4002 -24.3981 -24.3534 -24.3515 -22.4346 -22.4310 -22.3729 -22.3703 -22.2678 -22.2656 -22.2069 -22.2024 -9.2482 -9.2417 -8.9557 -8.9534 -8.8504 -8.8422 -8.1068 -8.1028 -8.0598 -8.0430 -7.9438 -7.9271 2.8033 2.8095 2.8174 2.8224 3.0251 3.0360 3.2219 3.2253 4.4089 4.4244 4.7068 4.7226 4.9612 4.9697 5.3688 5.3858 5.4971 5.5173 5.5906 5.5980 5.9868 5.9962 6.1131 6.1319 6.2690 6.2844 6.3707 6.4264 6.6575 6.6719 6.7265 6.7393 6.9009 6.9206 7.1683 7.1719 11.0226 11.0475 11.5160 11.5286 11.9681 12.0038 12.0352 12.0926 12.6248 12.6495 12.8281 12.8386 15.0905 15.0996 k = 0.5233 0.2209-0.4658 ( 12558 PWs) bands (ev): -46.7070 -46.7070 -46.7018 -46.7018 -35.1718 -35.1718 -35.1708 -35.1708 -24.4003 -24.3987 -24.3528 -24.3514 -22.4349 -22.4322 -22.3724 -22.3704 -22.2677 -22.2660 -22.2055 -22.2021 -9.2528 -9.2480 -8.9545 -8.9528 -8.8524 -8.8462 -8.1065 -8.1038 -8.0540 -8.0411 -7.9361 -7.9234 2.8111 2.8134 2.8198 2.8276 3.0114 3.0210 3.1990 3.2016 4.4318 4.4445 4.7104 4.7230 4.9737 4.9812 5.3808 5.3953 5.4873 5.5008 5.5931 5.5983 5.9889 5.9964 6.1044 6.1204 6.2800 6.3047 6.3713 6.4275 6.6603 6.6720 6.7206 6.7309 6.8974 6.9131 7.1627 7.1654 11.0347 11.0538 11.5186 11.5284 11.9684 12.0015 12.0299 12.0793 12.6280 12.6464 12.8334 12.8411 15.0900 15.0968 k = 0.5156 0.2356-0.4658 ( 12556 PWs) bands (ev): -46.7070 -46.7070 -46.7017 -46.7017 -35.1718 -35.1718 -35.1708 -35.1708 -24.4003 -24.3992 -24.3524 -24.3514 -22.4350 -22.4332 -22.3718 -22.3705 -22.2675 -22.2664 -22.2043 -22.2020 -9.2559 -9.2527 -8.9536 -8.9525 -8.8535 -8.8494 -8.1063 -8.1046 -8.0491 -8.0404 -7.9300 -7.9215 2.8137 2.8145 2.8274 2.8344 3.0004 3.0077 3.1826 3.1843 4.4498 4.4589 4.7126 4.7216 4.9843 4.9899 5.3913 5.4024 5.4787 5.4862 5.5948 5.5981 5.9945 6.0002 6.0930 6.1050 6.2942 6.3197 6.3764 6.4240 6.6630 6.6713 6.7167 6.7240 6.8956 6.9066 7.1585 7.1604 11.0448 11.0578 11.5210 11.5277 11.9707 11.9956 12.0307 12.0666 12.6310 12.6432 12.8376 12.8426 15.0901 15.0947 k = 0.5078 0.2503-0.4658 ( 12558 PWs) bands (ev): -46.7070 -46.7070 -46.7017 -46.7017 -35.1718 -35.1718 -35.1708 -35.1708 -24.4002 -24.3997 -24.3520 -24.3515 -22.4349 -22.4340 -22.3714 -22.3707 -22.2673 -22.2668 -22.2034 -22.2022 -9.2575 -9.2558 -8.9530 -8.9524 -8.8537 -8.8517 -8.1061 -8.1053 -8.0453 -8.0408 -7.9254 -7.9211 2.8143 2.8147 2.8350 2.8390 2.9936 2.9977 3.1729 3.1738 4.4621 4.4669 4.7145 4.7191 4.9918 4.9949 5.3999 5.4062 5.4726 5.4756 5.5960 5.5976 6.0012 6.0046 6.0840 6.0907 6.3081 6.3243 6.3878 6.4153 6.6656 6.6699 6.7150 6.7189 6.8956 6.9013 7.1561 7.1570 11.0523 11.0589 11.5232 11.5266 11.9749 11.9880 12.0363 12.0549 12.6340 12.6401 12.8406 12.8431 15.0908 15.0931 k = 0.5000 0.2649-0.4658 ( 12558 PWs) bands (ev): -46.7070 -46.7070 -46.7017 -46.7017 -35.1718 -35.1718 -35.1708 -35.1708 -24.4000 -24.4000 -24.3517 -24.3517 -22.4345 -22.4345 -22.3710 -22.3710 -22.2671 -22.2671 -22.2027 -22.2027 -9.2574 -9.2574 -8.9526 -8.9526 -8.8531 -8.8531 -8.1058 -8.1058 -8.0425 -8.0425 -7.9224 -7.9224 2.8146 2.8146 2.8393 2.8393 2.9926 2.9926 3.1699 3.1699 4.4679 4.4679 4.7166 4.7166 4.9955 4.9955 5.4054 5.4054 5.4710 5.4710 5.5969 5.5969 6.0056 6.0056 6.0825 6.0825 6.3192 6.3192 6.4024 6.4024 6.6680 6.6680 6.7158 6.7158 6.8976 6.8976 7.1556 7.1556 11.0571 11.0571 11.5251 11.5251 11.9808 11.9808 12.0446 12.0446 12.6370 12.6370 12.8424 12.8424 15.0918 15.0918 k = 0.5000 0.2649-0.4658 ( 12558 PWs) bands (ev): -46.7070 -46.7070 -46.7017 -46.7017 -35.1718 -35.1718 -35.1708 -35.1708 -24.4000 -24.4000 -24.3517 -24.3517 -22.4345 -22.4345 -22.3710 -22.3710 -22.2671 -22.2671 -22.2027 -22.2027 -9.2574 -9.2574 -8.9526 -8.9526 -8.8531 -8.8531 -8.1058 -8.1058 -8.0425 -8.0425 -7.9224 -7.9224 2.8146 2.8146 2.8393 2.8393 2.9926 2.9926 3.1699 3.1699 4.4679 4.4679 4.7166 4.7166 4.9955 4.9955 5.4054 5.4054 5.4710 5.4710 5.5969 5.5969 6.0056 6.0056 6.0825 6.0825 6.3192 6.3192 6.4024 6.4024 6.6680 6.6680 6.7158 6.7158 6.8976 6.8976 7.1556 7.1556 11.0571 11.0571 11.5251 11.5251 11.9808 11.9808 12.0446 12.0446 12.6370 12.6370 12.8424 12.8424 15.0918 15.0918 k = 0.5094 0.2699-0.4528 ( 12556 PWs) bands (ev): -46.7070 -46.7070 -46.7017 -46.7017 -35.1718 -35.1718 -35.1708 -35.1708 -24.4001 -24.3997 -24.3519 -24.3515 -22.4344 -22.4344 -22.3713 -22.3708 -22.2674 -22.2668 -22.2029 -22.2027 -9.2571 -9.2561 -8.9531 -8.9525 -8.8525 -8.8525 -8.1059 -8.1057 -8.0439 -8.0426 -7.9234 -7.9231 2.8145 2.8145 2.8409 2.8411 2.9931 2.9935 3.1718 3.1722 4.4664 4.4667 4.7134 4.7148 4.9951 4.9951 5.4044 5.4066 5.4706 5.4712 5.5958 5.5964 6.0073 6.0077 6.0828 6.0845 6.3156 6.3206 6.3996 6.4023 6.6662 6.6666 6.7138 6.7192 6.8958 6.8971 7.1565 7.1570 11.0585 11.0590 11.5223 11.5264 11.9810 11.9819 12.0427 12.0490 12.6359 12.6368 12.8407 12.8426 15.0914 15.0927 k = 0.5189 0.2749-0.4398 ( 12556 PWs) bands (ev): -46.7070 -46.7070 -46.7017 -46.7017 -35.1718 -35.1718 -35.1708 -35.1708 -24.4001 -24.3994 -24.3523 -24.3515 -22.4341 -22.4339 -22.3717 -22.3707 -22.2676 -22.2664 -22.2035 -22.2030 -9.2551 -9.2532 -8.9539 -8.9527 -8.8508 -8.8507 -8.1059 -8.1054 -8.0469 -8.0443 -7.9260 -7.9255 2.8144 2.8145 2.8456 2.8460 2.9950 2.9959 3.1777 3.1785 4.4622 4.4627 4.7051 4.7080 4.9937 4.9937 5.4034 5.4080 5.4702 5.4713 5.5930 5.5946 6.0128 6.0136 6.0852 6.0884 6.3101 6.3199 6.3943 6.3996 6.6614 6.6620 6.7133 6.7238 6.8918 6.8945 7.1595 7.1605 11.0633 11.0642 11.5184 11.5263 11.9821 11.9843 12.0435 12.0562 12.6335 12.6352 12.8377 12.8415 15.0917 15.0943 k = 0.5283 0.2799-0.4268 ( 12555 PWs) bands (ev): -46.7069 -46.7069 -46.7018 -46.7018 -35.1718 -35.1718 -35.1708 -35.1708 -24.4000 -24.3989 -24.3528 -24.3515 -22.4335 -22.4332 -22.3721 -22.3707 -22.2678 -22.2659 -22.2043 -22.2036 -9.2514 -9.2486 -8.9552 -8.9534 -8.8479 -8.8477 -8.1059 -8.1052 -8.0513 -8.0475 -7.9303 -7.9295 2.8145 2.8147 2.8532 2.8539 2.9984 2.9998 3.1876 3.1888 4.4553 4.4560 4.6921 4.6962 4.9914 4.9915 5.4021 5.4094 5.4699 5.4714 5.5884 5.5914 6.0216 6.0228 6.0897 6.0938 6.3028 6.3170 6.3870 6.3946 6.6534 6.6543 6.7145 6.7298 6.8859 6.8899 7.1646 7.1660 11.0712 11.0726 11.5134 11.5248 11.9835 11.9875 12.0471 12.0665 12.6298 12.6324 12.8333 12.8390 15.0925 15.0965 k = 0.5378 0.2850-0.4138 ( 12556 PWs) bands (ev): -46.7069 -46.7069 -46.7018 -46.7018 -35.1718 -35.1718 -35.1708 -35.1708 -24.3997 -24.3982 -24.3534 -24.3517 -22.4326 -22.4323 -22.3726 -22.3707 -22.2679 -22.2654 -22.2053 -22.2045 -9.2461 -9.2423 -8.9568 -8.9544 -8.8437 -8.8434 -8.1062 -8.1049 -8.0569 -8.0522 -7.9362 -7.9350 2.8150 2.8152 2.8636 2.8645 3.0035 3.0052 3.2014 3.2029 4.4457 4.4466 4.6747 4.6799 4.9884 4.9886 5.4001 5.4104 5.4699 5.4715 5.5821 5.5871 6.0333 6.0348 6.0956 6.1000 6.2942 6.3121 6.3785 6.3880 