Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18: 5:21 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./SF6.save/ file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 59 37 10 1736 857 134 Max 60 38 11 1738 880 138 Sum 2129 1347 395 62543 31317 4921 bravais-lattice index = 14 lattice parameter (alat) = 9.4840 a.u. unit-cell volume = 656.6732 (a.u.)^3 number of atoms/cell = 7 number of atomic types = 2 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 317.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.483975 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.333333 celldm(5)= -0.333333 celldm(6)= -0.333333 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.333333 0.942809 0.000000 ) a(3) = ( -0.333333 -0.471405 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.353553 0.612372 ) b(2) = ( 0.000000 1.060660 0.612372 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 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 S 6.00 32.06500 S( 1.00) F 7.00 18.99840 F( 1.00) 4 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 261 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 2) = ( 0.0090909 -0.0064282 0.0111340), wk = 0.0038314 k( 3) = ( 0.0181818 -0.0128565 0.0222681), wk = 0.0038314 k( 4) = ( 0.0272727 -0.0192847 0.0334021), wk = 0.0038314 k( 5) = ( 0.0363636 -0.0257130 0.0445362), wk = 0.0038314 k( 6) = ( 0.0454546 -0.0321412 0.0556702), wk = 0.0038314 k( 7) = ( 0.0545455 -0.0385695 0.0668043), wk = 0.0038314 k( 8) = ( 0.0636364 -0.0449977 0.0779383), wk = 0.0038314 k( 9) = ( 0.0727273 -0.0514259 0.0890724), wk = 0.0038314 k( 10) = ( 0.0818182 -0.0578542 0.1002064), wk = 0.0038314 k( 11) = ( 0.0909091 -0.0642824 0.1113404), wk = 0.0038314 k( 12) = ( 0.1000000 -0.0707107 0.1224745), wk = 0.0038314 k( 13) = ( 0.1090909 -0.0771389 0.1336085), wk = 0.0038314 k( 14) = ( 0.1181818 -0.0835672 0.1447426), wk = 0.0038314 k( 15) = ( 0.1272727 -0.0899954 0.1558766), wk = 0.0038314 k( 16) = ( 0.1363636 -0.0964237 0.1670107), wk = 0.0038314 k( 17) = ( 0.1454545 -0.1028519 0.1781447), wk = 0.0038314 k( 18) = ( 0.1545455 -0.1092801 0.1892787), wk = 0.0038314 k( 19) = ( 0.1636364 -0.1157084 0.2004128), wk = 0.0038314 k( 20) = ( 0.1727273 -0.1221366 0.2115468), wk = 0.0038314 k( 21) = ( 0.1818182 -0.1285649 0.2226809), wk = 0.0038314 k( 22) = ( 0.1909091 -0.1349931 0.2338149), wk = 0.0038314 k( 23) = ( 0.2000000 -0.1414214 0.2449490), wk = 0.0038314 k( 24) = ( 0.2090909 -0.1478496 0.2560830), wk = 0.0038314 k( 25) = ( 0.2181818 -0.1542778 0.2672171), wk = 0.0038314 k( 26) = ( 0.2272727 -0.1607061 0.2783511), wk = 0.0038314 k( 27) = ( 0.2363636 -0.1671343 0.2894852), wk = 0.0038314 k( 28) = ( 0.2454545 -0.1735626 0.3006192), wk = 0.0038314 k( 29) = ( 0.2545455 -0.1799908 0.3117532), wk = 0.0038314 k( 30) = ( 0.2636364 -0.1864191 0.3228873), wk = 0.0038314 k( 31) = ( 0.2727273 -0.1928473 0.3340213), wk = 0.0038314 k( 32) = ( 0.2818182 -0.1992755 0.3451554), wk = 0.0038314 k( 33) = ( 0.2909091 -0.2057038 0.3562894), wk = 0.0038314 k( 34) = ( 0.3000000 -0.2121320 0.3674235), wk = 0.0038314 k( 35) = ( 0.3090909 -0.2185603 0.3785575), wk = 0.0038314 k( 36) = ( 0.3181818 -0.2249885 0.3896916), wk = 0.0038314 k( 37) = ( 0.3272727 -0.2314168 0.4008256), wk = 0.0038314 k( 38) = ( 0.3363636 -0.2378450 0.4119596), wk = 0.0038314 k( 39) = ( 0.3454546 -0.2442733 0.4230937), wk = 0.0038314 k( 40) = ( 0.3545454 -0.2507015 0.4342277), wk = 0.0038314 k( 41) = ( 0.3636364 -0.2571297 0.4453618), wk = 0.0038314 k( 42) = ( 0.3727273 -0.2635580 0.4564958), wk = 0.0038314 k( 43) = ( 0.3818182 -0.2699862 0.4676299), wk = 0.0038314 k( 44) = ( 0.3909091 -0.2764145 0.4787639), wk = 0.0038314 k( 45) = ( 0.4000000 -0.2828427 0.4898979), wk = 0.0038314 k( 46) = ( 0.4090909 -0.2892710 0.5010320), wk = 0.0038314 k( 47) = ( 0.4181818 -0.2956992 0.5121660), wk = 0.0038314 k( 48) = ( 0.4272727 -0.3021274 0.5233001), wk = 0.0038314 k( 49) = ( 0.4363636 -0.3085557 0.5344341), wk = 0.0038314 k( 50) = ( 0.4454546 -0.3149839 0.5455682), wk = 0.0038314 k( 51) = ( 0.4545455 -0.3214122 0.5567022), wk = 0.0038314 k( 52) = ( 0.4636364 -0.3278404 0.5678363), wk = 0.0038314 k( 53) = ( 0.4727273 -0.3342687 0.5789703), wk = 0.0038314 k( 54) = ( 0.4818182 -0.3406969 0.5901043), wk = 0.0038314 k( 55) = ( 0.4909091 -0.3471251 0.6012384), wk = 0.0038314 k( 56) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0038314 k( 57) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0038314 k( 58) = ( 0.4871795 -0.3444879 0.6123724), wk = 0.0038314 k( 59) = ( 0.4743590 -0.3354224 0.6123724), wk = 0.0038314 k( 60) = ( 0.4615385 -0.3263570 0.6123724), wk = 0.0038314 k( 61) = ( 0.4487179 -0.3172915 0.6123724), wk = 0.0038314 k( 62) = ( 0.4358974 -0.3082260 0.6123724), wk = 0.0038314 k( 63) = ( 0.4230769 -0.2991606 0.6123724), wk = 0.0038314 k( 64) = ( 0.4102564 -0.2900951 0.6123724), wk = 0.0038314 k( 65) = ( 0.3974359 -0.2810296 0.6123724), wk = 0.0038314 k( 66) = ( 0.3846154 -0.2719641 0.6123724), wk = 0.0038314 k( 67) = ( 0.3717949 -0.2628987 0.6123724), wk = 0.0038314 k( 68) = ( 0.3589744 -0.2538332 0.6123724), wk = 0.0038314 k( 69) = ( 0.3461538 -0.2447677 0.6123724), wk = 0.0038314 k( 70) = ( 0.3333333 -0.2357023 0.6123724), wk = 0.0038314 k( 71) = ( 0.3205128 -0.2266368 0.6123724), wk = 0.0038314 k( 72) = ( 0.3076923 -0.2175713 0.6123724), wk = 0.0038314 k( 73) = ( 0.2948718 -0.2085058 0.6123724), wk = 0.0038314 k( 74) = ( 0.2820513 -0.1994404 0.6123724), wk = 0.0038314 k( 75) = ( 0.2692308 -0.1903749 0.6123724), wk = 0.0038314 k( 76) = ( 0.2564103 -0.1813094 0.6123724), wk = 0.0038314 k( 77) = ( 0.2435897 -0.1722440 0.6123724), wk = 0.0038314 k( 78) = ( 0.2307692 -0.1631785 0.6123724), wk = 0.0038314 k( 79) = ( 0.2179487 -0.1541130 0.6123724), wk = 0.0038314 k( 80) = ( 0.2051282 -0.1450475 0.6123724), wk = 0.0038314 k( 81) = ( 0.1923077 -0.1359821 0.6123724), wk = 0.0038314 k( 82) = ( 0.1794872 -0.1269166 0.6123724), wk = 0.0038314 k( 83) = ( 0.1666667 -0.1178511 0.6123724), wk = 0.0038314 k( 84) = ( 0.1538461 -0.1087857 0.6123724), wk = 0.0038314 k( 85) = ( 0.1410256 -0.0997202 0.6123724), wk = 0.0038314 k( 86) = ( 0.1282051 -0.0906547 0.6123724), wk = 0.0038314 k( 87) = ( 0.1153846 -0.0815892 0.6123724), wk = 0.0038314 k( 88) = ( 0.1025641 -0.0725238 0.6123724), wk = 0.0038314 k( 89) = ( 0.0897436 -0.0634583 0.6123724), wk = 0.0038314 k( 90) = ( 0.0769231 -0.0543928 0.6123724), wk = 0.0038314 k( 91) = ( 0.0641026 -0.0453274 0.6123724), wk = 0.0038314 k( 92) = ( 0.0512821 -0.0362619 0.6123724), wk = 0.0038314 k( 93) = ( 0.0384615 -0.0271964 0.6123724), wk = 0.0038314 k( 94) = ( 0.0256410 -0.0181309 0.6123724), wk = 0.0038314 k( 95) = ( 0.0128205 -0.0090655 0.6123724), wk = 0.0038314 k( 96) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0038314 k( 97) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0038314 k( 98) = ( 0.0000000 0.0000000 0.5966706), wk = 0.0038314 k( 99) = ( 0.0000000 0.0000000 0.5809687), wk = 0.0038314 k( 100) = ( 0.0000000 0.0000000 0.5652669), wk = 0.0038314 k( 101) = ( 0.0000000 0.0000000 0.5495650), wk = 0.0038314 k( 102) = ( 0.0000000 0.0000000 0.5338632), wk = 0.0038314 k( 103) = ( 0.0000000 0.0000000 0.5181613), wk = 0.0038314 k( 104) = ( 0.0000000 0.0000000 0.5024594), wk = 0.0038314 k( 105) = ( 0.0000000 0.0000000 0.4867576), wk = 0.0038314 k( 106) = ( 0.0000000 0.0000000 0.4710557), wk = 0.0038314 k( 107) = ( 0.0000000 0.0000000 0.4553539), wk = 0.0038314 k( 108) = ( 0.0000000 0.0000000 0.4396520), wk = 0.0038314 k( 109) = ( 0.0000000 0.0000000 0.4239502), wk = 0.0038314 k( 110) = ( 0.0000000 0.0000000 0.4082483), wk = 0.0038314 k( 111) = ( 0.0000000 0.0000000 0.3925464), wk = 0.0038314 k( 112) = ( 0.0000000 0.0000000 0.3768446), wk = 0.0038314 k( 113) = ( 0.0000000 0.0000000 0.3611427), wk = 0.0038314 k( 114) = ( 0.0000000 0.0000000 0.3454409), wk = 0.0038314 k( 115) = ( 0.0000000 0.0000000 0.3297390), wk = 0.0038314 k( 116) = ( 0.0000000 0.0000000 0.3140372), wk = 0.0038314 k( 117) = ( 0.0000000 0.0000000 0.2983353), wk = 0.0038314 k( 118) = ( 0.0000000 0.0000000 0.2826334), wk = 0.0038314 k( 119) = ( 0.0000000 0.0000000 0.2669316), wk = 0.0038314 k( 120) = ( 0.0000000 0.0000000 0.2512297), wk = 0.0038314 k( 121) = ( 0.0000000 0.0000000 0.2355279), wk = 0.0038314 k( 122) = ( 0.0000000 0.0000000 0.2198260), wk = 0.0038314 k( 123) = ( 0.0000000 0.0000000 0.2041241), wk = 0.0038314 k( 124) = ( 0.0000000 0.0000000 0.1884223), wk = 0.0038314 k( 125) = ( 0.0000000 0.0000000 0.1727204), wk = 0.0038314 k( 126) = ( 0.0000000 0.0000000 0.1570186), wk = 0.0038314 k( 127) = ( 0.0000000 0.0000000 0.1413167), wk = 0.0038314 k( 128) = ( 0.0000000 0.0000000 0.1256149), wk = 0.0038314 k( 129) = ( 0.0000000 0.0000000 0.1099130), wk = 0.0038314 k( 130) = ( 0.0000000 0.0000000 0.0942111), wk = 0.0038314 k( 131) = ( 0.0000000 0.0000000 0.0785093), wk = 0.0038314 k( 132) = ( 0.0000000 0.0000000 0.0628074), wk = 0.0038314 k( 133) = ( 0.0000000 0.0000000 0.0471056), wk = 0.0038314 k( 134) = ( 0.0000000 0.0000000 0.0314037), wk = 0.0038314 k( 135) = ( 0.0000000 0.0000000 0.0157019), wk = 0.0038314 k( 136) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 137) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 138) = ( 0.0053191 0.0075224 0.0130292), wk = 0.0038314 k( 139) = ( 0.0106383 0.0150448 0.0260584), wk = 0.0038314 k( 140) = ( 0.0159575 0.0225672 0.0390876), wk = 0.0038314 k( 141) = ( 0.0212766 0.0300897 0.0521168), wk = 0.0038314 k( 142) = ( 0.0265957 0.0376121 0.0651460), wk = 0.0038314 k( 143) = ( 0.0319149 0.0451345 0.0781752), wk = 0.0038314 k( 144) = ( 0.0372340 0.0526569 0.0912044), wk = 0.0038314 k( 145) = ( 0.0425532 0.0601793 0.1042336), wk = 0.0038314 k( 146) = ( 0.0478723 0.0677017 0.1172628), wk = 0.0038314 k( 147) = ( 0.0531915 0.0752241 0.1302920), wk = 0.0038314 k( 148) = ( 0.0585106 0.0827465 0.1433212), wk = 0.0038314 k( 149) = ( 0.0638298 0.0902690 0.1563504), wk = 0.0038314 k( 150) = ( 0.0691489 0.0977914 0.1693796), wk = 0.0038314 k( 151) = ( 0.0744681 0.1053138 0.1824088), wk = 0.0038314 k( 152) = ( 0.0797872 0.1128362 0.1954380), wk = 0.0038314 k( 153) = ( 0.0851064 0.1203586 0.2084672), wk = 0.0038314 k( 154) = ( 0.0904255 0.1278810 0.2214964), wk = 0.0038314 k( 155) = ( 0.0957447 0.1354034 0.2345256), wk = 0.0038314 k( 156) = ( 0.1010638 0.1429258 0.2475548), wk = 0.0038314 k( 157) = ( 0.1063830 0.1504483 0.2605840), wk = 0.0038314 k( 158) = ( 0.1117021 0.1579707 0.2736132), wk = 0.0038314 k( 159) = ( 0.1170213 0.1654931 0.2866424), wk = 0.0038314 k( 160) = ( 0.1223404 0.1730155 0.2996716), wk = 0.0038314 k( 161) = ( 0.1276596 0.1805379 0.3127008), wk = 0.0038314 k( 162) = ( 0.1329787 0.1880603 0.3257300), wk = 0.0038314 k( 163) = ( 0.1382979 0.1955827 0.3387592), wk = 0.0038314 k( 164) = ( 0.1436170 0.2031051 0.3517884), wk = 0.0038314 k( 165) = ( 0.1489362 0.2106276 0.3648176), wk = 0.0038314 k( 166) = ( 0.1542553 0.2181500 0.3778468), wk = 0.0038314 k( 167) = ( 0.1595745 0.2256724 0.3908760), wk = 0.0038314 k( 168) = ( 0.1648936 0.2331948 0.4039052), wk = 0.0038314 k( 169) = ( 0.1702128 0.2407172 0.4169344), wk = 0.0038314 k( 170) = ( 0.1755319 0.2482396 0.4299636), wk = 0.0038314 k( 171) = ( 0.1808511 0.2557620 0.4429928), wk = 0.0038314 k( 172) = ( 0.1861702 0.2632844 0.4560220), wk = 0.0038314 k( 173) = ( 0.1914894 0.2708068 0.4690512), wk = 0.0038314 k( 174) = ( 0.1968085 0.2783293 0.4820804), wk = 0.0038314 k( 175) = ( 0.2021277 0.2858517 0.4951096), wk = 0.0038314 k( 176) = ( 0.2074468 0.2933741 0.5081388), wk = 0.0038314 k( 177) = ( 0.2127660 0.3008965 0.5211680), wk = 0.0038314 k( 178) = ( 0.2180851 0.3084189 0.5341972), wk = 0.0038314 k( 179) = ( 0.2234043 0.3159413 0.5472264), wk = 0.0038314 k( 180) = ( 0.2287234 0.3234637 0.5602556), wk = 0.0038314 k( 181) = ( 0.2340425 0.3309861 0.5732848), wk = 0.0038314 k( 182) = ( 0.2393617 0.3385086 0.5863140), wk = 0.0038314 k( 183) = ( 0.2446809 0.3460310 0.5993432), wk = 0.0038314 k( 184) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0038314 k( 185) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0038314 k( 186) = ( 0.2553191 0.3385086 0.6123724), wk = 0.0038314 k( 187) = ( 0.2606383 0.3234637 0.6123724), wk = 0.0038314 k( 188) = ( 0.2659574 0.3084189 0.6123724), wk = 0.0038314 k( 189) = ( 0.2712766 0.2933741 0.6123724), wk = 0.0038314 k( 190) = ( 0.2765957 0.2783293 0.6123724), wk = 0.0038314 k( 191) = ( 0.2819149 0.2632844 0.6123724), wk = 0.0038314 k( 192) = ( 0.2872340 0.2482396 0.6123724), wk = 0.0038314 k( 193) = ( 0.2925532 0.2331948 0.6123724), wk = 0.0038314 k( 194) = ( 0.2978723 0.2181500 0.6123724), wk = 0.0038314 k( 195) = ( 0.3031915 0.2031051 0.6123724), wk = 0.0038314 k( 196) = ( 0.3085106 0.1880603 0.6123724), wk = 0.0038314 k( 197) = ( 0.3138298 0.1730155 0.6123724), wk = 0.0038314 k( 198) = ( 0.3191489 0.1579707 0.6123724), wk = 0.0038314 k( 199) = ( 0.3244681 0.1429258 0.6123724), wk = 0.0038314 k( 200) = ( 0.3297872 0.1278810 0.6123724), wk = 0.0038314 k( 201) = ( 0.3351064 0.1128362 0.6123724), wk = 0.0038314 k( 202) = ( 0.3404255 0.0977914 0.6123724), wk = 0.0038314 k( 203) = ( 0.3457447 0.0827465 0.6123724), wk = 0.0038314 k( 204) = ( 0.3510638 0.0677017 0.6123724), wk = 0.0038314 k( 205) = ( 0.3563830 0.0526569 0.6123724), wk = 0.0038314 k( 206) = ( 0.3617021 0.0376121 0.6123724), wk = 0.0038314 k( 207) = ( 0.3670213 0.0225672 0.6123724), wk = 0.0038314 k( 208) = ( 0.3723404 0.0075224 0.6123724), wk = 0.0038314 k( 209) = ( 0.3776596 -0.0075224 0.6123724), wk = 0.0038314 k( 210) = ( 0.3829787 -0.0225672 0.6123724), wk = 0.0038314 k( 211) = ( 0.3882979 -0.0376121 0.6123724), wk = 0.0038314 k( 212) = ( 0.3936170 -0.0526569 0.6123724), wk = 0.0038314 k( 213) = ( 0.3989362 -0.0677017 0.6123724), wk = 0.0038314 k( 214) = ( 0.4042553 -0.0827465 0.6123724), wk = 0.0038314 k( 215) = ( 0.4095745 -0.0977914 0.6123724), wk = 0.0038314 k( 216) = ( 0.4148936 -0.1128362 0.6123724), wk = 0.0038314 k( 217) = ( 0.4202128 -0.1278810 0.6123724), wk = 0.0038314 k( 218) = ( 0.4255319 -0.1429258 0.6123724), wk = 0.0038314 k( 219) = ( 0.4308511 -0.1579707 0.6123724), wk = 0.0038314 k( 220) = ( 0.4361702 -0.1730155 0.6123724), wk = 0.0038314 k( 221) = ( 0.4414894 -0.1880603 0.6123724), wk = 0.0038314 k( 222) = ( 0.4468085 -0.2031051 0.6123724), wk = 0.0038314 k( 223) = ( 0.4521277 -0.2181500 0.6123724), wk = 0.0038314 k( 224) = ( 0.4574468 -0.2331948 0.6123724), wk = 0.0038314 k( 225) = ( 0.4627660 -0.2482396 0.6123724), wk = 0.0038314 k( 226) = ( 0.4680851 -0.2632844 0.6123724), wk = 0.0038314 k( 227) = ( 0.4734043 -0.2783293 0.6123724), wk = 0.0038314 k( 228) = ( 0.4787234 -0.2933741 0.6123724), wk = 0.0038314 k( 229) = ( 0.4840426 -0.3084189 0.6123724), wk = 0.0038314 k( 230) = ( 0.4893617 -0.3234637 0.6123724), wk = 0.0038314 k( 231) = ( 0.4946809 -0.3385086 0.6123724), wk = 0.0038314 k( 232) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0038314 k( 233) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0038314 k( 234) = ( 0.2410714 0.3409265 0.6123724), wk = 0.0038314 k( 235) = ( 0.2321429 0.3282996 0.6123724), wk = 0.0038314 k( 236) = ( 0.2232143 0.3156727 0.6123724), wk = 0.0038314 k( 237) = ( 0.2142857 0.3030458 0.6123724), wk = 0.0038314 k( 238) = ( 0.2053571 0.2904189 0.6123724), wk = 0.0038314 k( 239) = ( 0.1964286 0.2777919 0.6123724), wk = 0.0038314 k( 240) = ( 0.1875000 0.2651650 0.6123724), wk = 0.0038314 k( 241) = ( 0.1785714 0.2525381 0.6123724), wk = 0.0038314 k( 242) = ( 0.1696429 0.2399112 0.6123724), wk = 0.0038314 k( 243) = ( 0.1607143 0.2272843 0.6123724), wk = 0.0038314 k( 244) = ( 0.1517857 0.2146574 0.6123724), wk = 0.0038314 k( 245) = ( 0.1428571 0.2020305 0.6123724), wk = 0.0038314 k( 246) = ( 0.1339286 0.1894036 0.6123724), wk = 0.0038314 k( 247) = ( 0.1250000 0.1767767 0.6123724), wk = 0.0038314 k( 248) = ( 0.1160714 0.1641498 0.6123724), wk = 0.0038314 k( 249) = ( 0.1071429 0.1515229 0.6123724), wk = 0.0038314 k( 250) = ( 0.0982143 0.1388960 0.6123724), wk = 0.0038314 k( 251) = ( 0.0892857 0.1262691 0.6123724), wk = 0.0038314 k( 