6.6424 6.6437 6.7176 6.7371 6.8780 6.8835 7.1715 7.1731 11.0823 11.0841 11.5079 11.5222 11.9845 11.9905 12.0543 12.0799 12.6249 12.6282 12.8275 12.8351 15.0941 15.0994 k = 0.5472 0.2900-0.4009 ( 12565 PWs) bands (ev): -46.7068 -46.7068 -46.7019 -46.7019 -35.1718 -35.1718 -35.1708 -35.1708 -24.3993 -24.3975 -24.3541 -24.3520 -22.4315 -22.4311 -22.3732 -22.3708 -22.2679 -22.2649 -22.2067 -22.2056 -9.2391 -9.2344 -8.9589 -8.9559 -8.8383 -8.8380 -8.1070 -8.1047 -8.0636 -8.0583 -7.9436 -7.9422 2.8159 2.8161 2.8767 2.8778 3.0101 3.0123 3.2189 3.2208 4.4335 4.4346 4.6534 4.6595 4.9847 4.9850 5.3966 5.4104 5.4704 5.4719 5.5743 5.5819 6.0469 6.0487 6.1023 6.1060 6.2848 6.3054 6.3699 6.3806 6.6290 6.6304 6.7223 6.7456 6.8687 6.8756 7.1796 7.1815 11.0963 11.0984 11.5021 11.5187 11.9850 11.9926 12.0651 12.0961 12.6187 12.6228 12.8203 12.8301 15.0966 15.1031 k = 0.5567 0.2950-0.3879 ( 12571 PWs) bands (ev): -46.7068 -46.7068 -46.7020 -46.7020 -35.1717 -35.1717 -35.1708 -35.1708 -24.3988 -24.3967 -24.3549 -24.3524 -22.4302 -22.4296 -22.3739 -22.3711 -22.2679 -22.2643 -22.2083 -22.2070 -9.2306 -9.2249 -8.9614 -8.9578 -8.8318 -8.8313 -8.1090 -8.1050 -8.0705 -8.0653 -7.9525 -7.9508 2.8172 2.8173 2.8924 2.8938 3.0185 3.0212 3.2399 3.2422 4.4188 4.4201 4.6287 4.6354 4.9805 4.9811 5.3908 5.4084 5.4714 5.4725 5.5654 5.5762 6.0614 6.0631 6.1089 6.1108 6.2753 6.2976 6.3624 6.3733 6.6138 6.6151 6.7287 6.7552 6.8582 6.8665 7.1887 7.1908 11.1131 11.1155 11.4963 11.5147 11.9848 11.9936 12.0793 12.1147 12.6114 12.6163 12.8118 12.8238 15.0999 15.1077 k = 0.5661 0.3000-0.3749 ( 12571 PWs) bands (ev): -46.7067 -46.7067 -46.7021 -46.7021 -35.1717 -35.1717 -35.1708 -35.1708 -24.3982 -24.3957 -24.3558 -24.3529 -22.4285 -22.4279 -22.3746 -22.3713 -22.2678 -22.2636 -22.2102 -22.2087 -9.2204 -9.2138 -8.9643 -8.9602 -8.8239 -8.8234 -8.1132 -8.1063 -8.0767 -8.0728 -7.9629 -7.9607 2.8189 2.8190 2.9107 2.9124 3.0287 3.0317 3.2644 3.2671 4.4018 4.4032 4.6010 4.6081 4.9760 4.9768 5.3820 5.4032 5.4730 5.4736 5.5564 5.5704 6.0750 6.0756 6.1136 6.1142 6.2671 6.2897 6.3571 6.3670 6.5981 6.5989 6.7366 6.7655 6.8471 6.8568 7.1983 7.2005 11.1325 11.1350 11.4909 11.5104 11.9840 11.9936 12.0961 12.1351 12.6030 12.6086 12.8021 12.8163 15.1043 15.1133 k = 0.5756 0.3050-0.3619 ( 12578 PWs) bands (ev): -46.7066 -46.7066 -46.7022 -46.7022 -35.1717 -35.1717 -35.1709 -35.1709 -24.3975 -24.3946 -24.3568 -24.3535 -22.4267 -22.4260 -22.3754 -22.3717 -22.2677 -22.2629 -22.2123 -22.2106 -9.2087 -9.2012 -8.9678 -8.9631 -8.8149 -8.8142 -8.1208 -8.1100 -8.0810 -8.0795 -7.9746 -7.9719 2.8209 2.8210 2.9316 2.9336 3.0407 3.0441 3.2921 3.2951 4.3824 4.3840 4.5707 4.5781 4.9714 4.9724 5.3692 5.3933 5.4750 5.4751 5.5483 5.5651 6.0828 6.0856 6.1145 6.1171 6.2622 6.2836 6.3544 6.3619 6.5830 6.5833 6.7456 6.7761 6.8363 6.8469 7.2080 7.2102 11.1541 11.1567 11.4859 11.5062 11.9826 11.9929 12.1147 12.1565 12.5937 12.5999 12.7912 12.8078 15.1098 15.1200 k = 0.5850 0.3100-0.3489 ( 12578 PWs) bands (ev): -46.7065 -46.7065 -46.7023 -46.7023 -35.1717 -35.1717 -35.1709 -35.1709 -24.3966 -24.3934 -24.3578 -24.3541 -22.4246 -22.4238 -22.3763 -22.3722 -22.2675 -22.2622 -22.2147 -22.2127 -9.1955 -9.1870 -8.9718 -8.9665 -8.8047 -8.8038 -8.1319 -8.1174 -8.0840 -8.0834 -7.9874 -7.9842 2.8232 2.8232 2.9551 2.9574 3.0545 3.0583 3.3229 3.3262 4.3611 4.3628 4.5385 4.5459 4.9669 4.9681 5.3518 5.3773 5.4768 5.4773 5.5421 5.5605 6.0815 6.0908 6.1132 6.1160 6.2631 6.2818 6.3538 6.3577 6.5696 6.5714 6.7553 6.7853 6.8277 6.8376 7.2174 7.2195 11.1777 11.1803 11.4815 11.5021 11.9809 11.9917 12.1343 12.1785 12.5835 12.5903 12.7791 12.7983 15.1167 15.1279 k = 0.5945 0.3150-0.3359 ( 12593 PWs) bands (ev): -46.7063 -46.7063 -46.7024 -46.7024 -35.1717 -35.1717 -35.1709 -35.1709 -24.3957 -24.3922 -24.3590 -24.3549 -22.4223 -22.4214 -22.3772 -22.3727 -22.2673 -22.2614 -22.2173 -22.2151 -9.1807 -9.1713 -8.9762 -8.9705 -8.7933 -8.7922 -8.1459 -8.1287 -8.0862 -8.0847 -8.0011 -7.9972 2.8257 2.8258 2.9810 2.9836 3.0701 3.0743 3.3567 3.3603 4.3379 4.3398 4.5045 4.5118 4.9625 4.9639 5.3292 5.3546 5.4786 5.4794 5.5382 5.5569 6.0722 6.0894 6.1071 6.1093 6.2718 6.2867 6.3533 6.3533 6.5609 6.5648 6.7646 6.7887 6.8257 6.8300 7.2262 7.2281 11.2030 11.2054 11.4779 11.4983 11.9787 11.9900 12.1542 12.2004 12.5727 12.5800 12.7660 12.7878 15.1249 15.1370 k = 0.6039 0.3200-0.3229 ( 12583 PWs) bands (ev): -46.7062 -46.7062 -46.7026 -46.7026 -35.1716 -35.1716 -35.1709 -35.1709 -24.3947 -24.3908 -24.3602 -24.3558 -22.4197 -22.4188 -22.3782 -22.3733 -22.2670 -22.2606 -22.2201 -22.2177 -9.1645 -9.1542 -8.9812 -8.9749 -8.7807 -8.7794 -8.1623 -8.1429 -8.0875 -8.0858 -8.0152 -8.0106 2.8284 2.8286 3.0094 3.0123 3.0874 3.0919 3.3931 3.3970 4.3131 4.3152 4.4693 4.4763 4.9586 4.9601 5.3012 5.3254 5.4801 5.4809 5.5363 5.5542 6.0573 6.0811 6.0948 6.0964 6.2882 6.2984 6.3481 6.3508 6.5593 6.5651 6.7718 6.7838 6.8261 6.8333 7.2340 7.2357 11.2296 11.2317 11.4749 11.4949 11.9764 11.9882 12.1740 12.2218 12.5613 12.5692 12.7518 12.7764 15.1346 15.1474 k = 0.6134 0.3250-0.3099 ( 12582 PWs) bands (ev): -46.7060 -46.7060 -46.7028 -46.7027 -35.1716 -35.1716 -35.1710 -35.1710 -24.3935 -24.3894 -24.3615 -24.3567 -22.4170 -22.4160 -22.3792 -22.3740 -22.2666 -22.2598 -22.2231 -22.2204 -9.1469 -9.1356 -8.9867 -8.9798 -8.7671 -8.7656 -8.1804 -8.1592 -8.0894 -8.0879 -8.0290 -8.0234 2.8314 2.8315 3.0400 3.0433 3.1065 3.1113 3.4322 3.4363 4.2871 4.2895 4.4330 4.4397 4.9552 4.9567 5.2680 5.2903 5.4808 5.4813 5.5355 5.5518 6.0385 6.0664 6.0774 6.0789 6.3102 6.3134 6.3441 6.3452 6.5658 6.5730 6.7744 6.7750 6.8285 6.8462 7.2406 7.2421 11.2571 11.2587 11.4727 11.4920 11.9738 11.9861 12.1930 12.2422 12.5496 12.5579 12.7367 12.7642 15.1457 15.1591 k = 0.6228 0.3300-0.2970 ( 12578 PWs) bands (ev): -46.7058 -46.7058 -46.7029 -46.7029 -35.1716 -35.1716 -35.1710 -35.1710 -24.3923 -24.3879 -24.3628 -24.3577 -22.4140 -22.4129 -22.3803 -22.3748 -22.2663 -22.2590 -22.2263 -22.2233 -9.1279 -9.1157 -8.9926 -8.9853 -8.7523 -8.7506 -8.2000 -8.1772 -8.0935 -8.0925 -8.0409 -8.0342 2.8344 2.8347 3.0728 3.0766 3.1272 3.1322 3.4736 3.4779 4.2602 4.2629 4.3961 4.4022 4.9523 4.9538 5.2301 5.2501 5.4796 5.4797 5.5348 5.5490 6.0175 6.0459 6.0567 6.0590 6.3194 6.3350 6.3377 6.3523 6.5801 6.5879 6.7655 6.7722 6.8374 6.8613 7.2459 7.2471 11.2852 11.2860 11.4711 11.4895 11.9712 11.9840 12.2110 12.2613 12.5378 12.5465 12.7208 12.7511 15.1582 15.1717 k = 0.6323 0.3350-0.2840 ( 12584 PWs) bands (ev): -46.7057 -46.7057 -46.7031 -46.7031 -35.1715 -35.1715 -35.1710 -35.1710 -24.3911 -24.3863 -24.3642 -24.3588 -22.4108 -22.4097 -22.3815 -22.3756 -22.2658 -22.2582 -22.2297 -22.2263 -9.1075 -9.0944 -8.9991 -8.9912 -8.7366 -8.7346 -8.2210 -8.1966 -8.1021 -8.1014 -8.0490 -8.0414 2.8376 2.8380 3.1076 3.1119 3.1495 3.1546 3.5170 3.5216 4.2328 4.2359 4.3588 4.3643 4.9501 4.9515 5.1877 5.2055 5.4751 5.4760 5.5332 5.5451 5.9956 6.0219 6.0341 6.0373 6.3144 6.3270 6.3640 6.3747 6.6006 6.6084 6.7563 6.7674 6.8507 6.8776 7.2496 7.2506 11.3132 11.3132 11.4701 11.4874 11.9685 11.9818 12.2277 12.2788 12.5261 12.5352 12.7041 12.7373 15.1719 15.1852 k = 0.6323 0.3350-0.2840 ( 12584 PWs) bands (ev): -46.7057 -46.7057 -46.7031 -46.7031 -35.1715 -35.1715 -35.1710 -35.1710 -24.3911 -24.3863 -24.3642 -24.3588 -22.4108 -22.4097 -22.3815 -22.3756 -22.2658 -22.2582 -22.2297 -22.2263 -9.1075 -9.0944 -8.9991 -8.9912 -8.7366 -8.7346 -8.2210 -8.1966 -8.1021 -8.1014 -8.0490 -8.0414 2.8376 2.8380 3.1076 3.1119 3.1495 3.1546 3.5170 3.5216 4.2328 4.2359 4.3588 4.3643 4.9501 4.9515 5.1877 5.2055 5.4751 5.4760 5.5332 5.5451 5.9956 6.0219 6.0341 6.0373 6.3144 6.3270 6.3640 6.3747 6.6006 6.6084 6.7563 6.7674 6.8507 6.8776 7.2496 7.2506 11.3132 11.3132 11.4701 11.4874 11.9685 11.9818 12.2277 12.2788 12.5261 12.5352 12.7041 12.7373 15.1719 15.1852 k = 0.6277 0.3326-0.2679 ( 12588 PWs) bands (ev): -46.7055 -46.7055 -46.7032 -46.7032 -35.1715 -35.1715 -35.1711 -35.1711 -24.3901 -24.3856 -24.3648 -24.3596 -22.4090 -22.4079 -22.3821 -22.3765 -22.2650 -22.2579 -22.2314 -22.2281 -9.0967 -9.0828 -9.0061 -8.9965 -8.7267 -8.7246 -8.2340 -8.2080 -8.1087 -8.1072 -8.0501 -8.0417 2.8420 2.8434 3.1282 3.1329 3.1638 3.1689 3.5510 3.5560 4.2230 4.2258 4.3315 4.3370 4.9538 4.9559 5.1544 5.1728 5.4602 5.4602 5.5622 5.5725 5.9740 6.0021 6.0164 6.0164 6.2842 6.2963 6.3679 6.3772 6.6226 6.6305 6.7615 6.7719 6.8489 6.8744 7.2490 7.2498 11.3334 11.3335 11.4937 11.5117 11.9718 11.9851 12.2330 12.2817 12.5270 12.5344 12.6941 12.7270 15.1910 15.2036 k = 0.6231 0.3302-0.2518 ( 12575 PWs) bands (ev): -46.7054 -46.7054 -46.7033 -46.7033 -35.1715 -35.1715 -35.1711 -35.1711 -24.3892 -24.3849 -24.3654 -24.3604 -22.4070 -22.4060 -22.3825 -22.3772 -22.2644 -22.2578 -22.2332 -22.2299 -9.0860 -9.0712 -9.0117 -9.0006 -8.7166 -8.7144 -8.2472 -8.2198 -8.1168 -8.1147 -8.0512 -8.0419 2.8500 2.8523 3.1498 3.1550 3.1797 3.1847 3.5858 3.5913 4.2122 4.2149 4.3051 4.3105 4.9513 4.9537 5.1202 5.1387 5.4467 5.4473 5.5826 5.5908 5.9543 5.9813 6.0023 6.0030 6.2566 6.2686 6.3706 6.3792 6.6467 6.6543 6.7660 6.7745 6.8481 6.8707 7.2479 7.2485 11.3544 11.3545 11.5186 11.5371 11.9752 11.9885 12.2380 12.2843 12.5270 12.5326 12.6839 12.7164 15.2106 15.2223 k = 0.6186 0.3278-0.2358 ( 12580 PWs) bands (ev): -46.7053 -46.7053 -46.7034 -46.7034 -35.1715 -35.1715 -35.1711 -35.1711 -24.3883 -24.3843 -24.3658 -24.3612 -22.4050 -22.4041 -22.3827 -22.3777 -22.2641 -22.2579 -22.2351 -22.2318 -9.0754 -9.0599 -9.0160 -9.0034 -8.7062 -8.7040 -8.2605 -8.2317 -8.1259 -8.1233 -8.0529 -8.0428 2.8617 2.8650 3.1721 3.1779 3.1972 3.2019 3.6213 3.6272 4.2010 4.2037 4.2797 4.2849 4.9420 4.9445 5.0855 5.1039 5.4348 5.4361 5.5909 5.5968 5.9377 5.9633 5.9928 5.9938 6.2345 6.2466 6.3716 6.3794 6.6723 6.6794 6.7698 6.7750 6.8489 6.8673 7.2462 7.2465 11.3761 11.3762 11.5444 11.5635 11.9788 11.9922 12.2428 12.2865 12.5259 12.5297 12.6734 12.7054 15.2306 15.2411 k = 0.6140 0.3253-0.2197 ( 12576 PWs) bands (ev): -46.7052 -46.7052 -46.7035 -46.7035 -35.1715 -35.1715 -35.1711 -35.1711 -24.3874 -24.3836 -24.3663 -24.3618 -22.4029 -22.4021 -22.3828 -22.3781 -22.2639 -22.2583 -22.2369 -22.2337 -9.0649 -9.0487 -9.0189 -9.0049 -8.6957 -8.6934 -8.2740 -8.2439 -8.1356 -8.1325 -8.0556 -8.0446 2.8770 2.8812 3.1949 3.2016 3.2165 3.2208 3.6573 3.6635 4.1899 4.1926 4.2555 4.2604 4.9262 4.9285 5.0508 5.0689 5.4233 5.4252 5.5857 5.5894 5.9239 5.9475 5.9880 5.9889 6.2211 6.2332 6.3702 6.3771 6.6986 6.7052 6.7728 6.7742 6.8513 6.8647 7.2439 7.2440 11.3985 11.3986 11.5708 11.5906 11.9826 11.9962 12.2474 12.2885 12.5236 12.5256 12.6628 12.6939 15.2506 15.2599 k = 0.6094 0.3229-0.2037 ( 12574 PWs) bands (ev): -46.7051 -46.7051 -46.7036 -46.7036 -35.1714 -35.1714 -35.1711 -35.1711 -24.3866 -24.3831 -24.3666 -24.3625 -22.4008 -22.4000 -22.3826 -22.3783 -22.2639 -22.2588 -22.2389 -22.2357 -9.0544 -9.0380 -9.0202 -9.0051 -8.6850 -8.6826 -8.2874 -8.2561 -8.1455 -8.1420 -8.0596 -8.0477 2.8959 2.9010 3.2181 3.2256 3.2379 3.2416 3.6934 3.7000 4.1793 4.1822 4.2328 4.2372 4.9046 4.9066 5.0161 5.0338 5.4105 5.4128 5.5677 5.5695 5.9099 5.9311 5.9878 5.9882 6.2187 6.2306 6.3660 6.3718 6.7252 6.7310 6.7733 6.7755 6.8550 6.8633 7.2410 7.2412 11.4215 11.4217 11.5977 11.6180 11.9869 12.0006 12.2520 12.2902 12.5199 12.5202 12.6518 12.6821 15.2707 15.2787 k = 0.6049 0.3205-0.1876 ( 12575 PWs) bands (ev): -46.7051 -46.7051 -46.7037 -46.7037 -35.1714 -35.1714 -35.1711 -35.1711 -24.3858 -24.3825 -24.3670 -24.3631 -22.3986 -22.3979 -22.3823 -22.3783 -22.2642 -22.2596 -22.2408 -22.2377 -9.0441 -9.0286 -9.0191 -9.0041 -8.6741 -8.6716 -8.3008 -8.2685 -8.1557 -8.1519 -8.0650 -8.0521 2.9184 2.9243 3.2414 3.2497 3.2613 3.2645 3.7292 3.7362 4.1697 4.1730 4.2118 4.2156 4.8781 4.8797 4.9817 4.9989 5.3951 5.3978 5.5394 5.5397 5.8925 5.9109 5.9916 5.9919 6.2282 6.2394 6.3591 6.3635 6.7510 6.7548 6.7751 6.7790 6.8597 6.8635 7.2374 7.2379 11.4453 11.4455 11.6246 11.6455 11.9916 12.0056 12.2566 12.2918 12.5134 12.5149 12.6406 12.6699 15.2908 15.2973 k = 0.6003 0.3181-0.1715 ( 12586 PWs) bands (ev): -46.7050 -46.7050 -46.7038 -46.7038 -35.1714 -35.1714 -35.1712 -35.1712 -24.3850 -24.3820 -24.3672 -24.3636 -22.3964 -22.3958 -22.3819 -22.3781 -22.2647 -22.2605 -22.2428 -22.2398 -9.0340 -9.0233 -9.0127 -9.0019 -8.6631 -8.6605 -8.3142 -8.2809 -8.1659 -8.1619 -8.0717 -8.0579 2.9444 2.9510 3.2650 3.2739 3.2866 3.2895 3.7644 3.7716 4.1615 4.1656 4.1928 4.1956 4.8477 4.8489 4.9476 4.9643 5.3762 5.3790 5.5027 5.5033 5.8699 5.8858 5.9987 5.9995 6.2479 6.2580 6.3500 6.3528 6.7666 6.7700 6.7895 6.7904 6.8650 6.8652 7.2333 7.2342 11.4697 11.4701 11.6515 11.6728 11.9968 12.0111 12.2611 12.2933 12.5051 12.5084 12.6290 12.6572 15.3108 15.3160 k = 0.5958 0.3157-0.1555 ( 12593 PWs) bands (ev): -46.7049 -46.7049 -46.7039 -46.7039 -35.1714 -35.1714 -35.1712 -35.1712 -24.3843 -24.3814 -24.3675 -24.3641 -22.3942 -22.3936 -22.3812 -22.3778 -22.2653 -22.2616 -22.2448 -22.2419 -9.0240 -9.0202 -9.0030 -8.9985 -8.6519 -8.6492 -8.3275 -8.2933 -8.1762 -8.1720 -8.0798 -8.0652 2.9737 2.9811 3.2893 3.2985 3.3133 3.3162 3.7981 3.8056 4.1549 4.1605 4.1767 4.1775 4.8142 4.8151 4.9141 4.9303 5.3535 5.3564 5.4606 5.4617 5.8423 5.8563 6.0073 6.0081 6.2750 6.2840 6.3401 6.3413 6.7707 6.7774 6.8123 6.8152 6.8681 6.8705 7.2288 7.2299 11.4947 11.4953 11.6780 11.6997 12.0026 