252) = ( 0.0803571 0.1136422 0.6123724), wk = 0.0038314 k( 253) = ( 0.0714286 0.1010153 0.6123724), wk = 0.0038314 k( 254) = ( 0.0625000 0.0883883 0.6123724), wk = 0.0038314 k( 255) = ( 0.0535714 0.0757614 0.6123724), wk = 0.0038314 k( 256) = ( 0.0446429 0.0631345 0.6123724), wk = 0.0038314 k( 257) = ( 0.0357143 0.0505076 0.6123724), wk = 0.0038314 k( 258) = ( 0.0267857 0.0378807 0.6123724), wk = 0.0038314 k( 259) = ( 0.0178571 0.0252538 0.6123724), wk = 0.0038314 k( 260) = ( 0.0089286 0.0126269 0.6123724), wk = 0.0038314 k( 261) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0038314 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 2) = ( 0.0090909 -0.0090909 0.0090909), wk = 0.0038314 k( 3) = ( 0.0181818 -0.0181818 0.0181818), wk = 0.0038314 k( 4) = ( 0.0272727 -0.0272727 0.0272727), wk = 0.0038314 k( 5) = ( 0.0363636 -0.0363636 0.0363636), wk = 0.0038314 k( 6) = ( 0.0454546 -0.0454545 0.0454545), wk = 0.0038314 k( 7) = ( 0.0545455 -0.0545454 0.0545454), wk = 0.0038314 k( 8) = ( 0.0636364 -0.0636364 0.0636364), wk = 0.0038314 k( 9) = ( 0.0727273 -0.0727273 0.0727273), wk = 0.0038314 k( 10) = ( 0.0818182 -0.0818182 0.0818182), wk = 0.0038314 k( 11) = ( 0.0909091 -0.0909091 0.0909091), wk = 0.0038314 k( 12) = ( 0.1000000 -0.1000000 0.1000000), wk = 0.0038314 k( 13) = ( 0.1090909 -0.1090909 0.1090909), wk = 0.0038314 k( 14) = ( 0.1181818 -0.1181818 0.1181818), wk = 0.0038314 k( 15) = ( 0.1272727 -0.1272727 0.1272727), wk = 0.0038314 k( 16) = ( 0.1363636 -0.1363636 0.1363636), wk = 0.0038314 k( 17) = ( 0.1454545 -0.1454545 0.1454545), wk = 0.0038314 k( 18) = ( 0.1545455 -0.1545455 0.1545454), wk = 0.0038314 k( 19) = ( 0.1636364 -0.1636364 0.1636364), wk = 0.0038314 k( 20) = ( 0.1727273 -0.1727273 0.1727273), wk = 0.0038314 k( 21) = ( 0.1818182 -0.1818182 0.1818182), wk = 0.0038314 k( 22) = ( 0.1909091 -0.1909091 0.1909091), wk = 0.0038314 k( 23) = ( 0.2000000 -0.2000000 0.2000000), wk = 0.0038314 k( 24) = ( 0.2090909 -0.2090909 0.2090909), wk = 0.0038314 k( 25) = ( 0.2181818 -0.2181818 0.2181818), wk = 0.0038314 k( 26) = ( 0.2272727 -0.2272727 0.2272727), wk = 0.0038314 k( 27) = ( 0.2363636 -0.2363636 0.2363636), wk = 0.0038314 k( 28) = ( 0.2454545 -0.2454545 0.2454545), wk = 0.0038314 k( 29) = ( 0.2545455 -0.2545455 0.2545454), wk = 0.0038314 k( 30) = ( 0.2636364 -0.2636364 0.2636364), wk = 0.0038314 k( 31) = ( 0.2727273 -0.2727273 0.2727273), wk = 0.0038314 k( 32) = ( 0.2818182 -0.2818182 0.2818182), wk = 0.0038314 k( 33) = ( 0.2909091 -0.2909091 0.2909091), wk = 0.0038314 k( 34) = ( 0.3000000 -0.3000000 0.3000000), wk = 0.0038314 k( 35) = ( 0.3090909 -0.3090909 0.3090909), wk = 0.0038314 k( 36) = ( 0.3181818 -0.3181818 0.3181818), wk = 0.0038314 k( 37) = ( 0.3272727 -0.3272727 0.3272727), wk = 0.0038314 k( 38) = ( 0.3363636 -0.3363636 0.3363636), wk = 0.0038314 k( 39) = ( 0.3454546 -0.3454546 0.3454545), wk = 0.0038314 k( 40) = ( 0.3545454 -0.3545454 0.3545454), wk = 0.0038314 k( 41) = ( 0.3636364 -0.3636364 0.3636364), wk = 0.0038314 k( 42) = ( 0.3727273 -0.3727273 0.3727273), wk = 0.0038314 k( 43) = ( 0.3818182 -0.3818182 0.3818182), wk = 0.0038314 k( 44) = ( 0.3909091 -0.3909091 0.3909091), wk = 0.0038314 k( 45) = ( 0.4000000 -0.4000000 0.4000000), wk = 0.0038314 k( 46) = ( 0.4090909 -0.4090909 0.4090909), wk = 0.0038314 k( 47) = ( 0.4181818 -0.4181818 0.4181818), wk = 0.0038314 k( 48) = ( 0.4272727 -0.4272727 0.4272727), wk = 0.0038314 k( 49) = ( 0.4363636 -0.4363636 0.4363636), wk = 0.0038314 k( 50) = ( 0.4454546 -0.4454546 0.4454545), wk = 0.0038314 k( 51) = ( 0.4545455 -0.4545454 0.4545454), wk = 0.0038314 k( 52) = ( 0.4636364 -0.4636364 0.4636364), wk = 0.0038314 k( 53) = ( 0.4727273 -0.4727273 0.4727273), wk = 0.0038314 k( 54) = ( 0.4818182 -0.4818182 0.4818182), wk = 0.0038314 k( 55) = ( 0.4909091 -0.4909091 0.4909091), wk = 0.0038314 k( 56) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0038314 k( 57) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0038314 k( 58) = ( 0.4871795 -0.4871795 0.5000000), wk = 0.0038314 k( 59) = ( 0.4743590 -0.4743590 0.5000000), wk = 0.0038314 k( 60) = ( 0.4615385 -0.4615385 0.5000000), wk = 0.0038314 k( 61) = ( 0.4487179 -0.4487179 0.5000000), wk = 0.0038314 k( 62) = ( 0.4358974 -0.4358974 0.5000000), wk = 0.0038314 k( 63) = ( 0.4230769 -0.4230769 0.5000000), wk = 0.0038314 k( 64) = ( 0.4102564 -0.4102564 0.5000000), wk = 0.0038314 k( 65) = ( 0.3974359 -0.3974359 0.5000000), wk = 0.0038314 k( 66) = ( 0.3846154 -0.3846154 0.5000000), wk = 0.0038314 k( 67) = ( 0.3717949 -0.3717949 0.5000000), wk = 0.0038314 k( 68) = ( 0.3589744 -0.3589744 0.5000000), wk = 0.0038314 k( 69) = ( 0.3461538 -0.3461538 0.5000000), wk = 0.0038314 k( 70) = ( 0.3333333 -0.3333333 0.5000000), wk = 0.0038314 k( 71) = ( 0.3205128 -0.3205128 0.5000000), wk = 0.0038314 k( 72) = ( 0.3076923 -0.3076923 0.5000000), wk = 0.0038314 k( 73) = ( 0.2948718 -0.2948718 0.5000000), wk = 0.0038314 k( 74) = ( 0.2820513 -0.2820513 0.5000000), wk = 0.0038314 k( 75) = ( 0.2692308 -0.2692308 0.5000000), wk = 0.0038314 k( 76) = ( 0.2564103 -0.2564103 0.5000000), wk = 0.0038314 k( 77) = ( 0.2435897 -0.2435897 0.5000000), wk = 0.0038314 k( 78) = ( 0.2307692 -0.2307692 0.5000000), wk = 0.0038314 k( 79) = ( 0.2179487 -0.2179487 0.5000000), wk = 0.0038314 k( 80) = ( 0.2051282 -0.2051282 0.5000000), wk = 0.0038314 k( 81) = ( 0.1923077 -0.1923077 0.5000000), wk = 0.0038314 k( 82) = ( 0.1794872 -0.1794872 0.5000000), wk = 0.0038314 k( 83) = ( 0.1666667 -0.1666667 0.5000000), wk = 0.0038314 k( 84) = ( 0.1538461 -0.1538461 0.5000000), wk = 0.0038314 k( 85) = ( 0.1410256 -0.1410256 0.5000000), wk = 0.0038314 k( 86) = ( 0.1282051 -0.1282051 0.5000000), wk = 0.0038314 k( 87) = ( 0.1153846 -0.1153846 0.5000000), wk = 0.0038314 k( 88) = ( 0.1025641 -0.1025641 0.5000000), wk = 0.0038314 k( 89) = ( 0.0897436 -0.0897436 0.5000000), wk = 0.0038314 k( 90) = ( 0.0769231 -0.0769231 0.5000000), wk = 0.0038314 k( 91) = ( 0.0641026 -0.0641026 0.5000000), wk = 0.0038314 k( 92) = ( 0.0512821 -0.0512821 0.5000000), wk = 0.0038314 k( 93) = ( 0.0384615 -0.0384615 0.5000000), wk = 0.0038314 k( 94) = ( 0.0256410 -0.0256410 0.5000000), wk = 0.0038314 k( 95) = ( 0.0128205 -0.0128205 0.5000000), wk = 0.0038314 k( 96) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038314 k( 97) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038314 k( 98) = ( 0.0000000 0.0000000 0.4871795), wk = 0.0038314 k( 99) = ( 0.0000000 0.0000000 0.4743590), wk = 0.0038314 k( 100) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0038314 k( 101) = ( 0.0000000 0.0000000 0.4487179), wk = 0.0038314 k( 102) = ( 0.0000000 0.0000000 0.4358974), wk = 0.0038314 k( 103) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0038314 k( 104) = ( 0.0000000 0.0000000 0.4102564), wk = 0.0038314 k( 105) = ( 0.0000000 0.0000000 0.3974359), wk = 0.0038314 k( 106) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0038314 k( 107) = ( 0.0000000 0.0000000 0.3717949), wk = 0.0038314 k( 108) = ( 0.0000000 0.0000000 0.3589744), wk = 0.0038314 k( 109) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0038314 k( 110) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0038314 k( 111) = ( 0.0000000 0.0000000 0.3205128), wk = 0.0038314 k( 112) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0038314 k( 113) = ( 0.0000000 0.0000000 0.2948718), wk = 0.0038314 k( 114) = ( 0.0000000 0.0000000 0.2820513), wk = 0.0038314 k( 115) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0038314 k( 116) = ( 0.0000000 0.0000000 0.2564103), wk = 0.0038314 k( 117) = ( 0.0000000 0.0000000 0.2435897), wk = 0.0038314 k( 118) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0038314 k( 119) = ( 0.0000000 0.0000000 0.2179487), wk = 0.0038314 k( 120) = ( 0.0000000 0.0000000 0.2051282), wk = 0.0038314 k( 121) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0038314 k( 122) = ( 0.0000000 0.0000000 0.1794872), wk = 0.0038314 k( 123) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0038314 k( 124) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0038314 k( 125) = ( 0.0000000 0.0000000 0.1410256), wk = 0.0038314 k( 126) = ( 0.0000000 0.0000000 0.1282051), wk = 0.0038314 k( 127) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0038314 k( 128) = ( 0.0000000 0.0000000 0.1025641), wk = 0.0038314 k( 129) = ( 0.0000000 0.0000000 0.0897436), wk = 0.0038314 k( 130) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0038314 k( 131) = ( 0.0000000 0.0000000 0.0641026), wk = 0.0038314 k( 132) = ( 0.0000000 0.0000000 0.0512821), wk = 0.0038314 k( 133) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0038314 k( 134) = ( 0.0000000 0.0000000 0.0256410), wk = 0.0038314 k( 135) = ( 0.0000000 0.0000000 0.0128205), wk = 0.0038314 k( 136) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 137) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038314 k( 138) = ( 0.0053191 0.0053192 0.0053191), wk = 0.0038314 k( 139) = ( 0.0106383 0.0106383 0.0106383), wk = 0.0038314 k( 140) = ( 0.0159575 0.0159575 0.0159574), wk = 0.0038314 k( 141) = ( 0.0212766 0.0212766 0.0212766), wk = 0.0038314 k( 142) = ( 0.0265957 0.0265957 0.0265957), wk = 0.0038314 k( 143) = ( 0.0319149 0.0319149 0.0319149), wk = 0.0038314 k( 144) = ( 0.0372340 0.0372340 0.0372340), wk = 0.0038314 k( 145) = ( 0.0425532 0.0425532 0.0425532), wk = 0.0038314 k( 146) = ( 0.0478723 0.0478723 0.0478723), wk = 0.0038314 k( 147) = ( 0.0531915 0.0531915 0.0531915), wk = 0.0038314 k( 148) = ( 0.0585106 0.0585106 0.0585106), wk = 0.0038314 k( 149) = ( 0.0638298 0.0638298 0.0638298), wk = 0.0038314 k( 150) = ( 0.0691489 0.0691489 0.0691489), wk = 0.0038314 k( 151) = ( 0.0744681 0.0744681 0.0744681), wk = 0.0038314 k( 152) = ( 0.0797872 0.0797872 0.0797872), wk = 0.0038314 k( 153) = ( 0.0851064 0.0851064 0.0851064), wk = 0.0038314 k( 154) = ( 0.0904255 0.0904255 0.0904255), wk = 0.0038314 k( 155) = ( 0.0957447 0.0957447 0.0957447), wk = 0.0038314 k( 156) = ( 0.1010638 0.1010638 0.1010638), wk = 0.0038314 k( 157) = ( 0.1063830 0.1063830 0.1063830), wk = 0.0038314 k( 158) = ( 0.1117021 0.1117021 0.1117021), wk = 0.0038314 k( 159) = ( 0.1170213 0.1170213 0.1170213), wk = 0.0038314 k( 160) = ( 0.1223404 0.1223404 0.1223404), wk = 0.0038314 k( 161) = ( 0.1276596 0.1276596 0.1276596), wk = 0.0038314 k( 162) = ( 0.1329787 0.1329787 0.1329787), wk = 0.0038314 k( 163) = ( 0.1382979 0.1382979 0.1382979), wk = 0.0038314 k( 164) = ( 0.1436170 0.1436170 0.1436170), wk = 0.0038314 k( 165) = ( 0.1489362 0.1489362 0.1489362), wk = 0.0038314 k( 166) = ( 0.1542553 0.1542553 0.1542553), wk = 0.0038314 k( 167) = ( 0.1595745 0.1595745 0.1595745), wk = 0.0038314 k( 168) = ( 0.1648936 0.1648936 0.1648936), wk = 0.0038314 k( 169) = ( 0.1702128 0.1702128 0.1702128), wk = 0.0038314 k( 170) = ( 0.1755319 0.1755319 0.1755319), wk = 0.0038314 k( 171) = ( 0.1808511 0.1808511 0.1808511), wk = 0.0038314 k( 172) = ( 0.1861702 0.1861702 0.1861702), wk = 0.0038314 k( 173) = ( 0.1914894 0.1914894 0.1914894), wk = 0.0038314 k( 174) = ( 0.1968085 0.1968085 0.1968085), wk = 0.0038314 k( 175) = ( 0.2021277 0.2021277 0.2021277), wk = 0.0038314 k( 176) = ( 0.2074468 0.2074468 0.2074468), wk = 0.0038314 k( 177) = ( 0.2127660 0.2127660 0.2127660), wk = 0.0038314 k( 178) = ( 0.2180851 0.2180851 0.2180851), wk = 0.0038314 k( 179) = ( 0.2234043 0.2234043 0.2234043), wk = 0.0038314 k( 180) = ( 0.2287234 0.2287234 0.2287234), wk = 0.0038314 k( 181) = ( 0.2340425 0.2340426 0.2340425), wk = 0.0038314 k( 182) = ( 0.2393617 0.2393617 0.2393617), wk = 0.0038314 k( 183) = ( 0.2446809 0.2446809 0.2446809), wk = 0.0038314 k( 184) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0038314 k( 185) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0038314 k( 186) = ( 0.2553191 0.2340426 0.2553191), wk = 0.0038314 k( 187) = ( 0.2606383 0.2180851 0.2606383), wk = 0.0038314 k( 188) = ( 0.2659574 0.2021277 0.2659574), wk = 0.0038314 k( 189) = ( 0.2712766 0.1861702 0.2712766), wk = 0.0038314 k( 190) = ( 0.2765957 0.1702128 0.2765957), wk = 0.0038314 k( 191) = ( 0.2819149 0.1542553 0.2819149), wk = 0.0038314 k( 192) = ( 0.2872340 0.1382979 0.2872340), wk = 0.0038314 k( 193) = ( 0.2925532 0.1223404 0.2925532), wk = 0.0038314 k( 194) = ( 0.2978723 0.1063830 0.2978723), wk = 0.0038314 k( 195) = ( 0.3031915 0.0904255 0.3031915), wk = 0.0038314 k( 196) = ( 0.3085106 0.0744681 0.3085106), wk = 0.0038314 k( 197) = ( 0.3138298 0.0585106 0.3138298), wk = 0.0038314 k( 198) = ( 0.3191489 0.0425532 0.3191489), wk = 0.0038314 k( 199) = ( 0.3244681 0.0265957 0.3244681), wk = 0.0038314 k( 200) = ( 0.3297872 0.0106383 0.3297872), wk = 0.0038314 k( 201) = ( 0.3351064 -0.0053191 0.3351064), wk = 0.0038314 k( 202) = ( 0.3404255 -0.0212766 0.3404255), wk = 0.0038314 k( 203) = ( 0.3457447 -0.0372340 0.3457447), wk = 0.0038314 k( 204) = ( 0.3510638 -0.0531915 0.3510638), wk = 0.0038314 k( 205) = ( 0.3563830 -0.0691489 0.3563830), wk = 0.0038314 k( 206) = ( 0.3617021 -0.0851064 0.3617021), wk = 0.0038314 k( 207) = ( 0.3670213 -0.1010638 0.3670213), wk = 0.0038314 k( 208) = ( 0.3723404 -0.1170213 0.3723404), wk = 0.0038314 k( 209) = ( 0.3776596 -0.1329787 0.3776596), wk = 0.0038314 k( 210) = ( 0.3829787 -0.1489362 0.3829787), wk = 0.0038314 k( 211) = ( 0.3882979 -0.1648936 0.3882979), wk = 0.0038314 k( 212) = ( 0.3936170 -0.1808511 0.3936170), wk = 0.0038314 k( 213) = ( 0.3989362 -0.1968085 0.3989362), wk = 0.0038314 k( 214) = ( 0.4042553 -0.2127660 0.4042553), wk = 0.0038314 k( 215) = ( 0.4095745 -0.2287234 0.4095745), wk = 0.0038314 k( 216) = ( 0.4148936 -0.2446809 0.4148936), wk = 0.0038314 k( 217) = ( 0.4202128 -0.2606383 0.4202128), wk = 0.0038314 k( 218) = ( 0.4255319 -0.2765957 0.4255319), wk = 0.0038314 k( 219) = ( 0.4308511 -0.2925532 0.4308511), wk = 0.0038314 k( 220) = ( 0.4361702 -0.3085106 0.4361702), wk = 0.0038314 k( 221) = ( 0.4414894 -0.3244681 0.4414894), wk = 0.0038314 k( 222) = ( 0.4468085 -0.3404255 0.4468085), wk = 0.0038314 k( 223) = ( 0.4521277 -0.3563830 0.4521277), wk = 0.0038314 k( 224) = ( 0.4574468 -0.3723404 0.4574468), wk = 0.0038314 k( 225) = ( 0.4627660 -0.3882979 0.4627660), wk = 0.0038314 k( 226) = ( 0.4680851 -0.4042553 0.4680851), wk = 0.0038314 k( 227) = ( 0.4734043 -0.4202128 0.4734043), wk = 0.0038314 k( 228) = ( 0.4787234 -0.4361702 0.4787234), wk = 0.0038314 k( 229) = ( 0.4840426 -0.4521277 0.4840425), wk = 0.0038314 k( 230) = ( 0.4893617 -0.4680851 0.4893617), wk = 0.0038314 k( 231) = ( 0.4946809 -0.4840426 0.4946808), wk = 0.0038314 k( 232) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0038314 k( 233) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0038314 k( 234) = ( 0.2410714 0.2410714 0.2589286), wk = 0.0038314 k( 235) = ( 0.2321429 0.2321429 0.2678571), wk = 0.0038314 k( 236) = ( 0.2232143 0.2232143 0.2767857), wk = 0.0038314 k( 237) = ( 0.2142857 0.2142857 0.2857143), wk = 0.0038314 k( 238) = ( 0.2053571 0.2053571 0.2946429), wk = 0.0038314 k( 239) = ( 0.1964286 0.1964286 0.3035714), wk = 0.0038314 k( 240) = ( 0.1875000 0.1875000 0.3125000), wk = 0.0038314 k( 241) = ( 0.1785714 0.1785714 0.3214286), wk = 0.0038314 k( 242) = ( 0.1696429 0.1696429 0.3303571), wk = 0.0038314 k( 243) = ( 0.1607143 0.1607143 0.3392857), wk = 0.0038314 k( 244) = ( 0.1517857 0.1517857 0.3482143), wk = 0.0038314 k( 245) = ( 0.1428571 0.1428571 0.3571429), wk = 0.0038314 k( 246) = ( 0.1339286 0.1339286 0.3660714), wk = 0.0038314 k( 247) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0038314 k( 248) = ( 0.1160714 0.1160714 0.3839286), wk = 0.0038314 k( 249) = ( 0.1071429 0.1071429 0.3928571), wk = 0.0038314 k( 250) = ( 0.0982143 0.0982143 0.4017857), wk = 0.0038314 k( 251) = ( 0.0892857 0.0892857 0.4107143), wk = 0.0038314 k( 252) = ( 0.0803571 0.0803571 0.4196429), wk = 0.0038314 k( 253) = ( 0.0714286 0.0714286 0.4285714), wk = 0.0038314 k( 254) = ( 0.0625000 0.0625000 0.4375000), wk = 0.0038314 k( 255) = ( 0.0535714 0.0535714 0.4464286), wk = 0.0038314 k( 256) = ( 0.0446429 0.0446429 0.4553571), wk = 0.0038314 k( 257) = ( 0.0357143 0.0357143 0.4642857), wk = 0.0038314 k( 258) = ( 0.0267857 0.0267857 0.4732143), wk = 0.0038314 k( 259) = ( 0.0178571 0.0178571 0.4821429), wk = 0.0038314 k( 260) = ( 0.0089286 0.0089286 0.4910714), wk = 0.0038314 k( 261) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038314 Dense grid: 62543 G-vectors FFT dimensions: ( 54, 54, 54) Smooth grid: 31317 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.20 Mb ( 224, 58) NL pseudopotentials 0.20 Mb ( 112, 118) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.01 Mb ( 1738) G-vector shells 0.00 Mb ( 345) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.79 Mb ( 224, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.21 Mb ( 118, 2, 58) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./SF6.save/charge-density.dat Starting wfc are 56 randomized atomic wfcs + 2 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.3 secs Computing kpt #: 2 total cpu time spent up to now is 2.7 secs Computing kpt #: 3 total cpu time spent up to now is 3.0 secs Computing kpt #: 4 total cpu time spent up to now is 3.4 secs Computing kpt #: 5 total cpu time spent up to now is 3.7 secs Computing kpt #: 6 total cpu time spent up to now is 4.1 secs Computing kpt #: 7 total cpu time spent up to now is 4.5 secs Computing kpt #: 8 total cpu time spent up to now is 4.8 secs Computing kpt #: 9 total cpu time spent up to now is 5.2 secs Computing kpt #: 10 total cpu time spent up to now is 5.5 secs Computing kpt #: 11 total cpu time spent up to now is 5.9 secs Computing kpt #: 12 total cpu time spent up to now is 6.3 secs Computing kpt #: 13 total cpu time spent up to now is 6.6 secs Computing kpt #: 14 total cpu time spent up to now is 7.0 secs Computing kpt #: 15 total cpu time spent up to now is 7.4 secs Computing kpt #: 16 total cpu time spent up to now is 7.7 secs Computing kpt #: 17 total cpu time spent up to now is 8.1 secs Computing kpt #: 18 total cpu time spent up to now is 8.5 secs Computing kpt #: 19 total cpu time spent up to now is 8.9 secs Computing kpt #: 20 total cpu time spent up to now is 9.3 secs Computing kpt #: 21 total cpu time spent up to now is 9.7 secs Computing kpt #: 22 total cpu time spent up to now is 10.1 secs Computing kpt #: 23 total cpu time spent up to now is 10.4 secs Computing kpt #: 24 total cpu time spent up to now is 10.8 secs Computing kpt #: 25 total cpu time spent up to now is 11.2 secs Computing kpt #: 26 total cpu time spent up to now is 11.6 secs Computing kpt #: 27 total cpu time spent up to now is 11.9 secs Computing kpt #: 28 total cpu time spent up to now is 12.3 secs Computing kpt #: 29 total cpu time spent up to now is 12.7 secs Computing kpt #: 30 total cpu time spent up to now is 13.1 secs Computing kpt #: 31 total cpu time spent up to now is 13.5 secs Computing kpt #: 32 total cpu time spent up to now is 13.9 secs Computing kpt #: 33 total cpu time spent up to now is 14.2 secs Computing kpt #: 34 total cpu time spent up to now is 14.6 secs Computing kpt #: 35 total cpu time spent up to now is 15.0 secs Computing kpt #: 36 total cpu time spent up to now is 15.4 secs Computing kpt #: 37 total cpu time spent up to now is 15.8 secs Computing kpt #: 38 total cpu time spent up to now is 16.2 secs Computing kpt #: 39 total cpu time spent up to now is 16.6 secs Computing kpt #: 40 total cpu time spent up to now is 17.0 secs Computing kpt #: 41 total cpu time spent up to now is 17.4 secs Computing kpt #: 42 total cpu time spent up to now is 17.8 secs Computing kpt #: 43 total cpu time spent up to now is 18.2 secs Computing kpt #: 44 total cpu time spent up to now is 18.6 secs Computing kpt #: 45 total cpu time spent up to now is 19.0 secs Computing kpt #: 46 total cpu time spent up to now is 19.4 secs Computing kpt #: 47 total cpu time spent up to now is 19.8 secs Computing kpt #: 48 total cpu time spent up to now is 20.2 secs Computing kpt #: 49 total cpu time spent up to now is 20.6 secs Computing kpt #: 50 total cpu time spent up to now is 21.0 secs Computing kpt #: 51 total cpu time spent up to now is 21.4 secs Computing kpt #: 52 total cpu time spent up to now is 21.9 secs Computing kpt #: 53 total cpu time spent up to now is 22.4 secs Computing kpt #: 54 total cpu time spent up to now is 23.0 secs Computing kpt #: 55 total cpu time spent up to now is 23.8 secs Computing kpt #: 56 total cpu time spent up to now is 24.4 secs Computing kpt #: 57 total cpu time spent up to now is 24.9 secs Computing kpt #: 58 total cpu time spent up to now is 25.7 secs Computing kpt #: 59 total cpu time spent up to now is 26.3 secs Computing kpt #: 60 total cpu time spent up to now is 26.9 secs Computing kpt #: 61 total cpu time spent up to now is 27.4 secs Computing kpt #: 62 total cpu time spent up to now is 28.0 secs Computing kpt #: 63 total cpu time spent up to now is 28.5 secs Computing kpt #: 64 total cpu time spent up to now is 28.9 secs Computing kpt #: 65 total cpu time spent up to now is 29.4 secs Computing kpt #: 66 total cpu time spent up to now is 29.8 secs Computing kpt #: 67 total cpu time spent up to now is 30.2 secs Computing kpt #: 68 total cpu time spent up to now is 30.7 secs Computing kpt #: 69 total cpu time spent up to now is 31.1 secs Computing kpt #: 70 total cpu time spent up to now is 31.6 secs Computing kpt #: 71 total cpu time spent up to now is 32.0 secs Computing kpt #: 72 total cpu time spent up to now is 32.5 secs Computing kpt #: 73 total cpu time spent up to now is 32.9 secs Computing kpt #: 74 total cpu time spent up to now is 33.4 secs Computing kpt #: 75 total cpu time spent up to now is 33.8 secs Computing kpt #: 76 total cpu time spent up to now is 34.3 secs Computing kpt #: 77 total cpu time spent up to now is 34.7 secs Computing kpt #: 78 total cpu time spent up to now is 35.2 secs Computing kpt #: 79 total cpu time spent up to now is 35.7 secs Computing kpt #: 80 total cpu time spent up to now is 36.1 secs Computing kpt #: 81 total cpu time spent up to now is 36.6 secs Computing kpt #: 82 total cpu time spent up to now is 37.0 secs Computing kpt #: 83 total cpu time spent up to now is 37.4 secs Computing kpt #: 84 total cpu time spent up to now is 37.8 secs Computing kpt #: 85 total cpu time spent up to now is 38.3 secs Computing kpt #: 86 total cpu time spent up to now is 38.7 secs Computing kpt #: 87 total cpu time spent up to now is 39.1 secs Computing kpt #: 88 total cpu time spent up to now is 39.5 secs Computing kpt #: 89 total cpu time spent up to now is 39.9 secs Computing kpt #: 90 total cpu time spent up to now is 40.4 secs Computing kpt #: 91 total cpu time spent up to now is 40.8 secs Computing kpt #: 92 total cpu time spent up to now is 41.2 secs Computing kpt #: 93 total cpu time spent up to now is 41.6 secs Computing kpt #: 94 total cpu time spent up to now is 42.0 secs Computing kpt #: 95 total cpu time spent up to now is 42.4 secs Computing kpt #: 96 total cpu time spent up to now is 42.9 secs Computing kpt #: 97 total cpu time spent up to now is 43.3 secs Computing kpt #: 98 total cpu time spent up to now is 43.7 secs Computing kpt #: 99 total cpu time spent up to now is 44.1 secs Computing kpt #: 100 total cpu time spent up to now is 44.5 secs Computing kpt #: 101 total cpu time spent up to now is 44.9 secs Computing kpt #: 102 total cpu time spent up to now is 45.4 secs Computing kpt #: 103 total cpu time spent up to now is 45.8 secs Computing kpt #: 104 total cpu time spent up to now is 46.2 secs Computing kpt #: 105 total cpu time spent up to now is 46.6 secs Computing kpt #: 106 total cpu time spent up to now is 47.1 secs Computing kpt #: 107 total cpu time spent up to now is 47.5 secs Computing kpt #: 108 total cpu time spent up to now is 47.9 secs Computing kpt #: 109 total cpu time spent up to now is 48.3 secs Computing kpt #: 110 total cpu time spent up to now is 48.7 secs Computing kpt #: 111 total cpu time spent up to now is 49.1 secs Computing kpt #: 112 total cpu time spent up to now is 49.5 secs Computing kpt #: 113 total cpu time spent up to now is 49.9 secs Computing kpt #: 114 total cpu time spent up to now is 50.3 secs Computing kpt #: 115 total cpu time spent up to now is 50.7 secs Computing kpt #: 116 total cpu time spent up to now is 51.1 secs Computing kpt #: 117 total cpu time spent up to now is 51.5 secs Computing kpt #: 118 total cpu time spent up to now is 51.9 secs Computing kpt #: 119 total cpu time spent up to now is 52.3 secs Computing kpt #: 120 total cpu time spent up to now is 52.7 secs Computing kpt #: 121 total cpu time spent up to now is 53.0 secs Computing kpt #: 122 total cpu time spent up to now is 53.4 secs Computing kpt #: 123 total cpu time spent up to now is 53.8 secs Computing kpt #: 124 total cpu time spent up to now is 54.2 secs Computing kpt #: 125 total cpu time spent up to now is 54.5 secs Computing kpt #: 126 total cpu time spent up to now is 54.9 secs Computing kpt #: 127 total cpu time spent up to now is 55.3 secs Computing kpt #: 128 total cpu time spent up to now is 55.6 secs Computing kpt #: 129 total cpu time spent up to now is 56.0 secs Computing kpt #: 130 total cpu time spent up to now is 56.3 secs Computing kpt #: 131 total cpu time spent up to now is 56.7 secs Computing kpt #: 132 total cpu time spent up to now is 57.1 secs Computing kpt #: 133 total cpu time spent up to now is 57.4 secs Computing kpt #: 134 total cpu time spent up to now is 57.8 secs Computing kpt #: 135 total cpu time spent up to now is 58.1 secs Computing kpt #: 136 total cpu time spent up to now is 58.5 secs Computing kpt #: 137 total cpu time spent up to now is 58.8 secs Computing kpt #: 138 total cpu time spent up to now is 59.2 secs Computing kpt #: 139 total cpu time spent up to now is 59.5 secs Computing kpt #: 140 total cpu time spent up to now is 59.9 secs Computing kpt #: 141 total cpu time spent up to now is 60.2 secs Computing kpt #: 142 total cpu time spent up to now is 60.6 secs Computing kpt #: 143 total cpu time spent up to now is 61.0 secs Computing kpt #: 144 total cpu time spent up to now is 61.3 secs Computing kpt #: 145 total cpu time spent up to now is 61.7 secs Computing kpt #: 146 total cpu time spent up to now is 62.0 secs Computing kpt #: 147 total cpu time spent up to now is 62.4 secs Computing kpt #: 148 total cpu time spent up to now is 62.8 secs Computing kpt #: 149 total cpu time spent up to now is 63.1 secs Computing kpt #: 150 total cpu time spent up to now is 63.5 secs Computing kpt #: 151 total cpu time spent up to now is 63.9 secs Computing kpt #: 152 total cpu time spent up to now is 64.3 secs Computing kpt #: 153 total cpu time spent up to now is 64.6 secs Computing kpt #: 154 total cpu time spent up to now is 65.0 secs Computing kpt #: 155 total cpu time spent up to now is 65.4 secs Computing kpt #: 156 total cpu time spent up to now is 65.8 secs Computing kpt #: 157 total cpu time spent up to now is 66.2 secs Computing kpt #: 158 total cpu time spent up to now is 66.6 secs Computing kpt #: 159 total cpu time spent up to now is 67.0 secs Computing kpt #: 160 total cpu time spent up to now is 67.3 secs Computing kpt #: 161 total cpu time spent up to now is 67.7 secs Computing kpt #: 162 total cpu time spent up to now is 68.1 secs Computing kpt #: 163 total cpu time spent up to now is 68.5 secs Computing kpt #: 164 total cpu time spent up to now is 68.9 secs Computing kpt #: 165 total cpu time spent up to now is 69.3 secs Computing kpt #: 166 total cpu time spent up to now is 69.7 secs Computing kpt #: 167 total cpu time spent up to now is 70.1 secs Computing kpt #: 168 total cpu time spent up to now is 70.5 secs Computing kpt #: 169 total cpu time spent up to now is 70.9 secs Computing kpt #: 170 total cpu time spent up to now is 71.3 secs Computing kpt #: 171 total cpu time spent up to now is 71.7 secs Computing kpt #: 172 total cpu time spent up to now is 72.1 secs Computing kpt #: 173 total cpu time spent up to now is 72.6 secs Computing kpt #: 174 total cpu time spent up to now is 73.0 secs Computing kpt #: 175 total cpu time spent up to now is 73.4 secs Computing kpt #: 176 total cpu time spent up to now is 73.8 secs Computing kpt #: 177 total cpu time spent up to now is 74.2 secs Computing kpt #: 178 total cpu time spent up to now is 74.7 secs Computing kpt #: 179 total cpu time spent up to now is 75.1 secs Computing kpt #: 180 total cpu time spent up to now is 75.6 secs Computing kpt #: 181 total cpu time spent up to now is 76.0 secs Computing kpt #: 182 total cpu time spent up to now is 76.5 secs Computing kpt #: 183 total cpu time spent up to now is 77.0 secs Computing kpt #: 184 total cpu time spent up to now is 77.6 secs Computing kpt #: 185 total cpu time spent up to now is 78.2 secs Computing kpt #: 186 total cpu time spent up to now is 78.8 secs Computing kpt #: 187 total cpu time spent up to now is 79.3 secs Computing kpt #: 188 total cpu time spent up to now is 79.8 secs Computing kpt #: 189 total cpu time spent up to now is 80.4 secs Computing kpt #: 190 total cpu time spent up to now is 80.9 secs Computing kpt #: 191 total cpu time spent up to now is 81.4 secs Computing kpt #: 192 total cpu time spent up to now is 81.9 secs Computing kpt #: 193 total cpu time spent up to now is 82.5 secs Computing kpt #: 194 total cpu time spent up to now is 83.0 secs Computing kpt #: 195 total cpu time spent up to now is 83.5 secs Computing kpt #: 196 total cpu time spent up to now is 84.0 secs Computing kpt #: 197 total cpu time spent up to now is 84.6 secs Computing kpt #: 198 total cpu time spent up to now is 85.1 secs Computing kpt #: 199 total cpu time spent up to now is 85.6 secs Computing kpt #: 200 total cpu time spent up to now is 86.1 secs Computing kpt #: 201 total cpu time spent up to now is 86.7 secs Computing kpt #: 202 total cpu time spent up to now is 87.1 secs Computing kpt #: 203 total cpu time spent up to now is 87.6 secs Computing kpt #: 204 total cpu time spent up to now is 88.0 secs Computing kpt #: 205 total cpu time spent up to now is 88.5 secs Computing kpt #: 206 total cpu time spent up to now is 88.9 secs Computing kpt #: 207 total cpu time spent up to now is 89.4 secs Computing kpt #: 208 total cpu time spent up to now is 89.8 secs Computing kpt #: 209 total cpu time spent up to now is 90.3 secs Computing kpt #: 210 total cpu time spent up to now is 90.7 secs Computing kpt #: 211 total cpu time spent up to now is 91.2 secs Computing kpt #: 212 total cpu time spent up to now is 91.6 secs Computing kpt #: 213 total cpu time spent up to now is 92.1 secs Computing kpt #: 214 total cpu time spent up to now is 92.5 secs Computing kpt #: 215 total cpu time spent up to now is 93.0 secs Computing kpt #: 216 total cpu time spent up to now is 93.5 secs Computing kpt #: 217 total cpu time spent up to now is 93.9 secs Computing kpt #: 218 total cpu time spent up to now is 94.4 secs Computing kpt #: 219 total cpu time spent up to now is 94.8 secs Computing kpt #: 220 total cpu time spent up to now is 95.3 secs Computing kpt #: 221 total cpu time spent up to now is 95.8 secs Computing kpt #: 222 total cpu time spent up to now is 96.3 secs Computing kpt #: 223 total cpu time spent up to now is 96.9 secs Computing kpt #: 224 total cpu time spent up to now is 97.4 secs Computing kpt #: 225 total cpu time spent up to now is 97.9 secs Computing kpt #: 226 total cpu time spent up to now is 98.5 secs Computing kpt #: 227 total cpu time spent up to now is 99.1 secs Computing kpt #: 228 total cpu time spent up to now is 99.7 secs Computing kpt #: 229 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 101.5 secs Computing kpt #: 230 total cpu time spent up to now is 102.5 secs Computing kpt #: 231 total cpu time spent up to now is 103.1 secs Computing kpt #: 232 total cpu time spent up to now is 103.6 secs Computing kpt #: 233 total cpu time spent up to now is 104.2 secs Computing kpt #: 234 total cpu time spent up to now is 104.7 secs Computing kpt #: 235 total cpu time spent up to now is 105.3 secs Computing kpt #: 236 total cpu time spent up to now is 105.8 secs Computing kpt #: 237 total cpu time spent up to now is 106.3 secs Computing kpt #: 238 total cpu time spent up to now is 106.9 secs Computing kpt #: 239 total cpu time spent up to now is 107.4 secs Computing kpt #: 240 total cpu time spent up to now is 107.8 secs Computing kpt #: 241 total cpu time spent up to now is 108.4 secs Computing kpt #: 242 total cpu time spent up to now is 108.9 secs Computing kpt #: 243 total cpu time spent up to now is 109.4 secs Computing kpt #: 244 total cpu time spent up to now is 109.9 secs Computing kpt #: 245 total cpu time spent up to now is 110.5 secs Computing kpt #: 246 total cpu time spent up to now is 111.0 secs Computing kpt #: 247 total cpu time spent up to now is 111.4 secs Computing kpt #: 248 total cpu time spent up to now is 111.9 secs Computing kpt #: 249 total cpu time spent up to now is 112.3 secs Computing kpt #: 250 total cpu time spent up to now is 112.8 secs Computing kpt #: 251 total cpu time spent up to now is 113.3 secs Computing kpt #: 252 total cpu time spent up to now is 113.7 secs Computing kpt #: 253 total cpu time spent up to now is 114.1 secs Computing kpt #: 254 total cpu time spent up to now is 114.6 secs Computing kpt #: 255 total cpu time spent up to now is 115.0 secs Computing kpt #: 256 total cpu time spent up to now is 115.4 secs Computing kpt #: 257 total cpu time spent up to now is 115.9 secs Computing kpt #: 258 total cpu time spent up to now is 116.3 secs Computing kpt #: 259 total cpu time spent up to now is 116.7 secs Computing kpt #: 260 total cpu time spent up to now is 117.1 secs Computing kpt #: 261 total cpu time spent up to now is 117.6 secs ethr = 2.08E-08, avg # of iterations = 17.4 total cpu time spent up to now is 117.