12.0172 12.2657 12.2948 12.4955 12.5005 12.6171 12.6440 15.3310 15.3351 k = 0.5912 0.3133-0.1394 ( 12592 PWs) bands (ev): -46.7048 -46.7048 -46.7040 -46.7040 -35.1714 -35.1714 -35.1712 -35.1712 -24.3836 -24.3810 -24.3677 -24.3646 -22.3918 -22.3914 -22.3804 -22.3773 -22.2661 -22.2628 -22.2469 -22.2441 -9.0167 -9.0141 -8.9939 -8.9927 -8.6406 -8.6379 -8.3406 -8.3056 -8.1865 -8.1821 -8.0892 -8.0739 3.0062 3.0143 3.3144 3.3237 3.3412 3.3441 3.8296 3.8372 4.1480 4.1575 4.1626 4.1660 4.7783 4.7788 4.8813 4.8969 5.3272 5.3299 5.4149 5.4164 5.8109 5.8235 6.0141 6.0143 6.3061 6.3146 6.3319 6.3323 6.7755 6.7827 6.8381 6.8411 6.8721 6.8761 7.2238 7.2252 11.5205 11.5211 11.7040 11.7259 12.0090 12.0240 12.2704 12.2961 12.4845 12.4912 12.6047 12.6303 15.3516 15.3548 k = 0.5866 0.3108-0.1233 ( 12587 PWs) bands (ev): -46.7048 -46.7048 -46.7040 -46.7040 -35.1713 -35.1713 -35.1712 -35.1712 -24.3829 -24.3805 -24.3679 -24.3650 -22.3895 -22.3891 -22.3795 -22.3766 -22.2671 -22.2642 -22.2490 -22.2464 -9.0123 -9.0045 -8.9881 -8.9825 -8.6293 -8.6264 -8.3534 -8.3179 -8.1967 -8.1923 -8.0999 -8.0839 3.0418 3.0505 3.3404 3.3499 3.3700 3.3730 3.8579 3.8655 4.1382 4.1458 4.1628 4.1648 4.7407 4.7409 4.8493 4.8644 5.2975 5.3001 5.3668 5.3684 5.7767 5.7884 6.0137 6.0147 6.3245 6.3283 6.3441 6.3483 6.7821 6.7888 6.8629 6.8667 6.8778 6.8818 7.2183 7.2201 11.5468 11.5477 11.7292 11.7513 12.0159 12.0315 12.2750 12.2974 12.4721 12.4805 12.5918 12.6160 15.3729 15.3756 k = 0.5821 0.3084-0.1073 ( 12583 PWs) bands (ev): -46.7047 -46.7047 -46.7041 -46.7041 -35.1713 -35.1713 -35.1712 -35.1712 -24.3822 -24.3800 -24.3680 -24.3655 -22.3871 -22.3868 -22.3784 -22.3759 -22.2682 -22.2656 -22.2511 -22.2487 -9.0068 -8.9951 -8.9813 -8.9723 -8.6178 -8.6148 -8.3660 -8.3300 -8.2070 -8.2026 -8.1119 -8.0953 3.0803 3.0895 3.3675 3.3771 3.3996 3.4026 3.8818 3.8892 4.1276 4.1335 4.1710 4.1720 4.7017 4.7018 4.8183 4.8328 5.2650 5.2675 5.3171 5.3187 5.7405 5.7516 6.0024 6.0051 6.3301 6.3335 6.3784 6.3827 6.7905 6.7963 6.8782 6.8874 6.8920 6.8931 7.2125 7.2146 11.5737 11.5748 11.7535 11.7757 12.0235 12.0396 12.2796 12.2985 12.4585 12.4684 12.5783 12.6011 15.3954 15.3979 k = 0.5775 0.3060-0.0912 ( 12585 PWs) bands (ev): -46.7047 -46.7047 -46.7041 -46.7041 -35.1713 -35.1713 -35.1712 -35.1712 -24.3815 -24.3796 -24.3682 -24.3658 -22.3847 -22.3845 -22.3772 -22.3749 -22.2695 -22.2672 -22.2533 -22.2510 -9.0004 -8.9859 -8.9735 -8.9623 -8.6063 -8.6032 -8.3781 -8.3419 -8.2173 -8.2128 -8.1250 -8.1079 3.1215 3.1311 3.3957 3.4053 3.4298 3.4329 3.9007 3.9076 4.1182 4.1231 4.1855 4.1865 4.6616 4.6620 4.7886 4.8025 5.2302 5.2325 5.2664 5.2680 5.7030 5.7136 5.9787 5.9832 6.3446 6.3482 6.4139 6.4173 6.8005 6.8052 6.8848 6.8932 6.9163 6.9167 7.2062 7.2086 11.6012 11.6025 11.7770 11.7990 12.0316 12.0483 12.2840 12.2994 12.4437 12.4552 12.5642 12.5856 15.4195 15.4221 k = 0.5730 0.3036-0.0752 ( 12581 PWs) bands (ev): -46.7046 -46.7046 -46.7042 -46.7042 -35.1713 -35.1713 -35.1712 -35.1712 -24.3809 -24.3791 -24.3683 -24.3662 -22.3823 -22.3821 -22.3759 -22.3739 -22.2709 -22.2689 -22.2556 -22.2534 -8.9931 -8.9768 -8.9650 -8.9525 -8.5947 -8.5915 -8.3899 -8.3534 -8.2275 -8.2231 -8.1391 -8.1217 3.1651 3.1750 3.4248 3.4345 3.4604 3.4636 3.9142 3.9206 4.1105 4.1148 4.2064 4.2076 4.6210 4.6218 4.7602 4.7735 5.1935 5.1954 5.2157 5.2170 5.6645 5.6748 5.9436 5.9499 6.3676 6.3715 6.4487 6.4512 6.8118 6.8152 6.8908 6.8989 6.9397 6.9402 7.1995 7.2023 11.6292 11.6307 11.7994 11.8211 12.0403 12.0577 12.2882 12.3000 12.4279 12.4408 12.5496 12.5695 15.4455 15.4484 k = 0.5684 0.3012-0.0591 ( 12583 PWs) bands (ev): -46.7046 -46.7046 -46.7042 -46.7042 -35.1713 -35.1713 -35.1712 -35.1712 -24.3802 -24.3787 -24.3684 -24.3666 -22.3799 -22.3798 -22.3745 -22.3727 -22.2724 -22.2706 -22.2578 -22.2559 -8.9849 -8.9677 -8.9559 -8.9429 -8.5830 -8.5798 -8.4010 -8.3646 -8.2378 -8.2334 -8.1542 -8.1366 3.2109 3.2211 3.4549 3.4646 3.4915 3.4947 3.9230 3.9288 4.1047 4.1085 4.2329 4.2344 4.5802 4.5814 4.7334 4.7460 5.1545 5.1552 5.1668 5.1668 5.6254 5.6355 5.8993 5.9071 6.3969 6.4010 6.4824 6.4841 6.8243 6.8263 6.8970 6.9047 6.9618 6.9626 7.1925 7.1956 11.6577 11.6594 11.8208 11.8421 12.0495 12.0677 12.2920 12.3002 12.4111 12.4254 12.5343 12.5527 15.4736 15.4770 k = 0.5638 0.2988-0.0430 ( 12579 PWs) bands (ev): -46.7046 -46.7046 -46.7043 -46.7043 -35.1713 -35.1713 -35.1712 -35.1712 -24.3796 -24.3782 -24.3685 -24.3669 -22.3775 -22.3774 -22.3729 -22.3715 -22.2739 -22.2724 -22.2601 -22.2584 -8.9760 -8.9585 -8.9464 -8.9335 -8.5714 -8.5681 -8.4115 -8.3754 -8.2480 -8.2437 -8.1701 -8.1524 3.2586 3.2689 3.4858 3.4956 3.5229 3.5262 3.9280 3.9333 4.1009 4.1043 4.2639 4.2656 4.5396 4.5414 4.7084 4.7203 5.1087 5.1100 5.1216 5.1235 5.5858 5.5956 5.8479 5.8571 6.4301 6.4345 6.5145 6.5154 6.8376 6.8382 6.9035 6.9107 6.9827 6.9837 7.1852 7.1885 11.6864 11.6884 11.8412 11.8620 12.0592 12.0783 12.2953 12.2998 12.3937 12.4091 12.5183 12.5352 15.5041 15.5080 k = 0.5593 0.2963-0.0270 ( 12585 PWs) bands (ev): -46.7045 -46.7045 -46.7043 -46.7043 -35.1713 -35.1713 -35.1712 -35.1712 -24.3790 -24.3778 -24.3687 -24.3673 -22.3752 -22.3751 -22.3714 -22.3701 -22.2755 -22.2742 -22.2624 -22.2609 -8.9665 -8.9493 -8.9367 -8.9245 -8.5598 -8.5564 -8.4213 -8.3856 -8.2582 -8.2540 -8.1867 -8.1691 3.3078 3.3181 3.5174 3.5272 3.5545 3.5578 3.9302 3.9351 4.0990 4.1020 4.2980 4.2993 4.4995 4.5023 4.6855 4.6966 5.0593 5.0609 5.0812 5.0835 5.5458 5.5555 5.7912 5.8016 6.4653 6.4698 6.5447 6.5450 6.8508 6.8516 6.9104 6.9170 7.0020 7.0032 7.1775 7.1810 11.7155 11.7176 11.8607 11.8809 12.0694 12.0894 12.2979 12.2986 12.3758 12.3921 12.5018 12.5172 15.5369 15.5414 k = 0.5547 0.2939-0.0109 ( 12582 PWs) bands (ev): -46.7045 -46.7045 -46.7043 -46.7043 -35.1713 -35.1713 -35.1712 -35.1712 -24.3784 -24.3774 -24.3688 -24.3676 -22.3728 -22.3728 -22.3697 -22.3687 -22.2771 -22.2759 -22.2648 -22.2634 -8.9565 -8.9402 -8.9269 -8.9157 -8.5481 -8.5447 -8.4301 -8.3951 -8.2684 -8.2643 -8.2039 -8.1866 3.3581 3.3684 3.5496 3.5593 3.5861 3.5897 3.9305 3.9351 4.0989 4.1016 4.3329 4.3332 4.4610 4.4659 4.6650 4.6752 5.0103 5.0117 5.0419 5.0440 5.5056 5.5152 5.7308 5.7420 6.5010 6.5057 6.5727 6.5729 6.8639 6.8661 6.9179 6.9237 7.0196 7.0209 7.1694 7.1732 11.7447 11.7470 11.8794 11.8987 12.0800 12.1009 12.2963 12.2996 12.3579 12.3747 12.4846 12.4986 15.5720 15.5772 k = 0.5502 0.2915 0.0051 ( 12578 PWs) bands (ev): -46.7045 -46.7045 -46.7043 -46.7043 -35.1713 -35.1713 -35.1712 -35.1712 -24.3778 -24.3769 -24.3690 -24.3680 -22.3705 -22.3705 -22.3680 -22.3672 -22.2786 -22.2777 -22.2671 -22.2660 -8.9462 -8.9311 -8.9171 -8.9073 -8.5366 -8.5330 -8.4378 -8.4039 -8.2786 -8.2746 -8.2214 -8.2046 3.4092 3.4192 3.5822 3.5917 3.6179 3.6217 3.9295 3.9339 4.1003 4.1027 4.3585 4.3637 4.4294 4.4395 4.6472 4.6565 4.9626 4.9638 5.0030 5.0050 5.4654 5.4747 5.6675 5.6795 6.5361 6.5410 6.5983 6.5990 6.8774 6.8810 6.9259 6.9309 7.0354 7.0366 7.1611 7.1651 11.7738 11.7763 11.8973 11.9157 12.0909 12.1128 12.2923 12.3003 12.3405 12.3572 12.4669 12.4794 15.6094 15.6152 k = 0.5456 0.2891 0.0212 ( 12579 PWs) bands (ev): -46.7045 -46.7045 -46.7044 -46.7044 -35.1713 -35.1713 -35.1712 -35.1712 -24.3772 -24.3765 -24.3692 -24.3683 -22.3683 -22.3683 -22.3663 -22.3657 -22.2802 -22.2794 -22.2695 -22.2685 -8.9357 -8.9223 -8.9075 -8.8993 -8.5251 -8.5214 -8.4444 -8.4118 -8.2888 -8.2849 -8.2393 -8.2231 3.4605 3.4702 3.6147 3.6239 3.6496 3.6538 3.9276 3.9319 4.1030 4.1051 4.3538 4.3613 4.4321 4.4447 4.6326 4.6409 4.9168 4.9177 4.9647 4.9666 5.4251 5.4343 5.6026 5.6150 6.5698 6.5746 6.6219 6.6229 6.8914 6.8962 6.9347 6.9387 7.0491 7.0502 7.1525 7.1566 11.8027 11.8053 11.9147 11.9319 12.1020 12.1251 12.2858 12.2995 12.3249 12.3400 12.4486 12.4597 15.6489 15.6552 k = 0.5410 0.2867 0.0373 ( 12577 PWs) bands (ev): -46.7045 -46.7045 -46.7044 -46.7044 -35.1713 -35.1713 -35.1712 -35.1712 -24.3767 -24.3761 -24.3693 -24.3687 -22.3662 -22.3661 -22.3647 -22.3641 -22.2817 -22.2810 -22.2718 -22.2710 -8.9252 -8.9137 -8.8982 -8.8917 -8.5136 -8.5099 -8.4496 -8.4187 -8.2990 -8.2953 -8.2572 -8.2419 3.5116 3.5208 3.6469 3.6556 3.6814 3.6861 3.9250 3.9294 4.1066 4.1082 4.3246 4.3295 4.4652 4.4753 4.6216 4.6287 4.8734 4.8741 4.9273 4.9291 5.3851 5.3940 5.5367 5.5494 6.6012 6.6059 6.6434 6.6446 6.9058 6.9117 6.9442 6.9473 7.0606 7.0615 7.1435 7.1478 11.8312 11.8338 11.9315 11.9475 12.1133 12.1376 12.2756 12.2965 12.3123 12.3241 12.4298 12.4396 15.6902 15.6971 k = 0.5365 0.2843 0.0533 ( 12571 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3761 -24.3756 -24.3696 -24.3690 -22.3641 -22.3641 -22.3630 -22.3626 -22.2831 -22.2826 -22.2741 -22.2734 -8.9149 -8.9054 -8.8896 -8.8848 -8.5024 -8.4986 -8.4532 -8.4245 -8.3090 -8.3056 -8.2749 -8.2607 3.5619 3.5705 3.6783 3.6863 3.7131 3.7185 3.9220 3.9265 4.1104 4.1115 4.2898 4.2935 4.5032 4.5119 4.6147 4.6206 4.8332 4.8335 4.8910 4.8928 5.3454 5.3540 5.4710 5.4837 6.6296 6.6340 6.6628 6.6640 6.9208 6.9274 6.9544 6.9566 7.0698 7.0704 7.1343 7.1386 11.8591 11.8616 11.9478 11.9623 12.1247 12.1503 12.2619 12.2895 12.3029 12.3116 12.4107 12.4192 15.7330 15.7404 k = 0.5319 0.2818 0.0694 ( 12589 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1712 -35.1712 -24.3756 -24.3752 -24.3698 -24.3694 -22.3623 -22.3622 -22.3615 -22.3612 -22.2844 -22.2840 -22.2763 -22.2758 -8.9049 -8.8975 -8.8816 -8.8784 -8.4913 -8.4876 -8.4552 -8.4291 -8.3190 -8.3158 -8.2923 -8.2795 3.6110 3.6188 3.7083 3.7155 3.7447 3.7509 3.9186 3.9232 4.1136 4.1141 4.2542 4.2574 4.5413 4.5491 4.6126 4.6172 4.7966 4.7967 4.8564 4.8581 5.3064 5.3146 5.4065 5.4189 6.6548 6.6586 6.6802 6.6812 6.9363 6.9433 6.9652 6.9667 7.0766 7.0768 7.1248 7.1291 11.8859 11.8882 11.9638 11.9764 12.1361 12.1630 12.2463 12.2778 12.2954 12.3034 12.3912 12.3986 15.7770 15.7850 k = 0.5274 0.2794 0.0855 ( 12597 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1712 -35.1712 -24.3750 -24.3748 -24.3701 -24.3698 -22.3605 -22.3605 -22.3600 -22.3598 -22.2855 -22.2852 -22.2784 -22.2780 -8.8955 -8.8901 -8.8747 -8.8728 -8.4805 -8.4769 -8.4553 -8.4323 -8.3289 -8.3260 -8.3090 -8.2980 3.6582 3.6652 3.7365 3.7429 3.7759 3.7828 3.9146 3.9195 4.1153 4.1155 4.2193 4.2222 4.5780 4.5845 4.6158 4.6195 4.7642 4.7648 4.8236 4.8253 5.2684 5.2760 5.3443 5.3561 6.6763 6.6793 6.6954 6.6962 6.9525 6.9594 6.9765 6.9775 7.0807 7.0810 7.1150 7.1193 11.9115 11.9133 11.9792 11.9897 12.1471 12.1757 12.2305 12.2644 12.2887 12.2973 12.3718 12.3780 15.8215 15.8302 k = 0.5228 0.2770 0.1015 ( 12594 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3745 -24.3743 -24.3704 -24.3701 -22.3590 -22.3589 -22.3587 -22.3585 -22.2864 -22.2862 -22.2803 -22.2801 -8.8869 -8.8832 -8.8690 -8.8680 -8.4701 -8.4669 -8.4533 -8.4341 -8.3385 -8.3359 -8.3249 -8.3157 3.7029 3.7089 3.7625 3.7682 3.8059 3.8136 3.9101 3.9153 4.1144 4.1152 4.1858 4.1886 4.6108 4.6138 4.6256 4.6306 4.7370 4.7381 4.7932 4.7948 5.2319 5.2386 5.2861 5.2967 6.6941 6.6962 6.7084 6.7088 6.9691 6.9755 6.9880 6.9889 7.0819 7.0828 7.1050 7.1092 11.9353 11.9367 11.9936 12.0017 12.1577 12.1883 12.2157 12.2517 12.2824 12.2914 12.3525 12.3576 15.8662 15.8758 k = 0.5182 0.2746 0.1176 ( 12607 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1712 -35.1712 -24.3740 -24.3739 -24.3707 -24.3705 -22.3577 -22.3576 -22.3575 -22.3574 -22.2871 -22.2869 -22.2821 -22.2820 -8.8792 -8.8770 -8.8645 -8.8643 -8.4602 -8.4580 -8.4490 -8.4346 -8.3477 -8.3456 -8.3394 -8.3325 3.7444 3.7495 3.7861 3.7911 3.8338 3.8420 3.9049 3.9105 4.1108 4.1122 4.1548 4.1575 4.6314 4.6324 4.6475 4.6542 4.7157 4.7172 4.7656 4.7672 5.1978 5.2032 5.2340 5.2427 6.7083 6.7096 6.7189 6.7191 6.9857 6.9914 6.9998 7.0006 7.0806 7.0822 7.0947 7.0989 11.9571 11.9579 12.0064 12.0118 12.1674 12.2005 12.2030 12.2413 12.2766 12.2852 12.3338 12.3378 15.9105 15.9206 k = 0.5137 0.2722 0.1336 ( 12601 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3735 -24.3734 -24.3710 -24.3709 -22.3566 -22.3566 -22.3566 -22.3565 -22.2875 -22.2874 -22.2837 -22.2836 -8.8727 -8.8716 -8.8615 -8.8615 -8.4511 -8.4504 -8.4430 -8.4341 -8.3563 -8.3547 -8.3520 -8.3476 3.7819 3.7859 3.8071 3.8112 3.8579 3.8663 3.8991 3.9053 4.1047 4.1063 4.1275 4.1300 4.6477 4.6498 4.6714 4.6772 4.7007 4.7031 4.7415 4.7430 5.1674 5.1708 5.1904 5.1962 6.7192 6.7198 6.7269 6.7269 7.0020 7.0065 7.0114 7.0123 7.0769 7.0793 7.0843 7.0885 11.9765 11.9768 12.0162 12.0191 12.1755 12.1933 12.2119 12.2339 12.2720 12.2789 12.3161 12.3190 15.9544 15.9638 k = 0.5091 0.2698 0.1497 ( 12599 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1712 -35.1712 -35.1712 -35.1712 -24.3730 -24.3730 -24.3714 -24.3713 -22.3559 -22.3559 -22.3558 -22.3558 -22.2876 -22.2876 -22.2851 -22.2850 -8.8674 -8.8670 -8.8600 -8.8599 -8.4436 -8.4432 -8.4369 -8.4329 -8.3636 -8.3628 -8.3621 -8.3600 3.8134 3.8163 3.8250 3.8281 3.8758 3.8842 3.8930 3.9000 4.0971 4.0984 4.1063 4.1081 4.6654 4.6679 4.6867 4.6913 4.6939 4.6972 4.7213 4.7228 5.1430 5.1442 5.1571 5.1597 6.7271 6.7273 6.7321 6.7322 7.0172 7.0202 7.0227 7.0237 7.0710 7.0740 7.0745 7.0783 11.9931 11.9932 12.0216 12.0227 12.1813 12.1874 12.2217 12.2302 12.2697 12.2738 12.3002 12.3020 15.9936 16.0006 k = 0.5046 0.2673 0.1658 ( 12620 PWs) bands (ev): -46.7045 -46.7045 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3726 -24.3726 -24.3718 -24.3717 -22.3554 -22.3554 -22.3554 -22.3554 -22.2875 -22.2874 -22.2862 -22.2862 -8.8635 -8.8634 -8.8598 -8.8598 -8.4375 -8.4371 -8.4332 -8.4323 -8.3689 -8.3689 -8.3687 -8.3685 3.8357 3.8368 3.8393 3.8405 3.8853 3.8883 3.8935 3.8961 4.0903 4.0906 4.0935 4.0939 4.6821 4.6840 4.6904 4.6905 4.6991 4.7001 4.7057 4.7072 5.1276 5.1277 5.1349 5.1354 6.7322 6.7323 6.7347 6.7348 7.0301 7.0313 7.0326 7.0334 7.0639 7.0645 7.0687 7.0694 12.0066 12.0066 12.0216 12.0219 12.1843 12.1851 12.2283 12.2296 12.2711 12.2722 12.2868 12.2874 16.0302 16.0338 k = 0.5000 0.2649 0.1818 ( 12616 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3722 -24.3722 -24.3722 -24.3722 -22.3553 -22.3553 -22.3552 -22.3552 -22.2870 -22.2870 -22.2870 -22.2870 -8.8610 -8.8610 -8.8609 -8.8609 -8.4334 -8.4334 -8.4334 -8.4334 -8.3714 -8.3714 -8.3709 -8.3709 3.8446 3.8446 3.8447 3.8447 3.8872 3.8872 3.8953 3.8953 4.0883 4.0883 4.0883 4.0883 4.6931 4.6931 4.6932 4.6932 4.6966 4.6966 4.6992 4.6992 5.1246 5.1246 5.1246 5.1246 6.7348 6.7348 6.7348 6.7348 7.0371 7.0371 7.0371 7.0371 7.0595 7.0595 7.0654 7.0654 12.0164 12.0164 12.0164 12.0164 12.1849 12.1849 12.2302 12.2302 12.2768 12.2768 12.2768 12.2768 16.0557 16.0558 k = 0.5000-0.3393-0.2329 ( 12592 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3796 -24.3796 -24.3662 -24.3662 -22.3597 -22.3597 -22.3588 -22.3588 -22.2948 -22.2948 -22.2751 -22.2751 -8.8013 -8.8013 -8.7904 -8.7904 -8.4770 -8.4770 -8.4708 -8.4708 -8.3727 -8.3727 -8.3650 -8.3650 3.3524 3.3524 3.3526 3.3526 3.6262 3.6262 3.6284 3.6284 4.1227 4.1227 4.1403 4.1403 4.5974 4.5974 4.6107 4.6107 5.1234 5.1234 5.1430 5.1430 5.5670 5.5670 5.5937 5.5937 6.9181 6.9181 6.9182 6.9182 7.0630 7.0630 7.0659 7.0659 7.1486 7.1486 7.1573 7.1573 11.2641 11.2641 11.2926 11.2926 12.1015 12.1015 12.1073 12.1073 12.3320 12.3320 12.3437 12.3437 15.6600 15.6600 k = 0.5110-0.3283-0.2253 ( 12593 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3801 -24.3791 -24.3667 -24.3657 -22.3603 -22.3597 -22.3595 -22.3583 -22.2957 -22.2936 -22.2758 -22.2742 -8.8054 -8.7995 -8.7939 -8.7891 -8.4924 -8.4881 -8.4611 -8.4529 -8.3776 -8.3693 -8.3656 -8.3588 3.3336 3.3348 3.3671 3.3682 3.6188 3.6190 3.6333 3.6380 4.1141 4.1300 4.1334 4.1458 4.5912 4.6066 4.6070 4.6183 5.1214 5.1259 5.1419 5.1439 5.5381 5.5658 5.6029 5.6279 6.8958 6.8959 6.9351 6.9352 7.0616 7.0618 7.0628 7.0680 7.1450 7.1504 7.1522 7.1633 11.2488 11.2777 11.2802 11.3082 12.0895 12.0927 12.1138 12.1216 12.3151 12.3220 12.3512 12.3671 15.6295 15.6558 k = 0.5220-0.3173-0.2177 ( 12595 PWs) bands (ev): -46.7044 -46.7044 -46.7044 -46.7044 -35.1713 -35.1713 -35.1713 -35.1713 -24.3806 -24.3786 -24.3673 -24.3653 -22.3612 -22.3608 -22.3597 -22.3580 -22.2961 -22.2919 -22.2761 -22.2729 -8.8115 -8.8002 -8.7995 -8.7904 -8.5069 -8.5041 -8.4462 -8.4350 -8.3792 -8.3710 -8.3568 -8.3513 3.3123 3.3140 3.3779 3.3806 3.6091 3.6106 3.6410 3.6484 4.1041 4.1244 4.1363 4.1504 4.5885 4.6062 4.6194 4.6290 5.1198 5.1291 5.1412 5.1442 5.5171 5.5449 5.6444 5.6673 6.8690 6.8692 6.9461 6.9461 7.0547 7.0588 7.0617 7.0682 7.1415 7.1429 7.1562 7.1686 11.2349 11.2639 11.2970 11.3241 12.0778 12.0781 12.1264 12.1356 12.3009 12.3024 12.3721 12.3917 15.5992 15.6251 k = 0.5331-0.3062-0.2102 ( 12593 PWs) bands (ev): -46.7044 -46.7044 -46.7043 -46.7043 -35.1713 -35.1713 -35.1713 -35.1713 -24.3811 -24.3781 -24.3679 -24.3648 -22.3624 -22.3621 -22.3603 -22.3581 -22.2960 -22.2900 -22.2762 -22.2715 -8.8193 -8.8069 -8.8035 -8.7943 -8.5201 -8.5188 -8.4341 -8.4189 -8.3756 -8.3686 -8.3468 -8.3428 3.2891 3.2909 3.3846 3.3890 3.5981 3.6009 3.6498 3.6601 4.0925 4.1133 4.1419 4.1547 4.5893 4.6092 4.6343 4.6422 5.1184 5.1334 5.1404 5.1449 5.5047 5.5317 5.6904 5.7110 6.8384 6.8388 6.9505 6.9507 7.0447 7.0529 7.0598 7.0664 7.1353 7.1382 7.1609 7.1736 11.2225 11.2514 11.3140 11.3401 12.0633 12.0662 12.1392 12.1494 12.2855 12.2901 12.3943 12.4171 15.5689 15.5943 k = 0.5441-0.2952-0.2026 ( 12595 PWs) bands (ev): -46.7045 -46.7045 -46.7043 -46.7043 -35.1713 -35.1713 -35.1713 -35.1713 -24.3816 -24.3776 -24.3685 -24.3644 -22.3638 -22.3637 -22.3613 -22.3584 -22.2956 -22.2877 -22.2760 -22.2698 -8.8285 -8.8158 -8.8093 -8.8007 -8.5321 -8.5320 -8.4261 -8.4069 -8.3658 -8.3599 -8.3356 -8.3333 3.2642 3.2658 3.3875 3.3935 3.5855 3.5892 3.6601 3.6731 4.0794 4.1001 4.1474 4.1594 4.5935 4.6154 4.6509 4.6574 5.1172 5.1383 5.1398 5.1483 5.5010 5.5262 5.7398 5.7581 6.8046 6.8051 6.9487 6.9491 7.0314 7.0431 7.0564 7.0619 7.1280 7.1349 7.1667 7.1787 11.2120 11.2406 11.3307 11.3556 12.0486 12.0547 12.1521 12.1626 12.2717 12.2829 12.4172 12.4428 15.5387 15.5636 k = 0.5551-0.2842-0.1950 ( 12590 PWs) bands (ev): -46.7045 -46.7045 -46.7043 -46.7043 -35.1713 -35.1713 -35.1713 -35.1713 -24.3820 -24.3771 -24.3691 -24.3640 -22.3655 -22.3653 -22.3626 -22.3589 -22.2947 -22.2852 -22.2754 -22.2679 -8.8389 -8.8259 -8.8175 -8.8095 -8.5442 -8.5429 -8.4212 -8.3992 -8.3512 -8.3448 -8.3230 -8.3229 3.2381 3.2392 3.3867 3.3941 3.5710 3.5754 3.6720 3.6872 4.0652 4.0852 4.1532 4.1648 4.6006 4.6241 4.6690 4.6741 5.1164 5.1355 5.1489 5.1551 5.5054 5.5282 5.7917 5.8075 6.7680 6.7688 6.9416 6.9423 7.0149 7.0293 7.0503 7.0537 7.1209 7.1313 7.1741 7.1847 11.2036 11.2317 11.3470 11.3703 12.0340 12.0432 12.1651 12.1755 12.2615 12.2796 12.4404 12.4685 15.5086 15.5328 k = 0.5661-0.2731-0.1874 ( 12586 PWs) bands (ev): -46.7045 -46.7045 -46.7043 -46.7043 -35.1713 -35.1713 -35.1713 -35.1713 -24.3825 -24.3766 -24.3698 -24.3637 -22.3675 -22.3670 -22.3642 -22.3597 -22.2935 -22.2824 -22.2747 -22.2659 -8.8503 -8.8371 -8.8278 -8.8203 -8.5554 -8.5530 -8.4172 -8.3936 -8.3348 -8.3266 -8.3112 -8.3086 3.2110 3.2115 3.3827 3.3912 3.5546 3.5592 3.6851 3.7020 4.0502 4.0691 4.1596 4.1710 4.6102 4.6348 4.6881 4.6918 5.1167 5.1337 5.1612 5.1653 5.5169 5.5368 5.8449 5.8584 6.7292 6.7301 6.9303 6.9311 6.9955 7.0118 7.0402 7.0413 7.1139 7.1270 7.1827 7.1916 11.1974 11.2248 11.3622 11.3839 12.0197 12.0317 12.1779 12.1879 12.2551 12.2801 12.4636 12.4939 15.4787 15.5022 k = 0.5771-0.2621-0.1799 ( 12585 PWs) bands (ev): -46.7045 -46.7045 -46.7042 -46.7042 -35.1713 -35.1713 -35.1712 -35.1712 -24.3830 -24.3761 -24.3705 -24.3634 -22.3696 -22.3688 -22.3661 -22.3606 -22.2921 -22.2796 -22.2737 -22.2638 -8.8625 -8.8491 -8.8396 -8.8327 -8.5659 -8.5626 -8.4127 -8.3880 -8.3186 -8.3089 -8.2966 -8.2920 3.1829 3.1831 3.3762 3.3853 3.5362 3.5409 3.6987 3.7167 4.0352 4.0527 4.1665 4.1780 4.6217 4.6470 4.7080 4.7103 5.1189 5.1339 5.1768 5.1792 5.5342 5.5513 5.8987 5.9098 6.6886 6.6897 6.9157 6.9166 6.9735 6.9909 7.0243 7.0255 7.1066 7.1220 7.1921 7.1994 11.1936 11.2201 11.3762 11.3961 12.0059 12.0203 12.1906 12.2003 12.2528 12.2841 12.4862 12.5186 15.4491 15.4717 k = 0.5882-0.2510-0.1723 ( 12579 PWs) bands (ev): -46.7046 -46.7046 -46.7042 -46.7042 -35.1713 -35.1713 -35.1712 -35.1712 -24.3834 -24.3756 -24.3712 -24.3631 -22.3719 -22.3707 -22.3681 -22.3617 -22.2904 -22.2766 -22.2726 -22.2616 -8.8753 -8.8619 -8.8526 -8.8462 -8.5760 -8.5721 -8.4072 -8.3817 -8.3035 -8.2946 -8.2777 -8.2733 3.1538 3.1548 3.3675 3.3771 3.5159 3.5206 3.7119 3.7301 4.0212 4.0369 4.1741 4.1856 4.6349 4.6602 4.7288 4.7295 5.1237 5.1372 5.1959 5.1968 5.5563 5.5707 5.9521 5.9608 6.6469 6.6480 6.8985 6.8993 6.9492 6.9674 7.0030 7.0061 7.0988 7.1161 7.2018 7.2076 11.1923 11.2178 11.3886 11.4065 11.9929 12.0092 12.2030 12.2129 12.2544 12.2911 12.5081 12.5424 15.4199 15.4416 k = 0.5992-0.2400-0.1647 ( 12587 PWs) bands (ev): -46.7046 -46.7046 -46.7042 -46.7042 -35.1713 -35.1713 -35.1712 -35.1712 -24.3839 -24.3751 -24.3720 -24.3628 -22.3743 -22.3726 -22.3702 -22.3629 -22.2886 -22.2735 -22.2713 -22.2593 -8.8887 -8.8752 -8.8663 -8.8605 -8.5859 -8.5816 -8.4004 -8.3744 -8.2893 -8.2820 -8.2568 -8.2533 3.1245 3.1262 3.3571 3.3669 3.4941 3.4986 3.7236 3.7411 4.0094 4.0229 4.1821 4.1936 4.6493 4.6743 4.7496 4.7505 5.1316 5.1442 5.2179 5.2182 5.5821 5.5941 6.0039 6.0101 6.6050 6.6058 6.8792 6.8799 6.9228 6.9415 6.9775 6.9821 7.0902 7.1090 7.2112 7.2159 11.1936 11.2178 11.3992 11.4149 11.9809 11.9985 12.2149 12.2262 12.2598 12.3002 12.5290 12.5651 15.3912 15.4120 k = 0.6102-0.2290-0.1571 ( 12587 PWs) bands (ev): -46.7046 -46.7046 -46.7041 -46.7041 -35.1713 -35.1713 -35.1712 -35.1712 -24.3843 -24.3745 -24.3728 -24.3625 -22.3767 -22.3747 -22.3722 -22.3642 -22.2867 -22.2704 -22.2699 -22.2570 -8.9025 -8.8890 -8.8803 -8.8751 -8.5957 -8.5912 -8.3924 -8.3660 -8.2757 -8.2696 -8.2356 -8.2327 3.0952 3.0976 3.3455 3.3553 3.4709 3.4752 3.7325 3.7483 4.0012 4.0120 4.1906 4.2017 4.6648 4.6890 4.7710 4.7734 5.1428 5.1549 5.2421 5.2433 5.6110 5.6207 6.0528 6.0564 6.5640 6.5644 6.8582 6.8585 6.8949 6.9138 6.9481 6.9539 7.0808 7.1010 7.2201 7.2239 11.1975 11.2203 11.4078 11.4213 11.9702 11.9886 12.2262 12.2401 12.2687 12.3110 12.5485 12.5863 15.3632 15.3830 k = 0.6212-0.2179-0.1496 ( 12593 PWs) bands (ev): -46.7047 -46.7047 -46.7041 -46.7041 -35.1714 -35.1713 -35.1712 -35.1712 -24.3848 -24.3740 -24.3736 -24.3623 -22.3792 -22.3770 -22.3741 -22.3655 -22.2847 -22.2685 -22.2672 -22.2547 -8.9166 -8.9031 -8.8943 -8.8898 -8.6056 -8.6009 -8.3833 -8.3566 -8.2623 -8.2573 -8.2147 -8.2122 3.0662 3.0692 3.3328 3.3427 3.4467 3.4507 3.7372 3.7505 3.9979 4.0054 4.1992 4.2098 4.6815 4.7045 4.7940 4.7976 5.1575 5.1693 5.2690 5.2709 5.6421 5.6499 6.0968 6.0974 6.5253 6.5260 6.8354 6.8355 6.8655 6.8848 6.9154 6.9220 7.0705 7.0918 7.2283 7.2313 11.2040 11.2253 11.4143 11.4255 11.9608 11.9796 12.2368 12.2548 12.2807 12.3229 12.5665 12.6060 15.3362 15.3550 k = 0.6323-0.2069-0.1420 ( 12597 PWs) bands (ev): -46.7047 -46.7047 -46.7041 -46.7041 -35.1714 -35.1714 -35.1712 -35.1712 -24.3852 -24.3744 -24.3734 -24.3621 -22.3818 -22.3794 -22.3757 -22.3668 -22.2827 -22.2670 -22.2641 -22.2523 -8.9309 -8.9174 -8.9081 -8.9044 -8.6155 -8.6109 -8.3732 -8.3464 -8.2491 -8.2448 -8.1945 -8.1921 3.0378 3.0413 3.3194 3.3292 3.4215 3.4252 3.7368 3.7470 4.0001 4.0042 4.2081 4.2179 4.6993 4.7208 4.8188 4.8235 5.1753 5.1871 5.2980 5.3003 5.6750 5.6812 6.1301 6.1328 6.4916 6.4938 6.8105 6.8110 6.8352 6.8548 6.8800 6.8870 7.0591 7.0815 7.2356 7.2380 11.2131 11.2327 11.4186 11.4275 11.9530 11.9719 12.2464 12.2697 12.2954 12.3359 12.5829 12.6240 15.3105 15.3283 k = 0.6433-0.1958-0.1344 ( 12592 PWs) bands (ev): -46.7048 -46.7048 -46.7040 -46.7040 -35.1714 -35.1714 -35.1712 -35.1712 -24.3857 -24.3753 -24.3728 -24.3619 -22.3844 -22.3820 -22.3772 -22.3681 -22.2807 -22.2655 -22.2609 -22.2500 -8.9455 -8.9318 -8.9213 -8.9185 -8.6255 -8.6210 -8.3623 -8.3355 -8.2359 -8.2323 -8.1752 -8.1727 3.0104 3.0141 3.3055 3.3151 3.3957 3.3992 3.7310 3.7381 4.0079 4.0087 4.2171 4.2259 4.7183 4.7381 4.8458 4.8511 5.1960 5.2078 5.3283 5.3310 5.7093 5.7139 6.1502 6.1566 6.4673 6.4717 6.7832 6.7843 6.8043 6.8245 6.8432 6.8500 7.0468 7.0701 7.2419 7.2438 11.2246 11.2425 11.4208 11.4274 11.9467 11.9656 12.2548 12.2843 12.3123 12.3499 12.5977 12.6402 15.2863 15.3031 k = 0.6543-0.1848-0.1268 ( 12582 PWs) bands (ev): -46.7048 -46.7048 -46.7039 -46.7039 -35.1714 -35.1714 -35.1712 -35.1712 -24.3861 -24.3761 -24.3722 -24.3617 -22.3870 -22.3846 -22.3786 -22.3693 -22.2787 -22.2641 -22.2578 -22.2477 -8.9602 -8.9464 -8.9337 -8.9319 -8.6356 -8.6312 -8.3507 -8.3240 -8.2227 -8.2197 -8.1570 -8.1543 2.9841 2.9881 3.2911 3.3006 3.3695 3.3726 3.7204 3.7246 4.0184 4.0202 4.2265 4.2340 4.7385 4.7564 4.8749 4.8804 5.2192 5.2309 5.3593 5.3622 5.7446 5.7476 6.1541 6.1639 6.4564 6.4630 6.7523 6.7540 6.7732 6.7946 6.8070 6.8131 7.0334 7.0577 7.2473 7.2488 11.2384 11.2544 11.4210 11.4254 11.9422 11.9607 12.2619 12.2978 12.3311 12.3650 12.6108 12.6546 15.2638 15.2797 k = 0.6653-0.1738-0.1193 ( 12578 PWs) bands (ev): -46.7049 -46.7049 -46.7039 -46.7039 -35.1714 -35.1714 -35.1712 -35.1712 -24.3866 -24.3770 -24.3716 -24.3614 -22.3895 -22.3873 -22.3797 -22.3705 -22.2768 -22.2628 -22.2546 -22.2454 -8.9750 -8.9610 -8.9453 -8.9445 -8.6458 -8.6416 -8.3386 -8.3120 -8.2095 -8.2070 -8.1399 -8.1369 2.9592 2.9633 3.2764 3.2858 3.3430 3.3459 3.7058 3.7077 4.0325 4.0361 4.2363 4.2425 4.7599 4.7757 4.9061 4.9113 5.2447 5.2561 5.3900 5.3930 5.7804 5.7821 6.1419 6.1541 6.4595 6.4675 6.7160 6.7184 6.7426 6.7658 6.7740 6.7787 7.0190 7.0442 7.2517 7.2528 11.2542 11.2685 11.4194 11.4215 11.9393 11.9574 12.2675 12.3094 12.3512 12.3813 12.6224 12.6672 15.2434 15.2585 k = 0.6763-0.1627-0.1117 ( 12575 PWs) bands (ev): -46.7050 -46.7049 -46.7038 -46.7038 -35.1714 -35.1714 -35.1712 -35.1712 -24.3870 -24.3780 -24.3709 -24.3612 -22.3921 -22.3899 -22.3807 -22.3716 -22.2750 -22.2615 -22.2516 -22.2431 -8.9899 -8.9758 -8.9560 -8.9558 -8.6560 -8.6520 -8.3261 -8.2997 -8.1965 -8.1943 -8.1242 -8.1207 2.9360 2.9400 3.2614 3.2707 3.3164 3.3190 3.6883 3.6885 4.0498 4.0547 4.2468 4.2514 4.7824 4.7960 4.9392 4.9436 5.2721 5.2829 5.4194 5.4225 5.8163 5.8167 6.1182 6.1317 6.4714 6.4799 6.6738 6.6767 6.7145 6.7391 6.7452 6.7489 7.0037 7.0296 7.2551 7.2559 11.2718 11.2843 11.4160 11.4162 11.9380 11.9555 12.2713 12.3184 12.3721 12.3988 12.6327 12.6783 15.2253 15.2398 k = 0.6874-0.1517-0.1041 ( 12582 PWs) bands (ev): -46.7050 -46.7050 -46.7037 -46.7037 -35.1714 -35.1714 -35.1712 -35.1712 -24.3875 -24.3789 -24.3702 -24.3610 -22.3946 -22.3926 -22.3814 -22.3726 -22.2733 -22.2604 -22.2486 -22.2409 -9.0048 -8.9907 -8.9664 -8.9652 -8.6662 -8.6625 -8.3133 -8.2870 -8.1834 -8.1817 -8.1098 -8.1059 2.9148 2.9186 3.2462 3.2555 3.2900 3.2923 3.6678 3.6690 4.0695 4.0750 4.2579 4.2610 4.8059 4.8172 4.9738 4.9768 