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3925 PWs) bands (ev): -27.9338 -27.9338 -24.4861 -24.4861 -24.4757 -24.4757 -24.4757 -24.4757 -23.0966 -23.0966 -23.0966 -23.0966 -12.5039 -12.5039 -8.3675 -8.3675 -8.3499 -8.3499 -8.3499 -8.3499 -5.8298 -5.8298 -5.8298 -5.8298 -5.8040 -5.8040 -5.4586 -5.4586 -5.4586 -5.4586 -3.4804 -3.4804 -3.4804 -3.4804 -3.4500 -3.4500 -3.2076 -3.2076 -3.1431 -3.1431 -3.1431 -3.1431 -2.0190 -2.0190 -1.9835 -1.9835 -1.9835 -1.9835 4.9182 4.9182 8.7024 8.7024 10.8781 10.8781 10.9675 10.9675 10.9675 10.9675 k = 0.0091-0.0064 0.0111 ( 3953 PWs) bands (ev): -27.9338 -27.9338 -24.4862 -24.4862 -24.4758 -24.4758 -24.4757 -24.4757 -23.0967 -23.0967 -23.0965 -23.0965 -12.5035 -12.5035 -8.3680 -8.3680 -8.3509 -8.3509 -8.3500 -8.3500 -5.8299 -5.8299 -5.8298 -5.8298 -5.8041 -5.8041 -5.4588 -5.4588 -5.4571 -5.4571 -3.4800 -3.4800 -3.4799 -3.4799 -3.4496 -3.4496 -3.2080 -3.2080 -3.1438 -3.1438 -3.1433 -3.1433 -2.0192 -2.0192 -1.9837 -1.9837 -1.9836 -1.9836 4.9198 4.9198 8.7034 8.7034 10.8773 10.8773 10.9659 10.9659 10.9676 10.9676 k = 0.0182-0.0129 0.0223 ( 3961 PWs) bands (ev): -27.9336 -27.9336 -24.4864 -24.4864 -24.4762 -24.4762 -24.4757 -24.4757 -23.0968 -23.0968 -23.0960 -23.0960 -12.5020 -12.5020 -8.3700 -8.3700 -8.3534 -8.3534 -8.3499 -8.3499 -5.8301 -5.8301 -5.8296 -5.8296 -5.8041 -5.8041 -5.4592 -5.4592 -5.4526 -5.4526 -3.4790 -3.4790 -3.4785 -3.4785 -3.4483 -3.4483 -3.2093 -3.2093 -3.1458 -3.1458 -3.1439 -3.1439 -2.0197 -2.0197 -1.9844 -1.9844 -1.9839 -1.9839 4.9245 4.9245 8.7063 8.7063 10.8748 10.8748 10.9613 10.9613 10.9679 10.9679 k = 0.0273-0.0193 0.0334 ( 3961 PWs) bands (ev): -27.9334 -27.9334 -24.4868 -24.4868 -24.4768 -24.4768 -24.4758 -24.4758 -23.0969 -23.0969 -23.0953 -23.0953 -12.4996 -12.4996 -8.3744 -8.3744 -8.3562 -8.3562 -8.3498 -8.3498 -5.8304 -5.8304 -5.8294 -5.8294 -5.8041 -5.8041 -5.4598 -5.4598 -5.4452 -5.4452 -3.4772 -3.4772 -3.4761 -3.4761 -3.4462 -3.4462 -3.2115 -3.2115 -3.1490 -3.1490 -3.1448 -3.1448 -2.0205 -2.0205 -1.9855 -1.9855 -1.9844 -1.9844 4.9324 4.9324 8.7111 8.7111 10.8700 10.8700 10.9545 10.9545 10.9684 10.9684 k = 0.0364-0.0257 0.0445 ( 3961 PWs) bands (ev): -27.9330 -27.9330 -24.4874 -24.4874 -24.4776 -24.4776 -24.4758 -24.4758 -23.0971 -23.0971 -23.0943 -23.0943 -12.4962 -12.4962 -8.3824 -8.3824 -8.3581 -8.3581 -8.3497 -8.3497 -5.8309 -5.8309 -5.8290 -5.8290 -5.8041 -5.8041 -5.4607 -5.4607 -5.4350 -5.4350 -3.4748 -3.4748 -3.4728 -3.4728 -3.4433 -3.4433 -3.2147 -3.2147 -3.1533 -3.1533 -3.1462 -3.1462 -2.0216 -2.0216 -1.9871 -1.9871 -1.9851 -1.9851 4.9433 4.9433 8.7178 8.7178 10.8618 10.8618 10.9466 10.9466 10.9691 10.9691 k = 0.0455-0.0321 0.0557 ( 3961 PWs) bands (ev): -27.9326 -27.9326 -24.4883 -24.4883 -24.4784 -24.4784 -24.4759 -24.4759 -23.0973 -23.0973 -23.0930 -23.0930 -12.4919 -12.4919 -8.3939 -8.3939 -8.3591 -8.3591 -8.3495 -8.3495 -5.8315 -5.8315 -5.8287 -5.8287 -5.8041 -5.8041 -5.4618 -5.4618 -5.4222 -5.4222 -3.4717 -3.4717 -3.4686 -3.4686 -3.4396 -3.4396 -3.2191 -3.2191 -3.1585 -3.1585 -3.1479 -3.1479 -2.0231 -2.0231 -1.9890 -1.9890 -1.9859 -1.9859 4.9572 4.9572 8.7263 8.7263 10.8490 10.8490 10.9391 10.9391 10.9699 10.9699 k = 0.0545-0.0386 0.0668 ( 3949 PWs) bands (ev): -27.9320 -27.9320 -24.4895 -24.4895 -24.4792 -24.4792 -24.4760 -24.4760 -23.0976 -23.0976 -23.0915 -23.0915 -12.4867 -12.4867 -8.4083 -8.4083 -8.3596 -8.3596 -8.3493 -8.3493 -5.8322 -5.8322 -5.8283 -5.8283 -5.8039 -5.8039 -5.4632 -5.4632 -5.4069 -5.4069 -3.4680 -3.4680 -3.4635 -3.4635 -3.4350 -3.4350 -3.2248 -3.2248 -3.1644 -3.1644 -3.1499 -3.1499 -2.0249 -2.0249 -1.9914 -1.9914 -1.9869 -1.9869 4.9740 4.9740 8.7367 8.7367 10.8309 10.8309 10.9332 10.9332 10.9710 10.9710 k = 0.0636-0.0450 0.0779 ( 3957 PWs) bands (ev): -27.9314 -27.9314 -24.4911 -24.4911 -24.4800 -24.4800 -24.4761 -24.4761 -23.0979 -23.0979 -23.0898 -23.0898 -12.4807 -12.4807 -8.4251 -8.4251 -8.3597 -8.3597 -8.3491 -8.3491 -5.8330 -5.8330 -5.8279 -5.8279 -5.8036 -5.8036 -5.4648 -5.4648 -5.3895 -5.3895 -3.4638 -3.4638 -3.4577 -3.4577 -3.4296 -3.4296 -3.2320 -3.2320 -3.1707 -3.1707 -3.1524 -3.1524 -2.0271 -2.0271 -1.9941 -1.9941 -1.9879 -1.9879 4.9936 4.9936 8.7490 8.7490 10.8074 10.8074 10.9291 10.9291 10.9721 10.9721 k = 0.0727-0.0514 0.0891 ( 3957 PWs) bands (ev): -27.9307 -27.9307 -24.4931 -24.4931 -24.4807 -24.4807 -24.4762 -24.4762 -23.0983 -23.0983 -23.0879 -23.0879 -12.4739 -12.4739 -8.4439 -8.4439 -8.3597 -8.3597 -8.3488 -8.3488 -5.8338 -5.8338 -5.8275 -5.8275 -5.8031 -5.8031 -5.4666 -5.4666 -5.3703 -5.3703 -3.4590 -3.4590 -3.4511 -3.4511 -3.4236 -3.4236 -3.2409 -3.2409 -3.1772 -3.1772 -3.1552 -3.1552 -2.0296 -2.0296 -1.9972 -1.9972 -1.9891 -1.9891 5.0157 5.0157 8.7630 8.7630 10.7793 10.7793 10.9266 10.9266 10.9734 10.9734 k = 0.0818-0.0579 0.1002 ( 3953 PWs) bands (ev): -27.9299 -27.9299 -24.4954 -24.4954 -24.4812 -24.4812 -24.4763 -24.4763 -23.0987 -23.0987 -23.0858 -23.0858 -12.4664 -12.4664 -8.4644 -8.4644 -8.3596 -8.3596 -8.3485 -8.3485 -5.8346 -5.8346 -5.8273 -5.8273 -5.8024 -5.8024 -5.4687 -5.4687 -5.3494 -5.3494 -3.4537 -3.4537 -3.4438 -3.4438 -3.4168 -3.4168 -3.2515 -3.2515 -3.1837 -3.1837 -3.1583 -3.1583 -2.0324 -2.0324 -2.0007 -2.0007 -1.9904 -1.9904 5.0403 5.0403 8.7787 8.7787 10.7474 10.7474 10.9253 10.9253 10.9748 10.9748 k = 0.0909-0.0643 0.1113 ( 3953 PWs) bands (ev): -27.9290 -27.9290 -24.4980 -24.4980 -24.4817 -24.4817 -24.4764 -24.4764 -23.0992 -23.0992 -23.0836 -23.0836 -12.4582 -12.4582 -8.4862 -8.4862 -8.3594 -8.3594 -8.3482 -8.3482 -5.8355 -5.8355 -5.8270 -5.8270 -5.8014 -5.8014 -5.4710 -5.4710 -5.3273 -5.3273 -3.4479 -3.4479 -3.4359 -3.4359 -3.4093 -3.4093 -3.2638 -3.2638 -3.1901 -3.1901 -3.1618 -3.1618 -2.0356 -2.0356 -2.0044 -2.0044 -1.9917 -1.9917 5.0672 5.0672 8.7962 8.7962 10.7127 10.7127 10.9247 10.9247 10.9762 10.9762 k = 0.1000-0.0707 0.1225 ( 3937 PWs) bands (ev): -27.9280 -27.9280 -24.5009 -24.5009 -24.4821 -24.4821 -24.4765 -24.4765 -23.0997 -23.0997 -23.0813 -23.0813 -12.4494 -12.4494 -8.5090 -8.5090 -8.3591 -8.3591 -8.3479 -8.3479 -5.8363 -5.8363 -5.8269 -5.8269 -5.8000 -5.8000 -5.4734 -5.4734 -5.3042 -5.3042 -3.4416 -3.4416 -3.4275 -3.4275 -3.4013 -3.4013 -3.2777 -3.2777 -3.1963 -3.1963 -3.1657 -3.1657 -2.0390 -2.0390 -2.0083 -2.0083 -1.9930 -1.9930 5.0961 5.0961 8.8152 8.8152 10.6759 10.6759 10.9247 10.9247 10.9776 10.9776 k = 0.1091-0.0771 0.1336 ( 3937 PWs) bands (ev): -27.9270 -27.9270 -24.5039 -24.5039 -24.4824 -24.4824 -24.4767 -24.4767 -23.1003 -23.1003 -23.0789 -23.0789 -12.4401 -12.4401 -8.5325 -8.5325 -8.3588 -8.3588 -8.3475 -8.3475 -5.8370 -5.8370 -5.8268 -5.8268 -5.7984 -5.7984 -5.4760 -5.4760 -5.2806 -5.2806 -3.4350 -3.4350 -3.4187 -3.4187 -3.3928 -3.3928 -3.2929 -3.2929 -3.2025 -3.2025 -3.1699 -3.1699 -2.0426 -2.0426 -2.0125 -2.0125 -1.9943 -1.9943 5.1268 5.1268 8.8358 8.8358 10.6377 10.6377 10.9250 10.9250 10.9790 10.9790 k = 0.1182-0.0836 0.1447 ( 3937 PWs) bands (ev): -27.9260 -27.9260 -24.5071 -24.5071 -24.4827 -24.4827 -24.4768 -24.4768 -23.1009 -23.1009 -23.0766 -23.0766 -12.4303 -12.4303 -8.5563 -8.5563 -8.3585 -8.3585 -8.3471 -8.3471 -5.8376 -5.8376 -5.8267 -5.8267 -5.7964 -5.7964 -5.4789 -5.4789 -5.2566 -5.2566 -3.4280 -3.4280 -3.4096 -3.4096 -3.3840 -3.3840 -3.3093 -3.3093 -3.2085 -3.2085 -3.1743 -3.1743 -2.0465 -2.0465 -2.0169 -2.0169 -1.9957 -1.9957 5.1591 5.1591 8.8579 8.8579 10.5988 10.5988 10.9255 10.9255 10.9804 10.9804 k = 0.1273-0.0900 0.1559 ( 3933 PWs) bands (ev): -27.9249 -27.9249 -24.5103 -24.5103 -24.4830 -24.4830 -24.4770 -24.4770 -23.1015 -23.1015 -23.0742 -23.0742 -12.4202 -12.4202 -8.5802 -8.5802 -8.3581 -8.3581 -8.3468 -8.3468 -5.8381 -5.8381 -5.8266 -5.8266 -5.7942 -5.7942 -5.4818 -5.4818 -5.2327 -5.2327 -3.4206 -3.4206 -3.4005 -3.4005 -3.3748 -3.3748 -3.3265 -3.3265 -3.2146 -3.2146 -3.1791 -3.1791 -2.0506 -2.0506 -2.0214 -2.0214 -1.9972 -1.9972 5.1927 5.1927 8.8815 8.8815 10.5599 10.5599 10.9260 10.9260 10.9817 10.9817 k = 0.1364-0.0964 0.1670 ( 3921 PWs) bands (ev): -27.9237 -27.9237 -24.5135 -24.5135 -24.4833 -24.4833 -24.4772 -24.4772 -23.1022 -23.1022 -23.0719 -23.0719 -12.4098 -12.4098 -8.6038 -8.6038 -8.3577 -8.3577 -8.3464 -8.3464 -5.8385 -5.8385 -5.8264 -5.8264 -5.7917 -5.7917 -5.4849 -5.4849 -5.2092 -5.2092 -3.4128 -3.4128 -3.3917 -3.3917 -3.3655 -3.3655 -3.3440 -3.3440 -3.2206 -3.2206 -3.1840 -3.1840 -2.0547 -2.0547 -2.0260 -2.0260 -1.9986 -1.9986 5.2273 5.2273 8.9064 8.9064 10.5216 10.5216 10.9265 10.9265 10.9828 10.9828 k = 0.1455-0.1029 0.1781 ( 3929 PWs) bands (ev): -27.9225 -27.9225 -24.5168 -24.5168 -24.4836 -24.4836 -24.4774 -24.4774 -23.1029 -23.1029 -23.0697 -23.0697 -12.3993 -12.3993 -8.6269 -8.6269 -8.3574 -8.3574 -8.3460 -8.3460 -5.8386 -5.8386 -5.8261 -5.8261 -5.7890 -5.7890 -5.4882 -5.4882 -5.1864 -5.1864 -3.4047 -3.4047 -3.3851 -3.3851 -3.3599 -3.3599 -3.3562 -3.3562 -3.2266 -3.2266 -3.1891 -3.1891 -2.0590 -2.0590 -2.0306 -2.0306 -2.0001 -2.0001 5.2626 5.2626 8.9326 8.9326 10.4846 10.4846 10.9270 10.9270 10.9837 10.9837 k = 0.1545-0.1093 0.1893 ( 3929 PWs) bands (ev): -27.9213 -27.9213 -24.5199 -24.5199 -24.4838 -24.4838 -24.4776 -24.4776 -23.1037 -23.1037 -23.0676 -23.0676 -12.3887 -12.3887 -8.6492 -8.6492 -8.3570 -8.3570 -8.3456 -8.3456 -5.8385 -5.8385 -5.8257 -5.8257 -5.7861 -5.7861 -5.4916 -5.4916 -5.1646 -5.1646 -3.3964 -3.3964 -3.3898 -3.3898 -3.3652 -3.3652 -3.3471 -3.3471 -3.2325 -3.2325 -3.1943 -3.1943 -2.0633 -2.0633 -2.0352 -2.0352 -2.0015 -2.0015 5.2983 5.2983 8.9601 8.9601 10.4494 10.4494 10.9272 10.9272 10.9844 10.9844 k = 0.1636-0.1157 0.2004 ( 3920 PWs) bands (ev): -27.9201 -27.9201 -24.5229 -24.5229 -24.4841 -24.4841 -24.4778 -24.4778 -23.1044 -23.1044 -23.0657 -23.0657 -12.3782 -12.3782 -8.6704 -8.6704 -8.3566 -8.3566 -8.3452 -8.3452 -5.8382 -5.8382 -5.8250 -5.8250 -5.7830 -5.7830 -5.4950 -5.4950 -5.1442 -5.1442 -3.4062 -3.4062 -3.3878 -3.3878 -3.3595 -3.3595 -3.3384 -3.3384 -3.2380 -3.2380 -3.1993 -3.1993 -2.0675 -2.0675 -2.0398 -2.0398 -2.0030 -2.0030 5.3341 5.3341 8.9888 8.9888 10.4167 10.4167 10.9273 10.9273 10.9849 10.9849 k = 0.1727-0.1221 0.2115 ( 3924 PWs) bands (ev): -27.9189 -27.9189 -24.5258 -24.5258 -24.4843 -24.4843 -24.4780 -24.4780 -23.1052 -23.1052 -23.0639 -23.0639 -12.3677 -12.3677 -8.6902 -8.6902 -8.3562 -8.3562 -8.3448 -8.3448 -5.8376 -5.8376 -5.8242 -5.8242 -5.7797 -5.7797 -5.4986 -5.4986 -5.1253 -5.1253 -3.4246 -3.4246 -3.3790 -3.3790 -3.3526 -3.3526 -3.3304 -3.3304 -3.2430 -3.2430 -3.2040 -3.2040 -2.0717 -2.0717 -2.0442 -2.0442 -2.0045 -2.0045 5.3697 5.3697 9.0187 9.0187 10.3869 10.3869 10.9271 10.9271 10.9850 10.9850 k = 0.1818-0.1286 0.2227 ( 3916 PWs) bands (ev): -27.9177 -27.9177 -24.5285 -24.5285 -24.4846 -24.4846 -24.4782 -24.4782 -23.1061 -23.1061 -23.0624 -23.0624 -12.3575 -12.3575 -8.7085 -8.7085 -8.3559 -8.3559 -8.3445 -8.3445 -5.8366 -5.8366 -5.8230 -5.8230 -5.7762 -5.7762 -5.5022 -5.5022 -5.1084 -5.1084 -3.4433 -3.4433 -3.3701 -3.3701 -3.3465 -3.3465 -3.3233 -3.3233 -3.2470 -3.2470 -3.2082 -3.2082 -2.0757 -2.0757 -2.0485 -2.0485 -2.0060 -2.0060 5.4046 5.4046 9.0497 9.0497 10.3605 10.3605 10.9265 10.9265 10.9847 10.9847 k = 0.1909-0.1350 0.2338 ( 3932 PWs) bands (ev): -27.9166 -27.9166 -24.5309 -24.5309 -24.4849 -24.4849 -24.4785 -24.4785 -23.1069 -23.1069 -23.0611 -23.0611 -12.3477 -12.3477 -8.7250 -8.7250 -8.3555 -8.3555 -8.3441 -8.3441 -5.8354 -5.8354 -5.8215 -5.8215 -5.7727 -5.7727 -5.5059 -5.5059 -5.0935 -5.0935 -3.4618 -3.4618 -3.3611 -3.3611 -3.3422 -3.3422 -3.3177 -3.3177 -3.2496 -3.2496 -3.2113 -3.2113 -2.0796 -2.0796 -2.0526 -2.0526 -2.0075 -2.0075 5.4387 5.4387 9.0820 9.0820 10.3380 10.3380 10.9255 10.9255 10.9840 10.9840 k = 0.2000-0.1414 0.2449 ( 3932 PWs) bands (ev): -27.9154 -27.9154 -24.5331 -24.5331 -24.4851 -24.4851 -24.4787 -24.4787 -23.1078 -23.1078 -23.0601 -23.0601 -12.3382 -12.3382 -8.7396 -8.7396 -8.3552 -8.3552 -8.3438 -8.3438 -5.8337 -5.8337 -5.8198 -5.8198 -5.7689 -5.7689 -5.5097 -5.5097 -5.0811 -5.0811 -3.4797 -3.4797 -3.3522 -3.3522 -3.3403 -3.3403 -3.3139 -3.3139 -3.2503 -3.2503 -3.2131 -3.2131 -2.0833 -2.0833 -2.0564 -2.0564 -2.0090 -2.0090 5.4716 5.4716 9.1154 9.1154 10.3197 10.3197 10.9242 10.9242 10.9829 10.9829 k = 0.2091-0.1478 0.2561 ( 3924 PWs) bands (ev): -27.9142 -27.9142 -24.5351 -24.5351 -24.4854 -24.4854 -24.4789 -24.4789 -23.1087 -23.1087 -23.0594 -23.0594 -12.3293 -12.3293 -8.7520 -8.7520 -8.3548 -8.3548 -8.3434 -8.3434 -5.8318 -5.8318 -5.8177 -5.8177 -5.7651 -5.7651 -5.5134 -5.5134 -5.0711 -5.0711 -3.4969 -3.4969 -3.3436 -3.3436 -3.3412 -3.3412 -3.3119 -3.3119 -3.2489 -3.2489 -3.2132 -3.2132 -2.0867 -2.0867 -2.0599 -2.0599 -2.0105 -2.0105 5.5029 5.5029 9.1502 9.1502 10.3060 10.3060 10.9224 10.9224 10.9813 10.9813 k = 0.2182-0.1543 0.2672 ( 3920 PWs) bands (ev): -27.9131 -27.9131 -24.5367 -24.5367 -24.4856 -24.4856 -24.4791 -24.4791 -23.1096 -23.1096 -23.0589 -23.0589 -12.3209 -12.3209 -8.7622 -8.7622 -8.3545 -8.3545 -8.3431 -8.3431 -5.8294 -5.8294 -5.8152 -5.8152 -5.7612 -5.7612 -5.5172 -5.5172 -5.0640 -5.0640 -3.5132 -3.5132 -3.3447 -3.3447 -3.3362 -3.3362 -3.3112 -3.3112 -3.2454 -3.2454 -3.2115 -3.2115 -2.0898 -2.0898 -2.0631 -2.0631 -2.0120 -2.0120 5.5324 5.5324 9.1865 9.1865 10.2970 10.2970 10.9200 10.9200 10.9792 10.9792 k = 0.2273-0.1607 0.2784 ( 3928 PWs) bands (ev): -27.9120 -27.9120 -24.5380 -24.5380 -24.4859 -24.4859 -24.4794 -24.4794 -23.1105 -23.1105 -23.0588 -23.0588 -12.3132 -12.3132 -8.7700 -8.7700 -8.3542 -8.3542 -8.3428 -8.3428 -5.8267 -5.8267 -5.8124 -5.8124 -5.7573 -5.7573 -5.5210 -5.5210 -5.0596 -5.0596 -3.5286 -3.5286 -3.3506 -3.3506 -3.3321 -3.3321 -3.3096 -3.3096 -3.2403 -3.2403 -3.2081 -3.2081 -2.0925 -2.0925 -2.0660 -2.0660 -2.0135 -2.0135 5.5598 5.5598 9.2244 9.2244 10.2929 10.2929 10.9172 10.9172 10.9765 10.9765 k = 0.2364-0.1671 0.2895 ( 3936 PWs) bands (ev): -27.9110 -27.9110 -24.5391 -24.5391 -24.4861 -24.4861 -24.4796 -24.4796 -23.1114 -23.1114 -23.0590 -23.0590 -12.3061 -12.3061 -8.7754 -8.7754 -8.3539 -8.3539 -8.3426 -8.3426 -5.8235 -5.8235 -5.8092 -5.8092 -5.7532 -5.7532 -5.5248 -5.5248 -5.0583 -5.0583 -3.5428 -3.5428 -3.3583 -3.3583 -3.3334 -3.3334 -3.3045 -3.3045 -3.2342 -3.2342 -3.2034 -3.2034 -2.0949 -2.0949 -2.0684 -2.0684 -2.0150 -2.0150 5.5849 5.5849 9.2640 9.2640 10.2936 10.2936 10.9138 10.9138 10.9732 10.9732 k = 0.2455-0.1736 0.3006 ( 3928 PWs) bands (ev): -27.9100 -27.9100 -24.5397 -24.5397 -24.4864 -24.4864 -24.4799 -24.4799 -23.1123 -23.1123 -23.0596 -23.0596 -12.2999 -12.2999 -8.7782 -8.7782 -8.3537 -8.3537 -8.3423 -8.3423 -5.8200 -5.8200 -5.8057 -5.8057 -5.7491 -5.7491 -5.5285 -5.5285 -5.0599 -5.0599 -3.5559 -3.5559 -3.3674 -3.3674 -3.3392 -3.3392 -3.2968 -3.2968 -3.2275 -3.2275 -3.1979 -3.1979 -2.0969 -2.0969 -2.0705 -2.0705 -2.0165 -2.0165 5.6075 5.6075 9.3057 9.3057 10.2992 10.2992 10.9098 10.9098 10.9693 10.9693 k = 0.2545-0.1800 0.3118 ( 3928 PWs) bands (ev): -27.9090 -27.9090 -24.5400 -24.5400 -24.4866 -24.4866 -24.4801 -24.4801 -23.1132 -23.1132 -23.0605 -23.0605 -12.2944 -12.2944 -8.7784 -8.7784 -8.3535 -8.3535 -8.3421 -8.3421 -5.8161 -5.8161 -5.8018 -5.8018 -5.7451 -5.7451 -5.5323 -5.5323 -5.0645 -5.0645 -3.5678 -3.5678 -3.3775 -3.3775 -3.3474 -3.3474 -3.2880 -3.2880 -3.2205 -3.2205 -3.1918 -3.1918 -2.0985 -2.0985 -2.0721 -2.0721 -2.0180 -2.0180 5.6274 5.6274 9.3496 9.3496 10.3095 10.3095 10.9053 10.9053 10.9648 10.9648 k = 0.2636-0.1864 0.3229 ( 3936 PWs) bands (ev): -27.9081 -27.9081 -24.5399 -24.5399 -24.4869 -24.4869 -24.4804 -24.4804 -23.1142 -23.1142 -23.0617 -23.0617 -12.2897 -12.2897 -8.7760 -8.7760 -8.3533 -8.3533 -8.3419 -8.3419 -5.8118 -5.8118 -5.7975 -5.7975 -5.7409 -5.7409 -5.5359 -5.5359 -5.0720 -5.0720 -3.5785 -3.5785 -3.3886 -3.3886 -3.3571 -3.3571 -3.2788 -3.2788 -3.2134 -3.2134 -3.1854 -3.1854 -2.0997 -2.0997 -2.0732 -2.0732 -2.0194 -2.0194 5.6446 5.6446 9.3960 9.3960 10.3243 10.3243 10.9002 10.9002 10.9597 10.9597 k = 0.2727-0.1928 0.3340 ( 3936 PWs) bands (ev): -27.9073 -27.9073 -24.5395 -24.5395 -24.4871 -24.4871 -24.4806 -24.4806 -23.1151 -23.1151 -23.0632 -23.0632 -12.2858 -12.2858 -8.7711 -8.7711 -8.3531 -8.3531 -8.3418 -8.3418 -5.8072 -5.8072 -5.7929 -5.7929 -5.7368 -5.7368 -5.5395 -5.5395 -5.0825 -5.0825 -3.5880 -3.5880 -3.4002 -3.4002 -3.3680 -3.3680 -3.2695 -3.2695 -3.2064 -3.2064 -3.1791 -3.1791 -2.1004 -2.1004 -2.0739 -2.0739 -2.0208 -2.0208 5.6591 5.6591 9.4450 9.4450 10.3433 10.3433 10.8945 10.8945 10.9540 10.9540 k = 0.2818-0.1993 0.3452 ( 3932 PWs) bands (ev): -27.9065 -27.9065 -24.5388 -24.5388 -24.4874 -24.4874 -24.4809 -24.4809 -23.1160 -23.1160 -23.0650 -23.0650 -12.2828 -12.2828 -8.7636 -8.7636 -8.3530 -8.3530 -8.3416 -8.3416 -5.8022 -5.8022 -5.7880 -5.7880 -5.7327 -5.7327 -5.5431 -5.5431 -5.0957 -5.0957 -3.5964 -3.5964 -3.4125 -3.4125 -3.3796 -3.3796 -3.2602 -3.2602 -3.1997 -3.1997 -3.1727 -3.1727 -2.1008 -2.1008 -2.0742 -2.0742 -2.0222 -2.0222 5.6707 5.6707 9.4969 9.4969 10.3662 10.3662 10.8883 10.8883 10.9478 10.9478 k = 0.2909-0.2057 0.3563 ( 3928 PWs) bands (ev): -27.9058 -27.9058 -24.5377 -24.5377 -24.4876 -24.4876 -24.4811 -24.4811 -23.1169 -23.1169 -23.0672 -23.0672 -12.2806 -12.2806 -8.7537 -8.7537 -8.3528 -8.3528 -8.3415 -8.3415 -5.7969 -5.7969 -5.7828 -5.7828 -5.7287 -5.7287 -5.5466 -5.5466 -5.1115 -5.1115 -3.6037 -3.6037 -3.4251 -3.4251 -3.3919 -3.3919 -3.2509 -3.2509 -3.1932 -3.1932 -3.1666 -3.1666 -2.1008 -2.1008 -2.0741 -2.0741 -2.0235 -2.0235 5.6797 5.6797 9.5518 9.5518 10.3927 10.3927 10.8817 10.8817 10.9410 10.9410 k = 0.3000-0.2121 0.3674 ( 3928 PWs) bands (ev): -27.9051 -27.9051 -24.5363 -24.5363 -24.4878 -24.4878 -24.4814 -24.4814 -23.1178 -23.1178 -23.0696 -23.0696 -12.2791 -12.2791 -8.7415 -8.7415 -8.3527 -8.3527 -8.3414 -8.3414 -5.7913 -5.7913 -5.7773 -5.7773 -5.7246 -5.7246 -5.5499 -5.5499 -5.1298 -5.1298 -3.6101 -3.6101 -3.4381 -3.4381 -3.4046 -3.4046 -3.2418 -3.2418 -3.1871 -3.1871 -3.1607 -3.1607 -2.1004 -2.1004 -2.0736 -2.0736 -2.0248 -2.0248 5.6861 5.6861 9.6097 9.6097 10.4225 10.4225 10.8745 10.8745 10.9337 10.9337 k = 0.3091-0.2186 0.3786 ( 3920 PWs) bands (ev): -27.9045 -27.9045 -24.5346 -24.5346 -24.4880 -24.4880 -24.4816 -24.4816 -23.1187 -23.1187 -23.0723 -23.0723 -12.2784 -12.2784 -8.7271 -8.7271 -8.3527 -8.3527 -8.3414 -8.3414 -5.7854 -5.7854 -5.7716 -5.7716 -5.7206 -5.7206 -5.5532 -5.5532 -5.1503 -5.1503 -3.6155 -3.6155 -3.4513 -3.4513 -3.4177 -3.4177 -3.2328 -3.2328 -3.1814 -3.1814 -3.1552 -3.1552 -2.0996 -2.0996 -2.0727 -2.0727 -2.0261 -2.0261 5.6900 5.6900 9.6706 9.6706 10.4553 10.4553 10.8670 10.8670 10.9259 10.9259 k = 0.3182-0.2250 0.3897 ( 3924 PWs) bands (ev): -27.9040 -27.9040 -24.5327 -24.5327 -24.4882 -24.4882 -24.4818 -24.4818 -23.1195 -23.1195 -23.0753 -23.0753 -12.2784 -12.2784 -8.7106 -8.7106 -8.3526 -8.3526 -8.3413 -8.3413 -5.7793 -5.7793 -5.7657 -5.7657 -5.7167 -5.7167 -5.5564 -5.5564 -5.1728 -5.1728 -3.6202 -3.6202 -3.4647 -3.4647 -3.4311 -3.4311 -3.2241 -3.2241 -3.1760 -3.1760 -3.1499 -3.1499 -2.0985 -2.0985 -2.0714 -2.0714 -2.0273 -2.0273 5.6916 5.6916 9.7344 9.7344 10.4906 10.4906 10.8592 10.8592 10.9177 10.9177 k = 0.3273-0.2314 0.4008 ( 3924 PWs) bands (ev): -27.9035 -27.9035 -24.5305 -24.5305 -24.4884 -24.4884 -24.4821 -24.4821 -23.1203 -23.1203 -23.0784 -23.0784 -12.2790 -12.2790 -8.6923 -8.6923 -8.3526 -8.3526 -8.3413 -8.3413 -5.7730 -5.7730 -5.7596 -5.7596 -5.7128 -5.7128 -5.5594 -5.5594 -5.1970 -5.1970 -3.6242 -3.6242 -3.4781 -3.4781 -3.4446 -3.4446 -3.2157 -3.2157 -3.1711 -3.1711 -3.1450 -3.1450 -2.0971 -2.0971 -2.0698 -2.0698 -2.0284 -2.0284 5.6911 5.6911 9.8010 9.8010 10.5283 10.5283 10.8511 10.8511 10.9092 10.9092 k = 0.3364-0.2378 0.4120 ( 3936 PWs) bands (ev): -27.9031 -27.9031 -24.5281 -24.5281 -24.4886 -24.4886 -24.4823 -24.4823 -23.1211 -23.1211 -23.0817 -23.0817 -12.2802 -12.2802 -8.6723 -8.6723 -8.3526 -8.3526 -8.3413 -8.3413 -5.7666 -5.7666 -5.7535 -5.7535 -5.7090 -5.7090 -5.5623 -5.5623 -5.2227 -5.2227 -3.6277 -3.6277 -3.4915 -3.4915 -3.4583 -3.4583 -3.2075 -3.2075 -3.1665 -3.1665 -3.1404 -3.1404 -2.0955 -2.0955 -2.0680 -2.0680 -2.0295 -2.0295 5.6888 5.6888 9.8701 9.8701 10.5681 10.5681 10.8429 10.8429 10.9004 10.9004 k = 0.3455-0.2443 0.4231 ( 3920 PWs) bands (ev): -27.9027 -27.9027 -24.5255 -24.5255 -24.4888 -24.4888 -24.4825 -24.4825 -23.1219 -23.1219 -23.0852 -23.0852 -12.2820 -12.2820 -8.6508 -8.6508 -8.3525 -8.3525 -8.3413 -8.3413 -5.7601 -5.7601 -5.7473 -5.7473 -5.7052 -5.7052 -5.5651 -5.5651 -5.2495 -5.2495 -3.6307 -3.6307 -3.5047 -3.5047 -3.4719 -3.4719 -3.1996 -3.1996 -3.1623 -3.1623 -3.1361 -3.1361 -2.0937 -2.0937 -2.0659 -2.0659 -2.0305 -2.0305 5.6849 5.6849 9.9414 9.9414 10.6098 10.6098 10.8348 10.8348 10.8915 10.8915 k = 0.3545-0.2507 0.4342 ( 3912 PWs) bands (ev): -27.9023 -27.9023 -24.5227 -24.5227 -24.4889 -24.4889 -24.4827 -24.4827 -23.1226 -23.1226 -23.0887 -23.0887 -12.2841 -12.2841 -8.6282 -8.6282 -8.3525 -8.3525 -8.3413 -8.3413 -5.7536 -5.7536 -5.7411 -5.7411 -5.7015 -5.7015 -5.5678 -5.5678 -5.2772 -5.2772 -3.6334 -3.6334 -3.5176 -3.5176 -3.4853 -3.4853 -3.1921 -3.1921 -3.1584 -3.1584 -3.1322 -3.1322 -2.0917 -2.0917 -2.0636 -2.0636 -2.0314 -2.0314 5.6797 5.6797 10.0144 10.0144 10.6530 10.6530 10.8270 10.8270 10.8825 10.8825 k = 0.3636-0.2571 0.4454 ( 3916 PWs) bands (ev): -27.9021 -27.9021 -24.5199 -24.5199 -24.4890 -24.4890 -24.4829 -24.4829 -23.1233 -23.1233 -23.0924 -23.0924 -12.2866 -12.2866 -8.6046 -8.6046 -8.3525 -8.3525 -8.3414 -8.3414 -5.7470 -5.7470 -5.7351 -5.7351 -5.6978 -5.6978 -5.5703 -5.5703 -5.3054 -5.3054 -3.6359 -3.6359 -3.5302 -3.5302 -3.4986 -3.4986 -3.1850 -3.1850 -3.1549 -3.1549 -3.1285 -3.1285 -2.0896 -2.0896 -2.0612 -2.0612 -2.0322 -2.0322 5.6734 5.6734 10.0884 10.0884 10.6975 10.6975 10.8201 10.8201 10.8734 10.8734 k = 0.3727-0.2636 0.4565 ( 3916 PWs) bands (ev): -27.9018 -27.9018 -24.5170 -24.5170 -24.4891 -24.4891 -24.4831 -24.4831 -23.1240 -23.1240 -23.0961 -23.0961 -12.2894 -12.2894 -8.5804 -8.5804 -8.3526 -8.3526 -8.3414 -8.3414 -5.7405 -5.7405 -5.7292 -5.7292 -5.6942 -5.6942 -5.5726 -5.5726 -5.3340 -5.3340 -3.6382 -3.6382 -3.5422 -3.5422 -3.5116 -3.5116 -3.1783 -3.1783 -3.1518 -3.1518 -3.1252 -3.1252 -2.0875 -2.0875 -2.0587 -2.0587 -2.0329 -2.0329 5.6662 5.6662 10.1628 10.1628 10.7413 10.7413 10.8163 10.8163 10.8644 10.8644 k = 0.3818-0.2700 0.4676 ( 3916 PWs) bands (ev): -27.9016 -27.9016 -24.5141 -24.5141 -24.4892 -24.4892 -24.4832 -24.4832 -23.1247 -23.1247 -23.0997 -23.0997 -12.2924 -12.2924 -8.5559 -8.5559 -8.3526 -8.3526 -8.3415 -8.3415 -5.7342 -5.7342 -5.7235 -5.7235 -5.6907 -5.6907 -5.5748 -5.5748 -5.3624 -5.3624 -3.6406 -3.6406 -3.5536 -3.5536 -3.5242 -3.5242 -3.1720 -3.1720 -3.1490 -3.1490 -3.1221 -3.1221 -2.0854 -2.0854 -2.0561 -2.0561 -2.0336 -2.0336 5.6585 5.6585 10.2366 10.2366 10.7742 10.7742 10.8261 10.8261 10.8556 10.8556 k = 0.3909-0.2764 0.4788 ( 3920 PWs) bands (ev): -27.9015 -27.9015 -24.5112 -24.5112 -24.4892 -24.4892 -24.4834 -24.4834 -23.1253 -23.1253 -23.1034 -23.1034 -12.2956 -12.2956 -8.5314 -8.5314 -8.3526 -8.3526 -8.3415 -8.3415 -5.7281 -5.7281 -5.7182 -5.7182 -5.6872 -5.6872 -5.5769 -5.5769 -5.3905 -5.3905 -3.6430 -3.6430 -3.5643 -3.5643 -3.5363 -3.5363 -3.1662 -3.1662 -3.1465 -3.1465 -3.1192 -3.1192 -2.0833 -2.0833 -2.0535 -2.0535 -2.0341 -2.0341 5.6503 5.6503 10.3087 10.3087 10.7810 10.7810 10.8471 10.8471 10.8656 10.8656 k = 0.4000-0.2828 0.4899 ( 3924 PWs) bands (ev): -27.9013 -27.9013 -24.5084 -24.5084 -24.4892 -24.4892 -24.4836 -24.4836 -23.1258 -23.1258 -23.1069 -23.1069 -12.2988 -12.2988 -8.5072 -8.5072 -8.3526 -8.3526 -8.3416 -8.3416 -5.7222 -5.7222 -5.7133 -5.7133 -5.6837 -5.6837 -5.5788 -5.5788 -5.4179 -5.4179 -3.6456 -3.6456 -3.5740 -3.5740 -3.5478 -3.5478 -3.1608 -3.1608 -3.1442 -3.1442 -3.1166 -3.1166 -2.0812 -2.0812 -2.0509 -2.0509 -2.0345 -2.0345 5.6420 5.6420 10.3778 10.3778 10.7777 10.7777 10.8388 10.8388 10.9196 10.9196 k = 0.4091-0.2893 0.5010 ( 3920 PWs) bands (ev): -27.9012 -27.9012 -24.5057 -24.5057 -24.4890 -24.4890 -24.4837 -24.4837 -23.1264 -23.1264 -23.1103 -23.1103 -12.3019 -12.3019 -8.4836 -8.4836 -8.3526 -8.3526 -8.3417 -8.3417 -5.7166 -5.7166 -5.7087 -5.7087 -5.6803 -5.6803 -5.5805 -5.5805 -5.4442 -5.4442 -3.6485 -3.6485 -3.5827 -3.5827 -3.5587 -3.5587 -3.1559 -3.1559 -3.1422 -3.1422 -3.1142 -3.1142 -2.0793 -2.0793 -2.0484 -2.0484 -2.0348 -2.0348 5.6338 5.6338 10.4427 10.4427 10.7726 10.7726 10.8310 10.8310 10.9803 10.9803 k = 0.4182-0.2957 0.5122 ( 3928 PWs) bands (ev): -27.9012 -27.9012 -24.5033 -24.5033 -24.4888 -24.4888 -24.4838 -24.4838 -23.1268 -23.1268 -23.1135 -23.1135 -12.3051 -12.3051 -8.4610 -8.4610 -8.3526 -8.3526 -8.3418 -8.3418 -5.7114 -5.7114 -5.7047 -5.7047 -5.6769 -5.6769 -5.5820 -5.5820 -5.4693 -5.4693 -3.6516 -3.6516 -3.5903 -3.5903 -3.5688 -3.5688 -3.1515 -3.1515 -3.1405 -3.1405 -3.1119 -3.1119 -2.0775 -2.0775 -2.0461 -2.0461 -2.0350 -2.0350 5.6258 5.6258 10.5019 10.5019 10.7678 10.7678 10.8238 10.8238 11.0469 11.0469 k = 0.4273-0.3021 0.5233 ( 3936 PWs) bands (ev): -27.9011 -27.9011 -24.5011 -24.5011 -24.4885 -24.4885 -24.4840 -24.4840 -23.1273 -23.1273 -23.1165 -23.1165 -12.3080 -12.3080 -8.4397 -8.4397 -8.3525 -8.3525 -8.3418 -8.3418 -5.7066 -5.7066 -5.7011 -5.7011 -5.6736 -5.6736 -5.5834 -5.5834 -5.4926 -5.4926 -3.6551 -3.6551 -3.5966 -3.5966 -3.5781 -3.5781 -3.1477 -3.1477 -3.1390 -3.1390 -3.1099 -3.1099 -2.0759 -2.0759 -2.0439 -2.0439 -2.0351 -2.0351 5.6182 5.6182 10.5544 10.5544 10.7637 10.7637 10.8170 10.8170 11.1194 11.1194 k = 0.4364-0.3086 0.5344 ( 3924 PWs) bands (ev): -27.9010 -27.9010 -24.4992 -24.4992 -24.4881 -24.4881 -24.4840 -24.4840 -23.1277 -23.1277 -23.1193 -23.1193 -12.3108 -12.3108 -8.4201 -8.4201 -8.3524 -8.3524 -8.3419 -8.3419 -5.7023 -5.7023 -5.6981 -5.6981 -5.6705 -5.6705 -5.5846 -5.5846 -5.5140 -5.5140 -3.6587 -3.6587 -3.6018 -3.6018 -3.5865 -3.5865 -3.1443 -3.1443 -3.1377 -3.1377 -3.1081 -3.1081 -2.0744 -2.0744 -2.0418 -2.0418 -2.0352 -2.0352 5.6112 5.6112 10.5992 10.5992 10.7611 10.7611 10.8110 10.8110 11.1976 11.1976 k = 0.4455-0.3150 0.5456 ( 3928 PWs) bands (ev): -27.9010 -27.9010 -24.4978 -24.4978 -24.4875 -24.4875 -24.4841 -24.4841 -23.1280 -23.1280 -23.1217 -23.1217 -12.3133 -12.3133 -8.4026 -8.4026 -8.3521 -8.3521 -8.3420 -8.3420 -5.6986 -5.6986 -5.6955 -5.6955 -5.6676 -5.6676 -5.5857 -5.5857 -5.5331 -5.5331 -3.6624 -3.6624 -3.6059 -3.6059 -3.5939 -3.5939 -3.1414 -3.1414 -3.1366 -3.1366 -3.1064 -3.1064 -2.0732 -2.0732 -2.0400 -2.0400 -2.0351 -2.0351 5.6048 5.6048 10.6354 10.6354 10.7606 10.7606 10.8056 10.8056 11.2812 11.2812 k = 0.4545-0.3214 0.5567 ( 3920 PWs) bands (ev): -27.9009 -27.9009 -24.4967 -24.4967 -24.4868 -24.4868 -24.4842 -24.4842 -23.1283 -23.1283 -23.1239 -23.1239 -12.3154 -12.3154 -8.3875 -8.3875 -8.3515 -8.3515 -8.3420 -8.3420 -5.6955 -5.6955 -5.6933 -5.6933 -5.6651 -5.6651 -5.5866 -5.5866 -5.5497 -5.5497 -3.6659 -3.6659 -3.6091 -3.6091 -3.6003 -3.6003 -3.1390 -3.1390 -3.1357 -3.1357 -3.1050 -3.1050 -2.0721 -2.0721 -2.0384 -2.0384 -2.0350 -2.0350 5.5993 5.5993 10.6626 10.6626 10.7630 10.7630 10.8009 10.8009 11.3694 11.3694 k = 0.4636-0.3278 0.5678 ( 3912 PWs) bands (ev): -27.9009 -27.9009 -24.4959 -24.4959 -24.4861 -24.4861 -24.4843 -24.4843 -23.1285 -23.1285 -23.1256 -23.1256 -12.3173 -12.3173 -8.3753 -8.3753 -8.3505 -8.3505 -8.3420 -8.3420 -5.6929 -5.6929 -5.6916 -5.6916 -5.6629 -5.6629 -5.5872 -5.5872 -5.5635 -5.5635 -3.6690 -3.6690 -3.6115 -3.6115 -3.6056 -3.6056 -3.1371 -3.1371 -3.1350 -3.1350 -3.1038 -3.1038 -2.0713 -2.0713 -2.0370 -2.0370 -2.0349 -2.0349 5.5946 5.5946 10.6807 10.6807 10.7685 10.7685 10.7971 10.7971 11.4612 11.4612 k = 0.4727-0.3343 0.5790 ( 3892 PWs) bands (ev): -27.9009 -27.9009 -24.4953 -24.4953 -24.4854 -24.4854 -24.4843 -24.4843 -23.1287 -23.1287 -23.1270 -23.1270 -12.3187 -12.3187 -8.3667 -8.3667 -8.3486 -8.3486 -8.3421 -8.3421 -5.6910 -5.6910 -5.6903 -5.6903 -5.6611 -5.6611 -5.5878 -5.5878 -5.5744 -5.5744 -3.6717 -3.6717 -3.6132 -3.6132 -3.6098 -3.6098 -3.1356 -3.1356 -3.1344 -3.1344 -3.1028 -3.1028 -2.0707 -2.0707 -2.0360 -2.0360 -2.0348 -2.0348 5.5909 5.5909 10.6912 10.6912 10.7760 10.7760 10.7940 10.7940 11.5551 11.5551 k = 0.4818-0.3407 0.5901 ( 3884 PWs) bands (ev): -27.9008 -27.9008 -24.4950 -24.4950 -24.4848 -24.4848 -24.4843 -24.4843 -23.1288 -23.1288 -23.1281 -23.1281 -12.3198 -12.3198 -8.3619 -8.3619 -8.3457 -8.3457 -8.3421 -8.3421 -5.6897 -5.6897 -5.6894 -5.6894 -5.6597 -5.6597 -5.5882 -5.5882 -5.5822 -5.5822 -3.6736 -3.6736 -3.6144 -3.6144 -3.6128 -3.6128 -3.1346 -3.1346 -3.1340 -3.1340 -3.1022 -3.1022 -2.0702 -2.0702 -2.0352 -2.0352 -2.0347 -2.0347 5.5882 5.5882 10.6967 10.6967 10.7833 10.7833 10.7918 10.7918 11.6482 11.6482 k = 0.4909-0.3471 0.6012 ( 3884 PWs) bands (ev): -27.9008 -27.9008 -24.4948 -24.4948 -24.4845 -24.4845 -24.4844 -24.4844 -23.1289 -23.1289 -23.1287 -23.1287 -12.3204 -12.3204 -8.3598 -8.3598 -8.3431 -8.3431 -8.3421 -8.3421 -5.6889 -5.6889 -5.6888 -5.6888 -5.6589 -5.6589 -5.5884 -5.5884 -5.5869 -5.5869 -3.6749 -3.6749 -3.6150 -3.6150 -3.6146 -3.6146 -3.1339 -3.1339 -3.1338 -3.1338 -3.1017 -3.1017 -2.0699 -2.0699 -2.0347 -2.0347 -2.0346 -2.0346 5.5865 5.5865 10.6991 10.6991 10.7883 10.7883 10.7905 10.7905 11.7320 11.7320 k = 0.5000-0.3536 0.6124 ( 3884 PWs) bands (ev): -27.9008 -27.9008 -24.4948 -24.4948 -24.4844 -24.4844 -24.4843 -24.4843 -23.1289 -23.1289 -23.1289 -23.1289 -12.3206 -12.3206 -8.3593 -8.3593 -8.3421 -8.3421 -8.3421 -8.3421 -5.6887 -5.6887 -5.6887 -5.6887 -5.6587 -5.6587 -5.5885 -5.5885 -5.5884 -5.5884 -3.6753 -3.6753 -3.6152 -3.6152 -3.6152 -3.6152 -3.1337 -3.1337 -3.1337 -3.1337 -3.1016 -3.1016 -2.0698 -2.0698 -2.0346 -2.0346 -2.0346 -2.0346 5.5860 5.5860 10.6998 10.6998 10.7901 10.7901 10.7901 10.7901 11.7741 11.7741 k = 0.5000-0.3536 0.6124 ( 3884 PWs) bands (ev): -27.9008 -27.9008 -24.4948 -24.4948 -24.4844 -24.4844 -24.4843 -24.4843 -23.1289 -23.1289 -23.1289 -23.1289 -12.3206 -12.3206 -8.3593 -8.3593 -8.3421 -8.3421 -8.3421 -8.3421 -5.6887 -5.6887 -5.6887 -5.6887 -5.6587 -5.6587 -5.5885 -5.5885 -5.5884 -5.5884 -3.6753 -3.6753 -3.6152 -3.6152 -3.6152 -3.6152 -3.1337 -3.1337 -3.1337 -3.1337 -3.1016 -3.1016 -2.0698 -2.0698 -2.0346 -2.0346 -2.0346 -2.0346 5.5860 5.5860 10.6998 10.6998 10.7901 10.7901 10.7901 10.7901 11.7741 11.7741 k = 0.4872-0.3445 0.6124 ( 3884 PWs) bands (ev): -27.9008 -27.9008 -24.4948 -24.4948 -24.4844 -24.4844 -24.4844 -24.4844 -23.1289 -23.1289 -23.1287 -23.1287 -12.3204 -12.3204 -8.3598 -8.3598 -8.3429 -8.3429 -8.3424 -8.3424 -5.6890 -5.6890 -5.6887 -5.6887 -5.6589 -5.6589 -5.5880 -5.5880 -5.5873 -5.5873 -3.6749 -3.6749 -3.6151 -3.6151 -3.6146 -3.6146 -3.1339 -3.1339 -3.1338 -3.1338 -3.1017 -3.1017 -2.0699 -2.0699 -2.0347 -2.0347 -2.0347 -2.0347 5.5865 5.5865 10.6991 10.6991 10.7888 10.7888 10.7900 10.7900 11.7420 11.7420 k = 0.4744-0.3354 0.6124 ( 3884 PWs) bands (ev): -27.9008 -27.9008 -24.4950 -24.4950 -24.4847 -24.4847 -24.4845 -24.4845 -23.1286 -23.1286 -23.1282 -23.1282 -12.3198 -12.3198 -8.3615 -8.3615 -8.3452 -8.3452 -8.3430 -8.3430 -5.6901 -5.6901 -5.6890 -5.6890 -5.6597 -5.6597 -5.5867 -5.5867 -5.5837 -5.5837 -3.6737 -3.6737 -3.6145 -3.6145 -3.6127 -3.6127 -3.1346 -3.1346 -3.1340 -3.1340 -3.1021 -3.1021 -2.0702 -2.0702 -2.0351 -2.0351 -2.0348 -2.0348 5.5881 5.5881 10.6970 10.6970 10.7851 10.7851 10.7897 10.7897 11.6754 11.6754 k = 0.4615-0.3264 0.6124 ( 3900 PWs) bands (ev): -27.9009 -27.9009 -24.4953 -24.4953 -24.4852 -24.4852 -24.4846 -24.4846 -23.1283 -23.1283 -23.1274 -23.1274 -12.3187 -12.3187 -8.3645 -8.3645 -8.3490 -8.3490 -8.3439 -8.3439 -5.6919 -5.6919 -5.6896 -5.6896 -5.6609 -5.6609 -5.5844 -5.5844 -5.5777 -5.5777 -3.6717 -3.6717 -3.6136 -3.6136 -3.6095 -3.6095 -3.1356 -3.1356 -3.1344 -3.1344 -3.1028 -3.1028 -2.0706 -2.0706 -2.0357 -2.0357 -2.0351 -2.0351 5.5909 5.5909 10.6931 10.6931 10.7786 10.7786 10.7894 10.7894 11.6009 11.6009 k = 0.4487-0.3173 0.6124 ( 3914 PWs) bands (ev): -27.9009 -27.9009 -24.4957 -24.4957 -24.4858 -24.4858 -24.4847 -24.4847 -23.1278 -23.1278 -23.1263 -23.1263 -12.3172 -12.3172 -8.3691 -8.3691 -8.3543 -8.3543 -8.3447 -8.3447 -5.6946 -5.6946 -5.6905 -5.6905 -5.6623 -5.6623 -5.5812 -5.5812 -5.5694 -5.5694 -3.6692 -3.6692 -3.6121 -3.6121 -3.6050 -3.6050 -3.1372 -3.1372 -3.1348 -3.1348 -3.1038 -3.1038 -2.0713 -2.0713 -2.0365 -2.0365 -2.0355 -2.0355 5.5946 5.5946 10.6870 10.6870 10.7693 10.7693 10.7894 10.7894 11.5271 11.5271 k = 0.4359-0.3082 0.6124 ( 3920 PWs) bands (ev): -27.9009 -27.9009 -24.4963 -24.4963 -24.4866 -24.4866 -24.4848 -24.4848 -23.1272 -23.1272 -23.1249 -23.1249 -12.3153 -12.3153 -8.3753 -8.3753 -8.3608 -8.3608 -8.3453 -8.3453 -5.6981 -5.6981 -5.6920 -5.6920 -5.6636 -5.6636 -5.5771 -5.5771 -5.5586 -5.5586 -3.6664 -3.6664 -3.6099 -3.6099 -3.5994 -3.5994 -3.1391 -3.1391 -3.1355 -3.1355 -3.1049 -3.1049 -2.0721 -2.0721 -2.0376 -2.0376 -2.0360 -2.0360 5.5995 5.5995 10.6782 10.6782 10.7568 10.7568 10.7900 10.7900 11.4571 11.4571 k = 0.4231-0.2992 0.6124 ( 3926 PWs) bands (ev): -27.9010 -27.9010 -24.4971 -24.4971 -24.4875 -24.4875 -24.4850 -24.4850 -23.1264 -23.1264 -23.1232 -23.1232 -12.3130 -12.3130 -8.3833 -8.3833 -8.3686 -8.3686 -8.3458 -8.3458 -5.7026 -5.7026 -5.6943 -5.6943 -5.6648 -5.6648 -5.5719 -5.5719 -5.5457 -5.5457 -3.6634 -3.6634 -3.6068 -3.6068 -3.5926 -3.5926 -3.1415 -3.1415 -3.1362 -3.1362 -3.1062 -3.1062 -2.0731 -2.0731 -2.0389 -2.0389 -2.0366 -2.0366 5.6054 5.6054 10.6658 10.6658 10.7408 10.7408 10.7915 10.7915 11.3929 11.3929 k = 0.4103-0.2901 0.6124 ( 3924 PWs) bands (ev): -27.9010 -27.9010 -24.4980 -24.4980 -24.4885 -24.4885 -24.4851 -24.4851 -23.1256 -23.1256 -23.1212 -23.1212 -12.3103 -12.3103 -8.3928 -8.3928 -8.3775 -8.3775 -8.3461 -8.3461 -5.7081 -5.7081 -5.6974 -5.6974 -5.6656 -5.6656 -5.5658 -5.5658 -5.5305 -5.5305 -3.6605 -3.6605 -3.6027 -3.6027 -3.5847 -3.5847 -3.1444 -3.1444 -3.1371 -3.1371 -3.1077 -3.1077 -2.0743 -2.0743 -2.0403 -2.0403 -2.0373 -2.0373 5.6122 5.6122 10.6493 10.6493 10.7213 10.7213 10.7940 10.7940 11.3359 11.3359 k = 0.3974-0.2810 0.6124 ( 3920 PWs) bands (ev): -27.9010 -27.9010 -24.4991 -24.4991 -24.4896 -24.4896 -24.4852 -24.4852 -23.1245 -23.1245 -23.1189 -23.1189 -12.3072 -12.3072 -8.4039 -8.4039 -8.3875 -8.3875 -8.3463 -8.3463 -5.7145 -5.7145 -5.7014 -5.7014 -5.6659 -5.6659 -5.5588 -5.5588 -5.5132 -5.5132 -3.6581 -3.6581 -3.5973 -3.5973 -3.5757 -3.5757 -3.1477 -3.1477 -3.1381 -3.1381 -3.1093 -3.1093 -2.0756 -2.0756 -2.0420 -2.0420 -2.0381 -2.0381 5.6201 5.6201 10.6275 10.6275 10.6986 10.6986 10.7977 10.7977 11.2870 11.2870 k = 0.3846-0.2720 0.6124 ( 3924 PWs) bands (ev): -27.9010 -27.9010 -24.5005 -24.5005 -24.4908 -24.4908 -24.4853 -24.4853 -23.1234 -23.1234 -23.1164 -23.1164 -12.3038 -12.3038 -8.4163 -8.4163 -8.3984 -8.3984 -8.3464 -8.3464 -5.7218 -5.7218 -5.7062 -5.7062 -5.6657 -5.6657 -5.5509 -5.5509 -5.4939 -5.4939 -3.6562 -3.6562 -3.5906 -3.5906 -3.5658 -3.5658 -3.1516 -3.1516 -3.1391 -3.1391 -3.1110 -3.1110 -2.0772 -2.0772 -2.0438 -2.0438 -2.0390 -2.0390 5.6288 5.6288 10.5993 10.5993 10.6738 10.6738 10.8023 10.8023 11.2467 11.2467 k = 0.3718-0.2629 0.6124 ( 3924 PWs) bands (ev): -27.9010 -27.9010 -24.5020 -24.5020 -24.4921 -24.4921 -24.4854 -24.4854 -23.1222 -23.1222 -23.1137 -23.1137 -12.3000 -12.3000 -8.4299 -8.4299 -8.4103 -8.4103 -8.3465 -8.3465 -5.7300 -5.7300 -5.7117 -5.7117 -5.6652 -5.6652 -5.5421 -5.5421 -5.4728 -5.4728 -3.6550 -3.6550 -3.5825 -3.5825 -3.5550 -3.5550 -3.1559 -3.1559 -3.1403 -3.1403 -3.1127 -3.1127 -2.0790 -2.0790 -2.0458 -2.0458 -2.0400 -2.0400 5.6385 5.6385 10.5639 10.5639 10.6482 10.6482 10.8080 10.8080 11.2150 11.2150 k = 0.3590-0.2538 0.6124 ( 3920 PWs) bands (ev): -27.9010 -27.9010 -24.5038 -24.5038 -24.4934 -24.4934 -24.4854 -24.4854 -23.1209 -23.1209 -23.1107 -23.1107 -12.2958 -12.2958 -8.4446 -8.4446 -8.4230 -8.4230 -8.3465 -8.3465 -5.7388 -5.7388 -5.7177 -5.7177 -5.6643 -5.6643 -5.5326 -5.5326 -5.4501 -5.4501 -3.6545 -3.6545 -3.5733 -3.5733 -3.5434 -3.5434 -3.1606 -3.1606 -3.1416 -3.1416 -3.1145 -3.1145 -2.0810 -2.0810 -2.0479 -2.0479 -2.0410 -2.0410 5.6490 5.6490 10.5216 10.5216 10.6225 10.6225 10.8145 10.8145 11.1911 11.1911 k = 0.3462-0.2448 0.6124 ( 3906 PWs) bands (ev): -27.9010 -27.9010 -24.5057 -24.5057 -24.4947 -24.4947 -24.4854 -24.4854 -23.1195 -23.1195 -23.1076 -23.1076 -12.2914 -12.2914 -8.4601 -8.4601 -8.4365 -8.4365 -8.3465 -8.3465 -5.7483 -5.7483 -5.7243 -5.7243 -5.6631 -5.6631 -5.5224 -5.5224 -5.4258 -5.4258 -3.6545 -3.6545 -3.5630 -3.5630 -3.5311 -3.5311 -3.1657 -3.1657 -3.1429 -3.1429 -3.1163 -3.1163 -2.0832 -2.0832 -2.0501 -2.0501 -2.0422 -2.0422 5.6603 5.6603 10.4735 10.4735 10.5967 10.5967 10.8218 10.8218 11.1742 11.1742 k = 0.3333-0.2357 0.6124 ( 3906 PWs) bands (ev): -27.9010 -27.9010 -24.5078 -24.5078 -24.4960 -24.4960 -24.4854 -24.4854 -23.1180 -23.1180 -23.1043 -23.1043 -12.2867 -12.2867 -8.4763 -8.4763 -8.4507 -8.4507 -8.3464 -8.3464 -5.7584 -5.7584 -5.7312 -5.7312 -5.6618 -5.6618 -5.5115 -5.5115 -5.4003 -5.4003 -3.6552 -3.6552 -3.5518 -3.5518 -3.5183 -3.5183 -3.1712 -3.1712 -3.1443 -3.1443 -3.1181 -3.1181 -2.0856 -2.0856 -2.0524 -2.0524 -2.0434 -2.0434 5.6723 5.6723 10.4212 10.4212 10.5708 10.5708 10.8296 10.8296 11.1629 11.1629 k = 0.3205-0.2266 0.6124 ( 3908 PWs) bands (ev): -27.9010 -27.9010 -24.5101 -24.5101 -24.4974 -24.4974 -24.4854 -24.4854 -23.1165 -23.1165 -23.1008 -23.1008 -12.2817 -12.2817 -8.4932 -8.4932 -8.4655 -8.4655 -8.3464 -8.3464 -5.7690 -5.7690 -5.7383 -5.7383 -5.6603 -5.6603 -5.5002 -5.5002 -5.3735 -5.3735 -3.6564 -3.6564 -3.5399 -3.5399 -3.5049 -3.5049 -3.1771 -3.1771 -3.1458 -3.1458 -3.1199 -3.1199 -2.0882 -2.0882 -2.0547 -2.0547 -2.0447 -2.0447 5.6850 5.6850 10.3663 10.3663 10.5444 10.5444 10.8380 10.8380 11.1561 11.1561 k = 0.3077-0.2176 0.6124 ( 3912 PWs) bands (ev): -27.9011 -27.9011 -24.5124 -24.5124 -24.4988 -24.4988 -24.4853 -24.4853 -23.1149 -23.1149 -23.0972 -23.0972 -12.2766 -12.2766 -8.5106 -8.5106 -8.4809 -8.4809 -8.3463 -8.3463 -5.7799 -5.7799 -5.7457 -5.7457 -5.6587 -5.6587 -5.4883 -5.4883 -5.3458 -5.3458 -3.6580 -3.6580 -3.5274 -3.5274 -3.4911 -3.4911 -3.1832 -3.1832 -3.1473 -3.1473 -3.1217 -3.1217 -2.0911 -2.0911 -2.0571 -2.0571 -2.0460 -2.0460 5.6983 5.6983 10.3099 10.3099 10.5177 10.5177 10.8469 10.8469 11.1293 11.1293 k = 0.2949-0.2085 0.6124 ( 3922 PWs) bands (ev): -27.9011 -27.9011 -24.5149 -24.5149 -24.5003 -24.5003 -24.4853 -24.4853 -23.1133 -23.1133 -23.0935 -23.0935 -12.2712 -12.2712 -8.5282 -8.5282 -8.4967 -8.4967 -8.3462 -8.3462 -5.7911 -5.7911 -5.7532 -5.7532 -5.6570 -5.6570 -5.4762 -5.4762 -5.3172 -5.3172 -3.6601 -3.6601 -3.5144 -3.5144 -3.4770 -3.4770 -3.1896 -3.1896 -3.1489 -3.1489 -3.1235 -3.1235 -2.0941 -2.0941 -2.0595 -2.0595 -2.0474 -2.0474 5.7121 5.7121 10.2529 10.2529 10.4906 10.4906 10.8560 10.8560 11.0819 11.0819 k = 0.2821-0.1994 0.6124 ( 3918 PWs) bands (ev): -27.9011 -27.9011 -24.5175 -24.5175 -24.5017 -24.5017 -24.4852 -24.4852 -23.1116 -23.1116 -23.0898 -23.0898 -12.2656 -12.2656 -8.5460 -8.5460 -8.5128 -8.5128 -8.3460 -8.3460 -5.8024 -5.8024 -5.7608 -5.7608 -5.6551 -5.6551 -5.4637 -5.4637 -5.2879 -5.2879 -3.6626 -3.6626 -3.5012 -3.5012 -3.4628 -3.4628 -3.1962 -3.1962 -3.1505 -3.1505 -3.1253 -3.1253 -2.0974 -2.0974 -2.0619 -2.0619 -2.0488 -2.0488 5.7264 5.7264 10.1962 10.1962 10.4633 10.4633 10.8653 10.8653 11.0350 11.0350 k = 0.2692-0.1904 0.6124 ( 3918 PWs) bands (ev): -27.9011 -27.9011 -24.5201 -24.5201 -24.5032 -24.5032 -24.4851 -24.4851 -23.1099 -23.1099 -23.0860 -23.0860 -12.2600 -12.2600 -8.5639 -8.5639 -8.5292 -8.5292 -8.3459 -8.3459 -5.8139 -5.8139 -5.7683 -5.7683 -5.6533 -5.6533 -5.4510 -5.4510 -5.2582 -5.2582 -3.6655 -3.6655 -3.4877 -3.4877 -3.4484 -3.4484 -3.2029 -3.2029 -3.1521 -3.1521 -3.1270 -3.1270 -2.1008 -2.1008 -2.0643 -2.0643 -2.0503 -2.0503 5.7410 5.7410 10.1402 10.1402 10.4359 10.4359 10.8748 10.8748 10.9889 10.9889 k = 0.2564-0.1813 0.6124 ( 3914 PWs) bands (ev): -27.9011 -27.9011 -24.5227 -24.5227 -24.5046 -24.5046 -24.4849 -24.4849 -23.1082 -23.1082 -23.0821 -23.0821 -12.2542 -12.2542 -8.5818 -8.5818 -8.5457 -8.5457 -8.3458 -8.3458 -5.8254 -5.8254 -5.7758 -5.7758 -5.6513 -5.6513 -5.4382 -5.4382 -5.2282 -5.2282 -3.6688 -3.6688 -3.4742 -3.4742 -3.4341 -3.4341 -3.2097 -3.2097 -3.1537 -3.1537 -3.1287 -3.1287 -2.1044 -2.1044 -2.0667 -2.0667 -2.0517 -2.0517 5.7559 5.7559 10.0854 10.0854 10.4084 10.4084 10.8843 10.8843 10.9437 10.9437 k = 0.2436-0.1722 0.6124 ( 3914 PWs) bands (ev): -27.9011 -27.9011 -24.5254 -24.5254 -24.5060 -24.5060 -24.4848 -24.4848 -23.1065 -23.1065 -23.0783 -23.0783 -12.2483 -12.2483 -8.5995 -8.5995 -8.5622 -8.5622 -8.3456 -8.3456 -5.8368 -5.8368 -5.7832 -5.7832 -5.6494 -5.6494 -5.4254 -5.4254 -5.1980 -5.1980 -3.6724 -3.6724 -3.4606 -3.4606 -3.4198 -3.4198 -3.2166 -3.2166 -3.1553 -3.1553 -3.1303 -3.1303 -2.1081 -2.1081 -2.0690 -2.0690 -2.0532 -2.0532 5.7710 5.7710 10.0321 10.0321 10.3810 10.3810 10.8933 10.8933 10.9000 10.9000 k = 0.2308-0.1632 0.6124 ( 3912 PWs) bands (ev): -27.9012 -27.9012 -24.5280 -24.5280 -24.5075 -24.5075 -24.4847 -24.4847 -23.1048 -23.1048 -23.0745 -23.0745 -12.2425 -12.2425 -8.6168 -8.6168 -8.5786 -8.5786 -8.3455 -8.3455 -5.8481 -5.8481 -5.7904 -5.7904 -5.6474 -5.6474 -5.4126 -5.4126 -5.1679 -5.1679 -3.6763 -3.6763 -3.4472 -3.4472 -3.4058 -3.4058 -3.2234 -3.2234 -3.1569 -3.1569 -3.1318 -3.1318 -2.1119 -2.1119 -2.0713 -2.0713 -2.0547 -2.0547 5.7862 5.7862 9.9806 9.9806 10.3539 10.3539 10.8567 10.8567 10.9032 10.9032 k = 0.2179-0.1541 0.6124 ( 3920 PWs) bands (ev): -27.9012 -27.9012 -24.5307 -24.5307 -24.5089 -24.5089 -24.4845 -24.4845 -23.1031 -23.1031 -23.0708 -23.0708 -12.2367 -12.2367 -8.6339 -8.6339 -8.5949 -8.5949 -8.3453 -8.3453 -5.8593 -5.8593 -5.7974 -5.7974 -5.6455 -5.6455 -5.4000 -5.4000 -5.1380 -5.1380 -3.6805 -3.6805 -3.4340 -3.4340 -3.3922 -3.3922 -3.2301 -3.2301 -3.1585 -3.1585 -3.1333 -3.1333 -2.1157 -2.1157 -2.0735 -2.0735 -2.0562 -2.0562 5.8013 5.8013 9.9311 9.9311 10.3272 10.3272 10.8154 10.8154 10.9124 10.9124 k = 0.2051-0.1450 0.6124 ( 3932 PWs) bands (ev): -27.9012 -27.9012 -24.5332 -24.5332 -24.5102 -24.5102 -24.4844 -24.4844 -23.1015 -23.1015 -23.0671 -23.0671 -12.2309 -12.2309 -8.6505 -8.6505 -8.6108 -8.6108 -8.3452 -8.3452 -5.8701 -5.8701 -5.8041 -5.8041 -5.6435 -5.6435 -5.3876 -5.3876 -5.1084 -5.1084 -3.6850 -3.6850 -3.4210 -3.4210 -3.3789 -3.3789 -3.2367 -3.2367 -3.1601 -3.1601 -3.1347 -3.1347 -2.1196 -2.1196 -2.0757 -2.0757 -2.0576 -2.0576 5.8164 5.8164 9.8839 9.8839 10.3010 10.3010 10.7756 10.7756 10.9213 10.9213 k = 0.1923-0.1360 0.6124 ( 3930 PWs) bands (ev): -27.9012 -27.9012 -24.5357 -24.5357 -24.5116 -24.5116 -24.4843 -24.4843 -23.0999 -23.0999 -23.0635 -23.0635 -12.2252 -12.2252 -8.6664 -8.6664 -8.6264 -8.6264 -8.3450 -8.3450 -5.8806 -5.8806 -5.8106 -5.8106 -5.6416 -5.6416 -5.3755 -5.3755 -5.0794 -5.0794 -3.6897 -3.6897 -3.4085 -3.4085 -3.3662 -3.3662 -3.2430 -3.2430 -3.1617 -3.1617 -3.1360 -3.1360 -2.1235 -2.1235 -2.0779 -2.0779 -2.0591 -2.0591 5.8313 5.8313 9.8390 9.8390 10.2755 10.2755 10.7375 10.7375 10.9299 10.9299 k = 0.1795-0.1269 0.6124 ( 3936 PWs) bands (ev): -27.9013 -27.9013 -24.5381 -24.5381 -24.5129 -24.5129 -24.4841 -24.4841 -23.0983 -23.0983 -23.0600 -23.0600 -12.2196 -12.2196 -8.6818 -8.6818 -8.6415 -8.6415 -8.3449 -8.3449 -5.8908 -5.8908 -5.8168 -5.8168 -5.6398 -5.6398 -5.3638 -5.3638 -5.0511 -5.0511 -3.6947 -3.6947 -3.3964 -3.3964 -3.3542 -3.3542 -3.2489 -3.2489 -3.1632 -3.1632 -3.1372 -3.1372 -2.1273 -2.1273 -2.0799 -2.0799 -2.0604 -2.0604 5.8458 5.8458 9.7965 9.7965 10.2508 10.2508 10.7012 10.7012 10.9382 10.9382 k = 0.1667-0.1179 0.6124 ( 3936 PWs) bands (ev): -27.9013 -27.9013 -24.5405 -24.5405 -24.5141 -24.5141 -24.4840 -24.4840 -23.0968 -23.0968 -23.0567 -23.0567 -12.2142 -12.2142 -8.6964 -8.6964 -8.6560 -8.6560 -8.3447 -8.3447 -5.9004 -5.9004 -5.8226 -5.8226 -5.6380 -5.6380 -5.3526 -5.3526 -5.0237 -5.0237 -3.6998 -3.6998 -3.3848 -3.3848 -3.3429 -3.3429 -3.2543 -3.2543 -3.1646 -3.1646 -3.1383 -3.1383 -2.1311 -2.1311 -2.0819 -2.0819 -2.0618 -2.0618 5.8600 5.8600 9.7566 9.7566 10.2270 10.2270 10.6669 10.6669 10.9461 10.9461 k = 0.1538-0.1088 0.6124 ( 3936 PWs) bands (ev): -27.9013 -27.9013 -24.5427 -24.5427 -24.5153 -24.5153 -24.4839 -24.4839 -23.0954 -23.0954 -23.0535 -23.0535 -12.2091 -12.2091 -8.7102 -8.7102 -8.6699 -8.6699 -8.3446 -8.3446 -5.9096 -5.9096 -5.8281 -5.8281 -5.6363 -5.6363 -5.3419 -5.3419 -4.9974 -4.9974 -3.7049 -3.7049 -3.3738 -3.3738 -3.3327 -3.3327 -3.2591 -3.2591 -3.1660 -3.1660 -3.1393 -3.1393 -2.1348 -2.1348 -2.0838 -2.0838 -2.0630 -2.0630 5.8736 5.8736 9.7194 9.7194 10.2044 10.2044 10.6347 10.6347 10.9535 10.9535 k = 0.1410-0.0997 0.6124 ( 3928 PWs) bands (ev): -27.9013 -27.9013 -24.5447 -24.5447 -24.5164 -24.5164 -24.4837 -24.4837 -23.0941 -23.0941 -23.0505 -23.0505 -12.2041 -12.2041 -8.7231 -8.7231 -8.6830 -8.6830 -8.3444 -8.3444 -5.9182 -5.9182 -5.8331 -5.8331 -5.6347 -5.6347 -5.3317 -5.3317 -4.9723 -4.9723 -3.7101 -3.7101 -3.3635 -3.3635 -3.3238 -3.3238 -3.2629 -3.2629 -3.1674 -3.1674 -3.1402 -3.1402 -2.1383 -2.1383 -2.0856 -2.0856 -2.0642 -2.0642 5.8865 5.8865 9.6849 9.6849 10.1830 10.1830 10.6047 10.6047 10.9604 10.9604 k = 0.1282-0.0907 0.6124 ( 3932 PWs) bands (ev): -27.9013 -27.9013 -24.5467 -24.5467 -24.5174 -24.5174 -24.4836 -24.4836 -23.0928 -23.0928 -23.0477 -23.0477 -12.1995 -12.1995 -8.7351 -8.7351 -8.6953 -8.6953 -8.3443 -8.3443 -5.9262 -5.9262 -5.8378 -5.8378 -5.6332 -5.6332 -5.3222 -5.3222 -4.9487 -4.9487 -3.7153 -3.7153 -3.3540 -3.3540 -3.3165 -3.3165 -3.2655 -3.2655 -3.1686 -3.1686 -3.1410 -3.1410 -2.1416 -2.1416 -2.0873 -2.0873 -2.0653 -2.0653 5.8988 5.8988 9.6533 9.6533 10.1629 10.1629 10.5769 10.5769 10.9668 10.9668 k = 0.1154-0.0816 0.6124 ( 3924 PWs) bands (ev): -27.9013 -27.9013 -24.5485 -24.5485 -24.5183 -24.5183 -24.4835 -24.4835 -23.0917 -23.0917 -23.0452 -23.0452 -12.1952 -12.1952 -8.7462 -8.7462 -8.7066 -8.7066 -8.3441 -8.3441 -5.9336 -5.9336 -5.8421 -5.8421 -5.6318 -5.6318 -5.3134 -5.3134 -4.9266 -4.9266 -3.7203 -3.7203 -3.3453 -3.3453 -3.3111 -3.3111 -3.2664 -3.2664 -3.1698 -3.1698 -3.1418 -3.1418 -2.1447 -2.1447 -2.0889 -2.0889 -2.0664 -2.0664 5.9102 5.9102 9.6244 9.6244 10.1444 10.1444 10.5515 10.5515 10.9726 10.9726 k = 0.1026-0.0725 0.6124 ( 3928 PWs) bands (ev): -27.9014 -27.9014 -24.5501 -24.5501 -24.5192 -24.5192 -24.4834 -24.4834 -23.0906 -23.0906 -23.0428 -23.0428 -12.1912 -12.1912 -8.7562 -8.7562 -8.7170 -8.7170 -8.3440 -8.3440 -5.9403 -5.9403 -5.8460 -5.8460 -5.6305 -5.6305 -5.3054 -5.3054 -4.9063 -4.9063 -3.7252 -3.7252 -3.3376 -3.3376 -3.3078 -3.3078 -3.2655 -3.2655 -3.1708 -3.1708 -3.1424 -3.1424 -2.1476 -2.1476 -2.0903 -2.0903 -2.0673 -2.0673 5.9207 5.9207 