5.3012 5.3111 5.4463 5.4494 5.8510 5.8521 6.0889 6.1030 6.4844 6.4927 6.6272 6.6303 6.6915 6.7170 6.7199 6.7233 6.9873 7.0141 7.2575 7.2580 11.2906 11.3015 11.4093 11.4121 11.9382 11.9552 12.2733 12.3244 12.3935 12.4172 12.6419 12.6879 15.2098 15.2236 k = 0.6984-0.1406-0.0965 ( 12579 PWs) bands (ev): -46.7051 -46.7051 -46.7037 -46.7037 -35.1714 -35.1714 -35.1711 -35.1711 -24.3880 -24.3799 -24.3695 -24.3608 -22.3971 -22.3952 -22.3820 -22.3735 -22.2717 -22.2595 -22.2456 -22.2387 -9.0197 -9.0056 -8.9754 -8.9732 -8.6764 -8.6729 -8.3002 -8.2742 -8.1705 -8.1691 -8.0970 -8.0925 2.8958 2.8992 3.2306 3.2400 3.2641 3.2659 3.6462 3.6484 4.0909 4.0967 4.2700 4.2716 4.8300 4.8391 5.0094 5.0105 5.3318 5.3403 5.4692 5.4723 5.8845 5.8872 6.0593 6.0735 6.4914 6.4986 6.5784 6.5812 6.6768 6.6977 6.6988 6.7046 6.9700 6.9975 7.2590 7.2592 11.3095 11.3194 11.4022 11.4079 11.9398 11.9562 12.2733 12.3273 12.4149 12.4360 12.6504 12.6963 15.1968 15.2103 k = 0.7094-0.1296-0.0890 ( 12576 PWs) bands (ev): -46.7052 -46.7052 -46.7036 -46.7036 -35.1714 -35.1714 -35.1711 -35.1711 -24.3885 -24.3809 -24.3687 -24.3605 -22.3996 -22.3978 -22.3824 -22.3742 -22.2703 -22.2587 -22.2428 -22.2365 -9.0346 -9.0205 -8.9831 -8.9799 -8.6866 -8.6834 -8.2870 -8.2612 -8.1578 -8.1566 -8.0856 -8.0805 2.8791 2.8822 3.2144 3.2240 3.2390 3.2403 3.6242 3.6272 4.1135 4.1193 4.2830 4.2832 4.8544 4.8613 5.0442 5.0455 5.3636 5.3705 5.4867 5.4898 5.9163 5.9210 6.0333 6.0473 6.4869 6.4917 6.5296 6.5318 6.6680 6.6784 6.6839 6.7011 6.9517 6.9799 7.2596 7.2596 11.3266 11.3362 11.3962 11.4056 11.9426 11.9584 12.2711 12.3270 12.4359 12.4548 12.6586 12.7037 15.1866 15.1998 k = 0.7204-0.1186-0.0814 ( 12570 PWs) bands (ev): -46.7053 -46.7053 -46.7035 -46.7035 -35.1715 -35.1715 -35.1711 -35.1711 -24.3889 -24.3819 -24.3679 -24.3602 -22.4020 -22.4003 -22.3826 -22.3748 -22.2690 -22.2581 -22.2400 -22.2344 -9.0494 -9.0355 -8.9893 -8.9852 -8.6968 -8.6938 -8.2737 -8.2482 -8.1454 -8.1444 -8.0758 -8.0701 2.8651 2.8676 3.1967 3.2060 3.2159 3.2173 3.6021 3.6056 4.1370 4.1425 4.2960 4.2972 4.8785 4.8832 5.0771 5.0813 5.3966 5.4013 5.4974 5.5007 5.9452 5.9527 6.0145 6.0276 6.4652 6.4684 6.4861 6.4886 6.6525 6.6596 6.6897 6.7080 6.9325 6.9613 7.2591 7.2593 11.3379 11.3471 11.3961 11.4089 11.9464 11.9618 12.2667 12.3234 12.4562 12.4731 12.6667 12.7106 15.1791 15.1922 k = 0.7314-0.1075-0.0738 ( 12577 PWs) bands (ev): -46.7053 -46.7053 -46.7034 -46.7034 -35.1715 -35.1715 -35.1711 -35.1711 -24.3895 -24.3830 -24.3671 -24.3599 -22.4043 -22.4027 -22.3827 -22.3753 -22.2679 -22.2578 -22.2373 -22.2323 -9.0641 -9.0504 -8.9941 -8.9891 -8.7069 -8.7042 -8.2604 -8.2351 -8.1333 -8.1326 -8.0674 -8.0611 2.8538 2.8557 3.1764 3.1836 3.1961 3.1991 3.5802 3.5841 4.1609 4.1660 4.3100 4.3124 4.9014 4.9041 5.1086 5.1160 5.4302 5.4328 5.5008 5.5045 5.9681 5.9804 6.0066 6.0170 6.4236 6.4275 6.4550 6.4592 6.6361 6.6429 6.7045 6.7215 6.9125 6.9417 7.2578 7.2582 11.3400 11.3467 11.4072 11.4212 11.9511 11.9659 12.2601 12.3166 12.4756 12.4906 12.6751 12.7171 15.1742 15.1873 k = 0.7425-0.0965-0.0662 ( 12578 PWs) bands (ev): -46.7055 -46.7055 -46.7033 -46.7033 -35.1715 -35.1715 -35.1711 -35.1711 -24.3900 -24.3840 -24.3662 -24.3596 -22.4066 -22.4051 -22.3825 -22.3756 -22.2670 -22.2577 -22.2347 -22.2302 -9.0787 -9.0652 -8.9973 -8.9914 -8.7169 -8.7144 -8.2472 -8.2222 -8.1217 -8.1214 -8.0603 -8.0535 2.8454 2.8466 3.1538 3.1595 3.1792 3.1835 3.5586 3.5628 4.1851 4.1896 4.3251 4.3287 4.9221 4.9231 5.1380 5.1490 5.4624 5.4642 5.4979 5.5037 5.9810 5.9998 6.0126 6.0190 6.3798 6.3861 6.4250 6.4314 6.6215 6.6286 6.7222 6.7376 6.8919 6.9212 7.2557 7.2563 11.3346 11.3383 11.4260 11.4406 11.9565 11.9708 12.2513 12.3067 12.4938 12.5069 12.6841 12.7236 15.1716 15.1848 k = 0.7535-0.0855-0.0586 ( 12576 PWs) bands (ev): -46.7055 -46.7055 -46.7032 -46.7032 -35.1715 -35.1715 -35.1711 -35.1711 -24.3905 -24.3852 -24.3652 -24.3592 -22.4087 -22.4075 -22.3821 -22.3757 -22.2663 -22.2578 -22.2321 -22.2283 -9.0932 -9.0799 -8.9990 -8.9921 -8.7268 -8.7246 -8.2340 -8.2093 -8.1110 -8.1110 -8.0544 -8.0470 2.8401 2.8406 3.1306 3.1355 3.1639 3.1688 3.5375 3.5420 4.2092 4.2130 4.3414 4.3460 4.9388 4.9393 5.1646 5.1791 5.4798 5.4838 5.5026 5.5139 5.9888 6.0105 6.0246 6.0305 6.3419 6.3514 6.3943 6.4028 6.6096 6.6171 6.7400 6.7538 6.8709 6.8997 7.2530 7.2538 11.3250 11.3266 11.4476 11.4634 11.9624 11.9762 12.2404 12.2940 12.5107 12.5218 12.6937 12.7303 15.1710 15.1843 k = 0.7645-0.0744-0.0511 ( 12584 PWs) bands (ev): -46.7057 -46.7057 -46.7031 -46.7031 -35.1715 -35.1715 -35.1710 -35.1710 -24.3911 -24.3863 -24.3642 -24.3588 -22.4108 -22.4097 -22.3815 -22.3756 -22.2658 -22.2582 -22.2297 -22.2263 -9.1075 -9.0944 -8.9991 -8.9912 -8.7366 -8.7346 -8.2210 -8.1965 -8.1021 -8.1014 -8.0490 -8.0414 2.8376 2.8380 3.1076 3.1119 3.1495 3.1546 3.5170 3.5216 4.2328 4.2359 4.3588 4.3643 4.9501 4.9515 5.1877 5.2055 5.4751 5.4760 5.5332 5.5451 5.9956 6.0219 6.0341 6.0373 6.3144 6.3270 6.3640 6.3747 6.6006 6.6084 6.7563 6.7674 6.8507 6.8776 7.2496 7.2506 11.3132 11.3132 11.4701 11.4875 11.9685 11.9818 12.2277 12.2788 12.5261 12.5352 12.7041 12.7373 15.1719 15.1852 Writing output data file LiNbO3.save init_run : 3.54s CPU 12.34s WALL ( 1 calls) electrons : 2975.47s CPU 3004.52s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.21s CPU 1.25s WALL ( 1 calls) Called by electrons: c_bands : 2975.31s CPU 3004.29s WALL ( 1 calls) v_of_rho : 0.07s CPU 0.81s WALL ( 1 calls) v_h : 0.03s CPU 0.04s WALL ( 1 calls) v_xc : 0.04s CPU 0.65s WALL ( 1 calls) newd : 0.55s CPU 0.75s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.22s CPU 0.34s WALL ( 273 calls) cegterg : 2822.16s CPU 2846.58s WALL ( 1126 calls) Called by sum_band: Called by *egterg: h_psi : 1230.03s CPU 1245.92s WALL ( 22487 calls) s_psi : 100.80s CPU 101.04s WALL ( 22487 calls) g_psi : 3.51s CPU 3.53s WALL ( 21088 calls) cdiaghg : 1019.86s CPU 1016.94s WALL ( 21361 calls) cegterg:over : 244.13s CPU 237.91s WALL ( 21088 calls) cegterg:upda : 115.53s CPU 121.17s WALL ( 21088 calls) cegterg:last : 78.92s CPU 79.71s WALL ( 2465 calls) Called by h_psi: h_psi:vloc : 1000.13s CPU 1012.61s WALL ( 22487 calls) h_psi:vnl : 225.90s CPU 228.42s WALL ( 22487 calls) add_vuspsi : 82.53s CPU 91.35s WALL ( 22487 calls) General routines calbec : 143.29s CPU 136.91s WALL ( 22487 calls) fft : 0.39s CPU 1.28s WALL ( 15 calls) fftw : 936.27s CPU 945.38s WALL ( 2215608 calls) davcio : 0.05s CPU 6.64s WALL ( 546 calls) Parallel routines fft_scatter : 429.53s CPU 431.41s WALL ( 2215623 calls) PWSCF : 51m42.80s CPU 56m56.06s WALL This run was terminated on: 3: 8:35 2Dec2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=