9.5985 9.5985 10.1274 10.1274 10.5286 10.5286 10.9779 10.9779 k = 0.0897-0.0635 0.6124 ( 3920 PWs) bands (ev): -27.9014 -27.9014 -24.5516 -24.5516 -24.5200 -24.5200 -24.4833 -24.4833 -23.0897 -23.0897 -23.0407 -23.0407 -12.1876 -12.1876 -8.7651 -8.7651 -8.7263 -8.7263 -8.3439 -8.3439 -5.9462 -5.9462 -5.8494 -5.8494 -5.6293 -5.6293 -5.2983 -5.2983 -4.8879 -4.8879 -3.7297 -3.7297 -3.3311 -3.3311 -3.3062 -3.3062 -3.2630 -3.2630 -3.1718 -3.1718 -3.1429 -3.1429 -2.1502 -2.1502 -2.0916 -2.0916 -2.0682 -2.0682 5.9302 5.9302 9.5756 9.5756 10.1122 10.1122 10.5082 10.5082 10.9826 10.9826 k = 0.0769-0.0544 0.6124 ( 3914 PWs) bands (ev): -27.9014 -27.9014 -24.5529 -24.5529 -24.5207 -24.5207 -24.4832 -24.4832 -23.0888 -23.0888 -23.0389 -23.0389 -12.1844 -12.1844 -8.7729 -8.7729 -8.7344 -8.7344 -8.3438 -8.3438 -5.9515 -5.9515 -5.8523 -5.8523 -5.6283 -5.6283 -5.2919 -5.2919 -4.8716 -4.8716 -3.7339 -3.7339 -3.3258 -3.3258 -3.3054 -3.3054 -3.2597 -3.2597 -3.1726 -3.1726 -3.1434 -3.1434 -2.1525 -2.1525 -2.0928 -2.0928 -2.0689 -2.0689 5.9386 5.9386 9.5556 9.5556 10.0988 10.0988 10.4904 10.4904 10.9867 10.9867 k = 0.0641-0.0453 0.6124 ( 3922 PWs) bands (ev): -27.9014 -27.9014 -24.5540 -24.5540 -24.5212 -24.5212 -24.4832 -24.4832 -23.0881 -23.0881 -23.0373 -23.0373 -12.1817 -12.1817 -8.7796 -8.7796 -8.7415 -8.7415 -8.3438 -8.3438 -5.9559 -5.9559 -5.8549 -5.8549 -5.6274 -5.6274 -5.2865 -5.2865 -4.8576 -4.8576 -3.7376 -3.7376 -3.3222 -3.3222 -3.3046 -3.3046 -3.2562 -3.2562 -3.1734 -3.1734 -3.1438 -3.1438 -2.1545 -2.1545 -2.0938 -2.0938 -2.0695 -2.0695 5.9458 5.9458 9.5387 9.5387 10.0873 10.0873 10.4752 10.4752 10.9901 10.9901 k = 0.0513-0.0363 0.6124 ( 3922 PWs) bands (ev): -27.9014 -27.9014 -24.5549 -24.5549 -24.5217 -24.5217 -24.4831 -24.4831 -23.0876 -23.0876 -23.0360 -23.0360 -12.1794 -12.1794 -8.7851 -8.7851 -8.7473 -8.7473 -8.3437 -8.3437 -5.9596 -5.9596 -5.8570 -5.8570 -5.6267 -5.6267 -5.2821 -5.2821 -4.8458 -4.8458 -3.7407 -3.7407 -3.3203 -3.3203 -3.3034 -3.3034 -3.2529 -3.2529 -3.1740 -3.1740 -3.1441 -3.1441 -2.1562 -2.1562 -2.0946 -2.0946 -2.0701 -2.0701 5.9519 5.9519 9.5248 9.5248 10.0778 10.0778 10.4627 10.4627 10.9930 10.9930 k = 0.0385-0.0272 0.6124 ( 3920 PWs) bands (ev): -27.9014 -27.9014 -24.5556 -24.5556 -24.5221 -24.5221 -24.4831 -24.4831 -23.0871 -23.0871 -23.0350 -23.0350 -12.1777 -12.1777 -8.7894 -8.7894 -8.7518 -8.7518 -8.3437 -8.3437 -5.9625 -5.9625 -5.8586 -5.8586 -5.6261 -5.6261 -5.2785 -5.2785 -4.8366 -4.8366 -3.7433 -3.7433 -3.3195 -3.3195 -3.3017 -3.3017 -3.2502 -3.2502 -3.1745 -3.1745 -3.1444 -3.1444 -2.1575 -2.1575 -2.0953 -2.0953 -2.0705 -2.0705 5.9566 5.9566 9.5140 9.5140 10.0703 10.0703 10.4530 10.4530 10.9952 10.9952 k = 0.0256-0.0181 0.6124 ( 3916 PWs) bands (ev): -27.9014 -27.9014 -24.5561 -24.5561 -24.5224 -24.5224 -24.4830 -24.4830 -23.0868 -23.0868 -23.0342 -23.0342 -12.1764 -12.1764 -8.7925 -8.7925 -8.7551 -8.7551 -8.3436 -8.3436 -5.9646 -5.9646 -5.8597 -5.8597 -5.6257 -5.6257 -5.2760 -5.2760 -4.8299 -4.8299 -3.7452 -3.7452 -3.3194 -3.3194 -3.3002 -3.3002 -3.2481 -3.2481 -3.1748 -3.1748 -3.1445 -3.1445 -2.1584 -2.1584 -2.0957 -2.0957 -2.0708 -2.0708 5.9600 5.9600 9.5062 9.5062 10.0649 10.0649 10.4460 10.4460 10.9968 10.9968 k = 0.0128-0.0091 0.6124 ( 3918 PWs) bands (ev): -27.9014 -27.9014 -24.5564 -24.5564 -24.5225 -24.5225 -24.4830 -24.4830 -23.0866 -23.0866 -23.0338 -23.0338 -12.1756 -12.1756 -8.7944 -8.7944 -8.7571 -8.7571 -8.3436 -8.3436 -5.9659 -5.9659 -5.8604 -5.8604 -5.6255 -5.6255 -5.2745 -5.2745 -4.8259 -4.8259 -3.7463 -3.7463 -3.3195 -3.3195 -3.2992 -3.2992 -3.2469 -3.2469 -3.1750 -3.1750 -3.1447 -3.1447 -2.1590 -2.1590 -2.0960 -2.0960 -2.0710 -2.0710 5.9621 5.9621 9.5016 9.5016 10.0616 10.0616 10.4418 10.4418 10.9978 10.9978 k = 0.0000 0.0000 0.6124 ( 3918 PWs) bands (ev): -27.9014 -27.9014 -24.5565 -24.5565 -24.5226 -24.5226 -24.4830 -24.4830 -23.0865 -23.0865 -23.0336 -23.0336 -12.1753 -12.1753 -8.7950 -8.7950 -8.7578 -8.7578 -8.3436 -8.3436 -5.9663 -5.9663 -5.8606 -5.8606 -5.6254 -5.6254 -5.2740 -5.2740 -4.8245 -4.8245 -3.7467 -3.7467 -3.3196 -3.3196 -3.2989 -3.2989 -3.2464 -3.2464 -3.1751 -3.1751 -3.1447 -3.1447 -2.1592 -2.1592 -2.0961 -2.0961 -2.0710 -2.0710 5.9628 5.9628 9.5000 9.5000 10.0606 10.0606 10.4404 10.4404 10.9981 10.9981 k = 0.0000 0.0000 0.6124 ( 3918 PWs) bands (ev): -27.9014 -27.9014 -24.5565 -24.5565 -24.5226 -24.5226 -24.4830 -24.4830 -23.0865 -23.0865 -23.0336 -23.0336 -12.1753 -12.1753 -8.7950 -8.7950 -8.7578 -8.7578 -8.3436 -8.3436 -5.9663 -5.9663 -5.8606 -5.8606 -5.6254 -5.6254 -5.2740 -5.2740 -4.8245 -4.8245 -3.7467 -3.7467 -3.3196 -3.3196 -3.2989 -3.2989 -3.2464 -3.2464 -3.1751 -3.1751 -3.1447 -3.1447 -2.1592 -2.1592 -2.0961 -2.0961 -2.0710 -2.0710 5.9628 5.9628 9.5000 9.5000 10.0606 10.0606 10.4404 10.4404 10.9981 10.9981 k = 0.0000 0.0000 0.5967 ( 3918 PWs) bands (ev): -27.9014 -27.9014 -24.5564 -24.5564 -24.5225 -24.5225 -24.4830 -24.4830 -23.0865 -23.0865 -23.0337 -23.0337 -12.1759 -12.1759 -8.7943 -8.7943 -8.7572 -8.7572 -8.3436 -8.3436 -5.9661 -5.9661 -5.8606 -5.8606 -5.6257 -5.6257 -5.2743 -5.2743 -4.8255 -4.8255 -3.7458 -3.7458 -3.3197 -3.3197 -3.2987 -3.2987 -3.2463 -3.2463 -3.1756 -3.1756 -3.1452 -3.1452 -2.1589 -2.1589 -2.0959 -2.0959 -2.0709 -2.0709 5.9609 5.9609 9.4982 9.4982 10.0619 10.0619 10.4405 10.4405 10.9980 10.9980 k = 0.0000 0.0000 0.5810 ( 3920 PWs) bands (ev): -27.9016 -27.9016 -24.5560 -24.5560 -24.5223 -24.5223 -24.4830 -24.4830 -23.0866 -23.0866 -23.0340 -23.0340 -12.1777 -12.1777 -8.7921 -8.7921 -8.7555 -8.7555 -8.3437 -8.3437 -5.9654 -5.9654 -5.8605 -5.8605 -5.6267 -5.6267 -5.2752 -5.2752 -4.8286 -4.8286 -3.7430 -3.7430 -3.3200 -3.3200 -3.2983 -3.2983 -3.2459 -3.2459 -3.1771 -3.1771 -3.1466 -3.1466 -2.1580 -2.1580 -2.0953 -2.0953 -2.0704 -2.0704 5.9552 5.9552 9.4927 9.4927 10.0657 10.0657 10.4410 10.4410 10.9979 10.9979 k = 0.0000 0.0000 0.5653 ( 3912 PWs) bands (ev): -27.9019 -27.9019 -24.5554 -24.5554 -24.5220 -24.5220 -24.4829 -24.4829 -23.0866 -23.0866 -23.0345 -23.0345 -12.1806 -12.1806 -8.7884 -8.7884 -8.7526 -8.7526 -8.3437 -8.3437 -5.9643 -5.9643 -5.8604 -5.8604 -5.6284 -5.6284 -5.2767 -5.2767 -4.8336 -4.8336 -3.7385 -3.7385 -3.3206 -3.3206 -3.2977 -3.2977 -3.2453 -3.2453 -3.1795 -3.1795 -3.1490 -3.1490 -2.1565 -2.1565 -2.0944 -2.0944 -2.0697 -2.0697 5.9459 5.9459 9.4837 9.4837 10.0722 10.0722 10.4420 10.4420 10.9977 10.9977 k = 0.0000 0.0000 0.5496 ( 3914 PWs) bands (ev): -27.9023 -27.9023 -24.5546 -24.5546 -24.5215 -24.5215 -24.4829 -24.4829 -23.0867 -23.0867 -23.0352 -23.0352 -12.1846 -12.1846 -8.7834 -8.7834 -8.7486 -8.7486 -8.3439 -8.3439 -5.9628 -5.9628 -5.8602 -5.8602 -5.6307 -5.6307 -5.2787 -5.2787 -4.8405 -4.8405 -3.7321 -3.7321 -3.3217 -3.3217 -3.2966 -3.2966 -3.2444 -3.2444 -3.1830 -3.1830 -3.1524 -3.1524 -2.1545 -2.1545 -2.0930 -2.0930 -2.0687 -2.0687 5.9329 5.9329 9.4711 9.4711 10.0811 10.0811 10.4439 10.4439 10.9973 10.9973 k = 0.0000 0.0000 0.5339 ( 3906 PWs) bands (ev): -27.9027 -27.9027 -24.5535 -24.5535 -24.5209 -24.5209 -24.4828 -24.4828 -23.0869 -23.0869 -23.0360 -23.0360 -12.1898 -12.1898 -8.7769 -8.7769 -8.7435 -8.7435 -8.3440 -8.3440 -5.9609 -5.9609 -5.8599 -5.8599 -5.6337 -5.6337 -5.2814 -5.2814 -4.8493 -4.8493 -3.7241 -3.7241 -3.3232 -3.3232 -3.2952 -3.2952 -3.2431 -3.2431 -3.1873 -3.1873 -3.1567 -3.1567 -2.1519 -2.1519 -2.0914 -2.0914 -2.0674 -2.0674 5.9165 5.9165 9.4553 9.4553 10.0926 10.0926 10.4469 10.4469 10.9968 10.9968 k = 0.0000 0.0000 0.5182 ( 3906 PWs) bands (ev): -27.9033 -27.9033 -24.5522 -24.5522 -24.5201 -24.5201 -24.4827 -24.4827 -23.0870 -23.0870 -23.0371 -23.0371 -12.1960 -12.1960 -8.7692 -8.7692 -8.7374 -8.7374 -8.3443 -8.3443 -5.9586 -5.9586 -5.8596 -5.8596 -5.6372 -5.6372 -5.2846 -5.2846 -4.8600 -4.8600 -3.7143 -3.7143 -3.3252 -3.3252 -3.2933 -3.2933 -3.2416 -3.2416 -3.1926 -3.1926 -3.1618 -3.1618 -2.1489 -2.1489 -2.0893 -2.0893 -2.0658 -2.0658 5.8967 5.8967 9.4365 9.4365 10.1066 10.1066 10.4515 10.4515 10.9960 10.9960 k = 0.0000 0.0000 0.5025 ( 3906 PWs) bands (ev): -27.9039 -27.9039 -24.5506 -24.5506 -24.5193 -24.5193 -24.4826 -24.4826 -23.0872 -23.0872 -23.0383 -23.0383 -12.2031 -12.2031 -8.7601 -8.7601 -8.7301 -8.7301 -8.3445 -8.3445 -5.9559 -5.9559 -5.8591 -5.8591 -5.6414 -5.6414 -5.2884 -5.2884 -4.8725 -4.8725 -3.7030 -3.7030 -3.3278 -3.3278 -3.2909 -3.2909 -3.2397 -3.2397 -3.1987 -3.1987 -3.1679 -3.1679 -2.1453 -2.1453 -2.0870 -2.0870 -2.0640 -2.0640 5.8737 5.8737 9.4148 9.4148 10.1229 10.1229 10.4579 10.4579 10.9951 10.9951 k = 0.0000 0.0000 0.4868 ( 3916 PWs) bands (ev): -27.9047 -27.9047 -24.5489 -24.5489 -24.5183 -24.5183 -24.4825 -24.4825 -23.0875 -23.0875 -23.0398 -23.0398 -12.2113 -12.2113 -8.7499 -8.7499 -8.7219 -8.7219 -8.3448 -8.3448 -5.9529 -5.9529 -5.8586 -5.8586 -5.6461 -5.6461 -5.2926 -5.2926 -4.8866 -4.8866 -3.6901 -3.6901 -3.3310 -3.3310 -3.2882 -3.2882 -3.2375 -3.2375 -3.2056 -3.2056 -3.1747 -3.1747 -2.1413 -2.1413 -2.0844 -2.0844 -2.0619 -2.0619 5.8478 5.8478 9.3907 9.3907 10.1415 10.1415 10.4661 10.4661 10.9940 10.9940 k = 0.0000 0.0000 0.4711 ( 3910 PWs) bands (ev): -27.9055 -27.9055 -24.5470 -24.5470 -24.5173 -24.5173 -24.4824 -24.4824 -23.0877 -23.0877 -23.0413 -23.0413 -12.2203 -12.2203 -8.7386 -8.7386 -8.7126 -8.7126 -8.3451 -8.3451 -5.9495 -5.9495 -5.8579 -5.8579 -5.6513 -5.6513 -5.2974 -5.2974 -4.9023 -4.9023 -3.6757 -3.6757 -3.3347 -3.3347 -3.2850 -3.2850 -3.2352 -3.2352 -3.2131 -3.2131 -3.1824 -3.1824 -2.1369 -2.1369 -2.0814 -2.0814 -2.0596 -2.0596 5.8191 5.8191 9.3644 9.3644 10.1623 10.1623 10.4763 10.4763 10.9927 10.9927 k = 0.0000 0.0000 0.4554 ( 3910 PWs) bands (ev): -27.9065 -27.9065 -24.5449 -24.5449 -24.5161 -24.5161 -24.4823 -24.4823 -23.0880 -23.0880 -23.0431 -23.0431 -12.2301 -12.2301 -8.7262 -8.7262 -8.7024 -8.7024 -8.3454 -8.3454 -5.9457 -5.9457 -5.8572 -5.8572 -5.6569 -5.6569 -5.3026 -5.3026 -4.9196 -4.9196 -3.6600 -3.6600 -3.3390 -3.3390 -3.2815 -3.2815 -3.2330 -3.2330 -3.2208 -3.2208 -3.1907 -3.1907 -2.1322 -2.1322 -2.0783 -2.0783 -2.0571 -2.0571 5.7880 5.7880 9.3363 9.3363 10.1853 10.1853 10.4885 10.4885 10.9913 10.9913 k = 0.0000 0.0000 0.4397 ( 3912 PWs) bands (ev): -27.9074 -27.9074 -24.5426 -24.5426 -24.5148 -24.5148 -24.4821 -24.4821 -23.0883 -23.0883 -23.0449 -23.0449 -12.2406 -12.2406 -8.7129 -8.7129 -8.6912 -8.6912 -8.3458 -8.3458 -5.9416 -5.9416 -5.8564 -5.8564 -5.6631 -5.6631 -5.3082 -5.3082 -4.9382 -4.9382 -3.6430 -3.6430 -3.3437 -3.3437 -3.2777 -3.2777 -3.2343 -3.2343 -3.2255 -3.2255 -3.1997 -3.1997 -2.1271 -2.1271 -2.0749 -2.0749 -2.0544 -2.0544 5.7546 5.7546 9.3067 9.3067 10.2102 10.2102 10.5025 10.5025 10.9897 10.9897 k = 0.0000 0.0000 0.4240 ( 3916 PWs) bands (ev): -27.9085 -27.9085 -24.5401 -24.5401 -24.5134 -24.5134 -24.4820 -24.4820 -23.0886 -23.0886 -23.0469 -23.0469 -12.2517 -12.2517 -8.6988 -8.6988 -8.6792 -8.6792 -8.3462 -8.3462 -5.9372 -5.9372 -5.8554 -5.8554 -5.6695 -5.6695 -5.3143 -5.3143 -4.9581 -4.9581 -3.6249 -3.6249 -3.3488 -3.3488 -3.2737 -3.2737 -3.2422 -3.2422 -3.2239 -3.2239 -3.2093 -3.2093 -2.1218 -2.1218 -2.0713 -2.0713 -2.0515 -2.0515 5.7191 5.7191 9.2759 9.2759 10.2369 10.2369 10.5182 10.5182 10.9879 10.9879 k = 0.0000 0.0000 0.4082 ( 3906 PWs) bands (ev): -27.9096 -27.9096 -24.5376 -24.5376 -24.5119 -24.5119 -24.4818 -24.4818 -23.0889 -23.0889 -23.0490 -23.0490 -12.2635 -12.2635 -8.6840 -8.6840 -8.6663 -8.6663 -8.3466 -8.3466 -5.9325 -5.9325 -5.8544 -5.8544 -5.6764 -5.6764 -5.3206 -5.3206 -4.9791 -4.9791 -3.6058 -3.6058 -3.3543 -3.3543 -3.2695 -3.2695 -3.2521 -3.2521 -3.2211 -3.2211 -3.2188 -3.2188 -2.1162 -2.1162 -2.0676 -2.0676 -2.0484 -2.0484 5.6820 5.6820 9.2443 9.2443 10.2654 10.2654 10.5354 10.5354 10.9861 10.9861 k = 0.0000 0.0000 0.3925 ( 3906 PWs) bands (ev): -27.9108 -27.9108 -24.5349 -24.5349 -24.5104 -24.5104 -24.4816 -24.4816 -23.0893 -23.0893 -23.0512 -23.0512 -12.2757 -12.2757 -8.6686 -8.6686 -8.6526 -8.6526 -8.3470 -8.3470 -5.9276 -5.9276 -5.8532 -5.8532 -5.6835 -5.6835 -5.3273 -5.3273 -5.0012 -5.0012 -3.5857 -3.5857 -3.3601 -3.3601 -3.2654 -3.2654 -3.2626 -3.2626 -3.2299 -3.2299 -3.2167 -3.2167 -2.1105 -2.1105 -2.0637 -2.0637 -2.0451 -2.0451 5.6434 5.6434 9.2121 9.2121 10.2953 10.2953 10.5539 10.5539 10.9841 10.9841 k = 0.0000 0.0000 0.3768 ( 3908 PWs) bands (ev): -27.9120 -27.9120 -24.5321 -24.5321 -24.5088 -24.5088 -24.4815 -24.4815 -23.0896 -23.0896 -23.0536 -23.0536 -12.2882 -12.2882 -8.6527 -8.6527 -8.6382 -8.6382 -8.3474 -8.3474 -5.9225 -5.9225 -5.8519 -5.8519 -5.6909 -5.6909 -5.3342 -5.3342 -5.0242 -5.0242 -3.5650 -3.5650 -3.3661 -3.3661 -3.2738 -3.2738 -3.2616 -3.2616 -3.2400 -3.2400 -3.2129 -3.2129 -2.1047 -2.1047 -2.0596 -2.0596 -2.0418 -2.0418 5.6037 5.6037 9.1796 9.1796 10.3266 10.3266 10.5736 10.5736 10.9821 10.9821 k = 0.0000 0.0000 0.3611 ( 3908 PWs) bands (ev): -27.9132 -27.9132 -24.5292 -24.5292 -24.5071 -24.5071 -24.4813 -24.4813 -23.0900 -23.0900 -23.0559 -23.0559 -12.3011 -12.3011 -8.6364 -8.6364 -8.6231 -8.6231 -8.3479 -8.3479 -5.9172 -5.9172 -5.8505 -5.8505 -5.6984 -5.6984 -5.3414 -5.3414 -5.0479 -5.0479 -3.5436 -3.5436 -3.3723 -3.3723 -3.2852 -3.2852 -3.2610 -3.2610 -3.2472 -3.2472 -3.2088 -3.2088 -2.0988 -2.0988 -2.0555 -2.0555 -2.0384 -2.0384 5.5630 5.5630 9.1470 9.1470 10.3590 10.3590 10.5942 10.5942 10.9800 10.9800 k = 0.0000 0.0000 0.3454 ( 3915 PWs) bands (ev): -27.9145 -27.9145 -24.5263 -24.5263 -24.5054 -24.5054 -24.4811 -24.4811 -23.0904 -23.0904 -23.0584 -23.0584 -12.3142 -12.3142 -8.6199 -8.6199 -8.6074 -8.6074 -8.3484 -8.3484 -5.9118 -5.9118 -5.8490 -5.8490 -5.7061 -5.7061 -5.3487 -5.3487 -5.0722 -5.0722 -3.5217 -3.5217 -3.3787 -3.3787 -3.2969 -3.2969 -3.2683 -3.2683 -3.2467 -3.2467 -3.2046 -3.2046 -2.0929 -2.0929 -2.0513 -2.0513 -2.0349 -2.0349 5.5217 5.5217 9.1146 9.1146 10.3923 10.3923 10.6155 10.6155 10.9779 10.9779 k = 0.0000 0.0000 0.3297 ( 3915 PWs) bands (ev): -27.9158 -27.9158 -24.5233 -24.5233 -24.5037 -24.5037 -24.4808 -24.4808 -23.0908 -23.0908 -23.0609 -23.0609 -12.3274 -12.3274 -8.6032 -8.6032 -8.5912 -8.5912 -8.3488 -8.3488 -5.9062 -5.9062 -5.8474 -5.8474 -5.7138 -5.7138 -5.3562 -5.3562 -5.0970 -5.0970 -3.4997 -3.4997 -3.3851 -3.3851 -3.3087 -3.3087 -3.2791 -3.2791 -3.2428 -3.2428 -3.2004 -3.2004 -2.0870 -2.0870 -2.0470 -2.0470 -2.0313 -2.0313 5.4800 5.4800 9.0826 9.0826 10.4264 10.4264 10.6373 10.6373 10.9758 10.9758 k = 0.0000 0.0000 0.3140 ( 3921 PWs) bands (ev): -27.9171 -27.9171 -24.5203 -24.5203 -24.5019 -24.5019 -24.4806 -24.4806 -23.0912 -23.0912 -23.0634 -23.0634 -12.3406 -12.3406 -8.5865 -8.5865 -8.5746 -8.5746 -8.3493 -8.3493 -5.9005 -5.9005 -5.8458 -5.8458 -5.7216 -5.7216 -5.3637 -5.3637 -5.1221 -5.1221 -3.4776 -3.4776 -3.3915 -3.3915 -3.3206 -3.3206 -3.2907 -3.2907 -3.2381 -3.2381 -3.1961 -3.1961 -2.0812 -2.0812 -2.0427 -2.0427 -2.0278 -2.0278 5.4382 5.4382 9.0512 9.0512 10.4609 10.4609 10.6594 10.6594 10.9736 10.9736 k = 0.0000 0.0000 0.2983 ( 3921 PWs) bands (ev): -27.9184 -27.9184 -24.5173 -24.5173 -24.5001 -24.5001 -24.4804 -24.4804 -23.0916 -23.0916 -23.0659 -23.0659 -12.3538 -12.3538 -8.5698 -8.5698 -8.5578 -8.5578 -8.3498 -8.3498 -5.8948 -5.8948 -5.8440 -5.8440 -5.7293 -5.7293 -5.3712 -5.3712 -5.1474 -5.1474 -3.4559 -3.4559 -3.3978 -3.3978 -3.3325 -3.3325 -3.3023 -3.3023 -3.2333 -3.2333 -3.1919 -3.1919 -2.0756 -2.0756 -2.0383 -2.0383 -2.0242 -2.0242 5.3966 5.3966 9.0205 9.0205 10.4957 10.4957 10.6817 10.6817 10.9715 10.9715 k = 0.0000 0.0000 0.2826 ( 3919 PWs) bands (ev): -27.9197 -27.9197 -24.5143 -24.5143 -24.4983 -24.4983 -24.4802 -24.4802 -23.0920 -23.0920 -23.0685 -23.0685 -12.3669 -12.3669 -8.5531 -8.5531 -8.5408 -8.5408 -8.3503 -8.3503 -5.8891 -5.8891 -5.8423 -5.8423 -5.7370 -5.7370 -5.3787 -5.3787 -5.1727 -5.1727 -3.4352 -3.4352 -3.4036 -3.4036 -3.3442 -3.3442 -3.3137 -3.3137 -3.2283 -3.2283 -3.1877 -3.1877 -2.0701 -2.0701 -2.0339 -2.0339 -2.0207 -2.0207 5.3554 5.3554 8.9906 8.9906 10.5304 10.5304 10.7039 10.7039 10.9695 10.9695 k = 0.0000 0.0000 0.2669 ( 3923 PWs) bands (ev): -27.9210 -27.9210 -24.5114 -24.5114 -24.4965 -24.4965 -24.4799 -24.4799 -23.0924 -23.0924 -23.0710 -23.0710 -12.3797 -12.3797 -8.5365 -8.5365 -8.5240 -8.5240 -8.3507 -8.3507 -5.8835 -5.8835 -5.8405 -5.8405 -5.7445 -5.7445 -5.3861 -5.3861 -5.1978 -5.1978 -3.4195 -3.4195 -3.4056 -3.4056 -3.3554 -3.3554 -3.3243 -3.3243 -3.2233 -3.2233 -3.1835 -3.1835 -2.0648 -2.0648 -2.0295 -2.0295 -2.0172 -2.0172 5.3149 5.3149 8.9617 8.9617 10.5649 10.5649 10.7260 10.7260 10.9675 10.9675 k = 0.0000 0.0000 0.2512 ( 3927 PWs) bands (ev): -27.9223 -27.9223 -24.5086 -24.5086 -24.4947 -24.4947 -24.4797 -24.4797 -23.0928 -23.0928 -23.0735 -23.0735 -12.3922 -12.3922 -8.5201 -8.5201 -8.5073 -8.5073 -8.3511 -8.3511 -5.8779 -5.8779 -5.8387 -5.8387 -5.7518 -5.7518 -5.3934 -5.3934 -5.2226 -5.2226 -3.4200 -3.4200 -3.3949 -3.3949 -3.3652 -3.3652 -3.3329 -3.3329 -3.2184 -3.2184 -3.1795 -3.1795 -2.0597 -2.0597 -2.0252 -2.0252 -2.0138 -2.0138 5.2752 5.2752 8.9340 8.9340 10.5989 10.5989 10.7478 10.7478 10.9656 10.9656 k = 0.0000 0.0000 0.2355 ( 3931 PWs) bands (ev): -27.9235 -27.9235 -24.5058 -24.5058 -24.4929 -24.4929 -24.4794 -24.4794 -23.0932 -23.0932 -23.0759 -23.0759 -12.4043 -12.4043 -8.5040 -8.5040 -8.4909 -8.4909 -8.3515 -8.3515 -5.8724 -5.8724 -5.8369 -5.8369 -5.7589 -5.7589 -5.4005 -5.4005 -5.2470 -5.2470 -3.4253 -3.4253 -3.3893 -3.3893 -3.3707 -3.3707 -3.3357 -3.3357 -3.2134 -3.2134 -3.1755 -3.1755 -2.0549 -2.0549 -2.0210 -2.0210 -2.0105 -2.0105 5.2367 5.2367 8.9075 8.9075 10.6320 10.6320 10.7691 10.7691 10.9639 10.9639 k = 0.0000 0.0000 0.2198 ( 3931 PWs) bands (ev): -27.9247 -27.9247 -24.5032 -24.5032 -24.4912 -24.4912 -24.4792 -24.4792 -23.0936 -23.0936 -23.0783 -23.0783 -12.4160 -12.4160 -8.4882 -8.4882 -8.4750 -8.4750 -8.3519 -8.3519 -5.8671 -5.8671 -5.8351 -5.8351 -5.7657 -5.7657 -5.4074 -5.4074 -5.2707 -5.2707 -3.4310 -3.4310 -3.3955 -3.3955 -3.3745 -3.3745 -3.3280 -3.3280 -3.2085 -3.2085 -3.1718 -3.1718 -2.0503 -2.0503 -2.0168 -2.0168 -2.0073 -2.0073 5.1996 5.1996 8.8822 8.8822 10.6640 10.6640 10.7898 10.7898 10.9623 10.9623 k = 0.0000 0.0000 0.2041 ( 3935 PWs) bands (ev): -27.9258 -27.9258 -24.5007 -24.5007 -24.4895 -24.4895 -24.4789 -24.4789 -23.0940 -23.0940 -23.0805 -23.0805 -12.4272 -12.4272 -8.4730 -8.4730 -8.4596 -8.4596 -8.3523 -8.3523 -5.8621 -5.8621 -5.8334 -5.8334 -5.7722 -5.7722 -5.4139 -5.4139 -5.2937 -5.2937 -3.4367 -3.4367 -3.4049 -3.4049 -3.3817 -3.3817 -3.3137 -3.3137 -3.2035 -3.2035 -3.1681 -3.1681 -2.0461 -2.0461 -2.0127 -2.0127 -2.0043 -2.0043 5.1640 5.1640 8.8584 8.8584 10.6946 10.6946 10.8099 10.8099 10.9610 10.9610 k = 0.0000 0.0000 0.1884 ( 3939 PWs) bands (ev): -27.9269 -27.9269 -24.4984 -24.4984 -24.4878 -24.4878 -24.4786 -24.4786 -23.0943 -23.0943 -23.0827 -23.0827 -12.4379 -12.4379 -8.4583 -8.4583 -8.4449 -8.4449 -8.3526 -8.3526 -5.8573 -5.8573 -5.8318 -5.8318 -5.7782 -5.7782 -5.4201 -5.4201 -5.3158 -5.3158 -3.4423 -3.4423 -3.4146 -3.4146 -3.3903 -3.3903 -3.2976 -3.2976 -3.1985 -3.1985 -3.1647 -3.1647 -2.0421 -2.0421 -2.0088 -2.0088 -2.0014 -2.0014 5.1301 5.1301 8.8361 8.8361 10.7235 10.7235 10.8293 10.8293 10.9599 10.9599 k = 0.0000 0.0000 0.1727 ( 3947 PWs) bands (ev): -27.9280 -27.9280 -24.4963 -24.4963 -24.4862 -24.4862 -24.4783 -24.4783 -23.0947 -23.0947 -23.0848 -23.0848 -12.4479 -12.4479 -8.4444 -8.4444 -8.4310 -8.4310 -8.3529 -8.3529 -5.8528 -5.8528 -5.8303 -5.8303 -5.7837 -5.7837 -5.4260 -5.4260 -5.3367 -5.3367 -3.4476 -3.4476 -3.4241 -3.4241 -3.3992 -3.3992 -3.2818 -3.2818 -3.1933 -3.1933 -3.1614 -3.1614 -2.0384 -2.0384 -2.0051 -2.0051 -1.9987 -1.9987 5.0982 5.0982 8.8153 8.8153 10.7504 10.7504 10.8478 10.8478 10.9591 10.9591 k = 0.0000 0.0000 0.1570 ( 3953 PWs) bands (ev): -27.9290 -27.9290 -24.4944 -24.4944 -24.4846 -24.4846 -24.4780 -24.4780 -23.0950 -23.0950 -23.0867 -23.0867 -12.4572 -12.4572 -8.4313 -8.4313 -8.4179 -8.4179 -8.3531 -8.3531 -5.8486 -5.8486 -5.8291 -5.8291 -5.7887 -5.7887 -5.4315 -5.4315 -5.3564 -5.3564 -3.4526 -3.4526 -3.4331 -3.4331 -3.4076 -3.4076 -3.2671 -3.2671 -3.1880 -3.1880 -3.1584 -3.1584 -2.0351 -2.0351 -2.0016 -2.0016 -1.9962 -1.9962 5.0685 5.0685 8.7962 8.7962 10.7750 10.7750 10.8656 10.8656 10.9586 10.9586 k = 0.0000 0.0000 0.1413 ( 3953 PWs) bands (ev): -27.9298 -27.9298 -24.4926 -24.4926 -24.4831 -24.4831 -24.4777 -24.4777 -23.0953 -23.0953 -23.0885 -23.0885 -12.4658 -12.4658 -8.4191 -8.4191 -8.4057 -8.4057 -8.3533 -8.3533 -5.8449 -5.8449 -5.8280 -5.8280 -5.7931 -5.7931 -5.4365 -5.4365 -5.3747 -5.3747 -3.4573 -3.4573 -3.4416 -3.4416 -3.4155 -3.4155 -3.2539 -3.2539 -3.1825 -3.1825 -3.1556 -3.1556 -2.0320 -2.0320 -1.9984 -1.9984 -1.9939 -1.9939 5.0410 5.0410 8.7787 8.7787 10.7970 10.7970 10.8824 10.8824 10.9585 10.9585 k = 0.0000 0.0000 0.1256 ( 3961 PWs) bands (ev): -27.9307 -27.9307 -24.4911 -24.4911 -24.4817 -24.4817 -24.4774 -24.4774 -23.0956 -23.0956 -23.0902 -23.0902 -12.4736 -12.4736 -8.4080 -8.4080 -8.3946 -8.3946 -8.3534 -8.3534 -5.8415 -5.8415 -5.8273 -5.8273 -5.7967 -5.7967 -5.4411 -5.4411 -5.3916 -5.3916 -3.4617 -3.4617 -3.4494 -3.4494 -3.4227 -3.4227 -3.2425 -3.2425 -3.1766 -3.1766 -3.1531 -3.1531 -2.0293 -2.0293 -1.9954 -1.9954 -1.9917 -1.9917 5.0160 5.0160 8.7629 8.7629 10.8162 10.8162 10.8983 10.8983 10.9589 10.9589 k = 0.0000 0.0000 0.1099 ( 3955 PWs) bands (ev): -27.9314 -27.9314 -24.4899 -24.4899 -24.4804 -24.4804 -24.4771 -24.4771 -23.0958 -23.0958 -23.0916 -23.0916 -12.4806 -12.4806 -8.3981 -8.3981 -8.3845 -8.3845 -8.3533 -8.3533 -5.8386 -5.8386 -5.8269 -5.8269 -5.7996 -5.7996 -5.4451 -5.4451 -5.4067 -5.4067 -3.4658 -3.4658 -3.4564 -3.4564 -3.4291 -3.4291 -3.2330 -3.2330 -3.1706 -3.1706 -3.1508 -3.1508 -2.0269 -2.0269 -1.9927 -1.9927 -1.9899 -1.9899 4.9936 4.9936 8.7489 8.7489 10.8326 10.8326 10.9130 10.9130 10.9596 10.9596 k = 0.0000 0.0000 0.0942 ( 3951 PWs) bands (ev): -27.9320 -27.9320 -24.4888 -24.4888 -24.4792 -24.4792 -24.4768 -24.4768 -23.0960 -23.0960 -23.0929 -23.0929 -12.4867 -12.4867 -8.3894 -8.3894 -8.3756 -8.3756 -8.3532 -8.3532 -5.8361 -5.8361 -5.8270 -5.8270 -5.8016 -5.8016 -5.4487 -5.4487 -5.4202 -5.4202 -3.4694 -3.4694 -3.4626 -3.4626 -3.4347 -3.4347 -3.2253 -3.2253 -3.1646 -3.1646 -3.1488 -3.1488 -2.0248 -2.0248 -1.9903 -1.9903 -1.9882 -1.9882 4.9740 4.9740 8.7366 8.7366 10.8461 10.8461 10.9265 10.9265 10.9607 10.9607 k = 0.0000 0.0000 0.0785 ( 3951 PWs) bands (ev): -27.9326 -27.9326 -24.4879 -24.4879 -24.4782 -24.4782 -24.4765 -24.4765 -23.0962 -23.0962 -23.0940 -23.0940 -12.4919 -12.4919 -8.3823 -8.3823 -8.3679 -8.3679 -8.3528 -8.3528 -5.8341 -5.8341 -5.8273 -5.8273 -5.8029 -5.8029 -5.4517 -5.4517 -5.4317 -5.4317 -3.4726 -3.4726 -3.4679 -3.4679 -3.4394 -3.4394 -3.2193 -3.2193 -3.1588 -3.1588 -3.1471 -3.1471 -2.0230 -2.0230 -1.9882 -1.9882 -1.9868 -1.9868 4.9571 4.9571 8.7262 8.7262 10.8568 10.8568 10.9384 10.9384 10.9621 10.9621 k = 0.0000 0.0000 0.0628 ( 3959 PWs) bands (ev): -27.9330 -27.9330 -24.4873 -24.4873 -24.4773 -24.4773 -24.4762 -24.4762 -23.0964 -23.0964 -23.0950 -23.0950 -12.4962 -12.4962 -8.3765 -8.3765 -8.3615 -8.3615 -8.3523 -8.3523 -5.8325 -5.8325 -5.8280 -5.8280 -5.8037 -5.8037 -5.4542 -5.4542 -5.4413 -5.4413 -3.4753 -3.4753 -3.4724 -3.4724 -3.4433 -3.4433 -3.2148 -3.2148 -3.1535 -3.1535 -3.1457 -3.1457 -2.0216 -2.0216 -1.9866 -1.9866 -1.9856 -1.9856 4.9432 4.9432 8.7177 8.7177 10.8650 10.8650 10.9485 10.9485 10.9636 10.9636 k = 0.0000 0.0000 0.0471 ( 3959 PWs) bands (ev): -27.9334 -27.9334 -24.4868 -24.4868 -24.4766 -24.4766 -24.4760 -24.4760 -23.0965 -23.0965 -23.0957 -23.0957 -12.4996 -12.4996 -8.3723 -8.3723 -8.3565 -8.3565 -8.3516 -8.3516 -5.8313 -5.8313 -5.8287 -5.8287 -5.8040 -5.8040 -5.4561 -5.4561 -5.4488 -5.4488 -3.4775 -3.4775 -3.4758 -3.4758 -3.4462 -3.4462 -3.2115 -3.2115 -3.1492 -3.1492 -3.1446 -3.1446 -2.0205 -2.0205 -1.9852 -1.9852 -1.9847 -1.9847 4.9323 4.9323 8.7110 8.7110 10.8710 10.8710 10.9567 10.9567 10.9651 10.9651 k = 0.0000 0.0000 0.0314 ( 3955 PWs) bands (ev): -27.9336 -27.9336 -24.4864 -24.4864 -24.4761 -24.4761 -24.4759 -24.4759 -23.0966 -23.0966 -23.0962 -23.0962 -12.5020 -12.5020 -8.3696 -8.3696 -8.3529 -8.3529 -8.3508 -8.3508 -5.8305 -5.8305 -5.8293 -5.8293 -5.8040 -5.8040 -5.4575 -5.4575 -5.4542 -5.4542 -3.4791 -3.4791 -3.4784 -3.4784 -3.4483 -3.4483 -3.2093 -3.2093 -3.1459 -3.1459 -3.1438 -3.1438 -2.0197 -2.0197 -1.9843 -1.9843 -1.9840 -1.9840 4.9245 4.9245 8.7062 8.7062 10.8750 10.8750 10.9626 10.9626 10.9664 10.9664 k = 0.0000 0.0000 0.0157 ( 3949 PWs) bands (ev): -27.9338 -27.9338 -24.4862 -24.4862 -24.4758 -24.4758 -24.4758 -24.4758 -23.0966 -23.0966 -23.0965 -23.0965 -12.5035 -12.5035 -8.3680 -8.3680 -8.3507 -8.3507 -8.3502 -8.3502 -5.8300 -5.8300 -5.8297 -5.8297 -5.8040 -5.8040 -5.4583 -5.4583 -5.4575 -5.4575 -3.4801 -3.4801 -3.4799 -3.4799 -3.4496 -3.4496 -3.2080 -3.2080 -3.1438 -3.1438 -3.1433 -3.1433 -2.0192 -2.0192 -1.9837 -1.9837 -1.9836 -1.9836 4.9198 4.9198 8.7034 8.7034 10.8773 10.8773 10.9662 10.9662 10.9672 10.9672 k = 0.0000 0.0000 0.0000 ( 3925 PWs) bands (ev): -27.9338 -27.9338 -24.4861 -24.4861 -24.4757 -24.4757 -24.4757 -24.4757 -23.0966 -23.0966 -23.0966 -23.0966 -12.5039 -12.5039 -8.3675 -8.3675 -8.3499 -8.3499 -8.3499 -8.3499 -5.8298 -5.8298 -5.8298 -5.8298 -5.8040 -5.8040 -5.4586 -5.4586 -5.4586 -5.4586 -3.4804 -3.4804 -3.4804 -3.4804 -3.4500 -3.4500 -3.2076 -3.2076 -3.1431 -3.1431 -3.1431 -3.1431 -2.0190 -2.0190 -1.9835 -1.9835 -1.9835 -1.9835 4.9182 4.9182 8.7024 8.7024 10.8781 10.8781 10.9675 10.9675 10.9675 10.9675 k = 0.0000 0.0000 0.0000 ( 3925 PWs) bands (ev): -27.9338 -27.9338 -24.4861 -24.4861 -24.4757 -24.4757 -24.4757 -24.4757 -23.0966 -23.0966 -23.0966 -23.0966 -12.5039 -12.5039 -8.3675 -8.3675 -8.3499 -8.3499 -8.3499 -8.3499 -5.8298 -5.8298 -5.8298 -5.8298 -5.8040 -5.8040 -5.4586 -5.4586 -5.4586 -5.4586 -3.4804 -3.4804 -3.4804 -3.4804 -3.4500 -3.4500 -3.2076 -3.2076 -3.1431 -3.1431 -3.1431 -3.1431 -2.0190 -2.0190 -1.9835 -1.9835 -1.9835 -1.9835 4.9182 4.9182 8.7024 8.7024 10.8781 10.8781 10.9675 10.9675 10.9675 10.9675 k = 0.0053 0.0075 0.0130 ( 3955 PWs) bands (ev): -27.9338 -27.9338 -24.4862 -24.4862 -24.4758 -24.4758 -24.4758 -24.4758 -23.0966 -23.0966 -23.0966 -23.0966 -12.5035 -12.5035 -8.3680 -8.3680 -8.3505 -8.3505 -8.3504 -8.3504 -5.8300 -5.8300 -5.8296 -5.8296 -5.8040 -5.8040 -5.4579 -5.4579 -5.4579 -5.4579 -3.4801 -3.4801 -3.4799 -3.4799 -3.4496 -3.4496 -3.2080 -3.2080 -3.1439 -3.1439 -3.1433 -3.1433 -2.0192 -2.0192 -1.9837 -1.9837 -1.9837 -1.9837 4.9198 4.9198 8.7034 8.7034 10.8773 10.8773 10.9665 10.9665 10.9669 10.9669 k = 0.0106 0.0150 0.0261 ( 3955 PWs) bands (ev): -27.9336 -27.9336 -24.4864 -24.4864 -24.4761 -24.4761 -24.4759 -24.4759 -23.0964 -23.0964 -23.0964 -23.0964 -12.5020 -12.5020 -8.3695 -8.3695 -8.3520 -8.3520 -8.3519 -8.3519 -5.8305 -5.8305 -5.8292 -5.8292 -5.8040 -5.8040 -5.4558 -5.4558 -5.4557 -5.4557 -3.4791 -3.4791 -3.4783 -3.4783 -3.4483 -3.4483 -3.2094 -3.2094 -3.1460 -3.1460 -3.1438 -3.1438 -2.0197 -2.0197 -1.9842 -1.9842 -1.9842 -1.9842 4.9247 4.9247 8.7064 8.7064 10.8750 10.8750 10.9635 10.9635 10.9652 10.9652 k = 0.0160 0.0226 0.0391 ( 3955 PWs) bands (ev): -27.9334 -27.9334 -24.4868 -24.4868 -24.4765 -24.4765 -24.4762 -24.4762 -23.0961 -23.0961 -23.0960 -23.0960 -12.4995 -12.4995 -8.3720 -8.3720 -8.3546 -8.3546 -8.3542 -8.3542 -5.8315 -5.8315 -5.8285 -5.8285 -5.8039 -5.8039 -5.4524 -5.4524 -5.4521 -5.4521 -3.4775 -3.4775 -3.4756 -3.4756 -3.4461 -3.4461 -3.2117 -3.2117 -3.1494 -3.1494 -3.1446 -3.1446 -2.0205 -2.0205 -1.9850 -1.9850 -1.9850 -1.9850 4.9328 4.9328 8.7113 8.7113 10.8710 10.8710 10.9585 10.9585 10.9625 10.9625 k = 0.0213 0.0301 0.0521 ( 3955 PWs) bands (ev): -27.9330 -27.9330 -24.4873 -24.4873 -24.4771 -24.4771 -24.4766 -24.4766 -23.0957 -23.0957 -23.0956 -23.0956 -12.4960 -12.4960 -8.3754 -8.3754 -8.3583 -8.3583 -8.3575 -8.3575 -5.8328 -5.8328 -5.8279 -5.8279 -5.8034 -5.8034 -5.4475 -5.4475 -5.4471 -5.4471 -3.4753 -3.4753 -3.4720 -3.4720 -3.4430 -3.4430 -3.2151 -3.2151 -3.1539 -3.1539 -3.1456 -3.1456 -2.0217 -2.0217 -1.9862 -1.9862 -1.9862 -1.9862 4.9441 4.9441 8.7182 8.7182 10.8655 10.8655 10.9515 10.9515 10.9589 10.9589 k = 0.0266 0.0376 0.0651 ( 3946 PWs) bands (ev): -27.9325 -27.9325 -24.4879 -24.4879 -24.4779 -24.4779 -24.4770 -24.4770 -23.0951 -23.0951 -23.0950 -23.0950 -12.4915 -12.4915 -8.3798 -8.3798 -8.3628 -8.3628 -8.3616 -8.3616 -5.8345 -5.8345 -5.8276 -5.8276 -5.8024 -5.8024 -5.4413 -5.4413 -5.4407 -5.4407 -3.4726 -3.4726 -3.4673 -3.4673 -3.4390 -3.4390 -3.2199 -3.2199 -3.1593 -3.1593 -3.1470 -3.1470 -2.0231 -2.0231 -1.9877 -1.9877 -1.9876 -1.9876 4.9584 4.9584 8.7270 8.7270 10.8582 10.8582 10.9426 10.9426 10.9543 10.9543 k = 0.0319 0.0451 0.0782 ( 3940 PWs) bands (ev): -27.9319 -27.9319 -24.4887 -24.4887 -24.4788 -24.4788 -24.4776 -24.4776 -23.0944 -23.0944 -23.0944 -23.0944 -12.4860 -12.4860 -8.3852 -8.3852 -8.3684 -8.3684 -8.3667 -8.3667 -5.8365 -5.8365 -5.8279 -5.8279 -5.8005 -5.8005 -5.4337 -5.4337 -5.4329 -5.4329 -3.4695 -3.4695 -3.4617 -3.4617 -3.4341 -3.4341 -3.2262 -3.2262 -3.1652 -3.1652 -3.1487 -3.1487 -2.0249 -2.0249 -1.9895 -1.9895 -1.9894 -1.9894 4.9759 4.9759 8.7378 8.7378 10.8491 10.8491 10.9317 10.9317 10.9491 10.9491 k = 0.0372 0.0527 0.0912 ( 3940 PWs) bands (ev): -27.9313 -27.9313 -24.4897 -24.4897 -24.4798 -24.4798 -24.4783 -24.4783 -23.0936 -23.0936 -23.0935 -23.0935 -12.4797 -12.4797 -8.3914 -8.3914 -8.3749 -8.3749 -8.3726 -8.3726 -5.8389 -5.8389 -5.8288 -5.8288 -5.7976 -5.7976 -5.4249 -5.4249 -5.4239 -5.4239 -3.4659 -3.4659 -3.4551 -3.4551 -3.4283 -3.4283 -3.2343 -3.2343 -3.1712 -3.1712 -3.1508 -3.1508 -2.0271 -2.0271 -1.9917 -1.9917 -1.9916 -1.9916 4.9962 4.9962 8.7504 8.7504 10.8382 10.8382 10.9189 10.9189 10.9431 10.9431 k = 0.0426 0.0602 0.1042 ( 3952 PWs) bands (ev): -27.9305 -27.9305 -24.4908 -24.4908 -24.4810 -24.4810 -24.4791 -24.4791 -23.0927 -23.0927 -23.0926 -23.0926 -12.4724 -12.4724 -8.3986 -8.3986 -8.3823 -8.3823 -8.3793 -8.3793 -5.8416 -5.8416 -5.8305 -5.8305 -5.7938 -5.7938 -5.4148 -5.4148 -5.4135 -5.4135 -3.4619 -3.4619 -3.4478 -3.4478 -3.4215 -3.4215 -3.2444 -3.2444 -3.1771 -3.1771 -3.1531 -3.1531 -2.0295 -2.0295 -1.9941 -1.9941 -1.9940 -1.9940 5.0194 5.0194 8.7649 8.7649 10.8255 10.8255 10.9043 10.9043 10.9367 10.9367 k = 0.0479 0.0677 0.1173 ( 3946 PWs) bands (ev): -27.9297 -27.9297 -24.4920 -24.4920 -24.4822 -24.4822 -24.4799 -24.4799 -23.0916 -23.0916 -23.0916 -23.0916 -12.4643 -12.4643 -8.4066 -8.4066 -8.3905 -8.3905 -8.3868 -8.3868 -5.8445 -5.8445 -5.8328 -5.8328 -5.7892 -5.7892 -5.4034 -5.4034 -5.4019 -5.4019 -3.4575 -3.4575 -3.4396 -3.4396 -3.4140 -3.4140 -3.2564 -3.2564 -3.1828 -3.1828 -3.1557 -3.1557 -2.0322 -2.0322 -1.9969 -1.9969 -1.9967 -1.9967 5.0454 5.0454 8.7812 8.7812 10.8108 10.8108 10.8877 10.8877 10.9299 10.9299 k = 0.0532 0.0752 0.1303 ( 3946 PWs) bands (ev): -27.9288 -27.9288 -24.4935 -24.4935 -24.4836 -24.4836 -24.4809 -24.4809 -23.0905 -23.0905 -23.0905 -23.0905 -12.4553 -12.4553 -8.4154 -8.4154 -8.3995 -8.3995 -8.3951 -8.3951 -5.8478 -5.8478 -5.8356 -5.8356 -5.7838 -5.7838 -5.3909 -5.3909 -5.3891 -5.3891 -3.4528 -3.4528 -3.4307 -3.4307 -3.4056 -3.4056 -3.2703 -3.2703 -3.1882 -3.1882 -3.1586 -3.1586 -2.0352 -2.0352 -2.0000 -2.0000 -1.9997 -1.9997 5.0739 5.0739 8.7993 8.7993 10.7942 10.7942 10.8694 10.8694 10.9228 10.9228 k = 0.0585 0.0827 0.1433 ( 3946 PWs) bands (ev): -27.9278 -27.9278 -24.4951 -24.4951 -24.4850 -24.4850 -24.4819 -24.4819 -23.0892 -23.0892 -23.0892 -23.0892 -12.4455 -12.4455 -8.4249 -8.4249 -8.4092 -8.4092 -8.4041 -8.4041 -5.8512 -5.8512 -5.8388 -5.8388 -5.7779 -5.7779 -5.3773 -5.3773 -5.3752 -5.3752 -3.4478 -3.4478 -3.4211 -3.4211 -3.3965 -3.3965 -3.2858 -3.2858 -3.1934 -3.1934 -3.1618 -3.1618 -2.0385 -2.0385 -2.0033 -2.0033 -2.0030 -2.0030 5.1049 5.1049 8.8192 8.8192 10.7758 10.7758 10.8492 10.8492 10.9156 10.9156 k = 0.0638 0.0903 0.1564 ( 3946 PWs) bands (ev): -27.9267 -27.9267 -24.4968 -24.4968 -24.4865 -24.4865 -24.4831 -24.4831 -23.0879 -23.0879 -23.0879 -23.0879 -12.4349 -12.4349 -8.4351 -8.4351 -8.4196 -8.4196 -8.4137 -8.4137 -5.8549 -5.8549 -5.8423 -5.8423 -5.7715 -5.7715 -5.3626 -5.3626 -5.3603 -5.3603 -3.4425 -3.4425 -3.4109 -3.4109 -3.3868 -3.3868 -3.3027 -3.3027 -3.1984 -3.1984 -3.1652 -3.1652 -2.0421 -2.0421 -2.0069 -2.0069 -2.0065 -2.0065 5.1382 5.1382 8.8407 8.8407 10.7554 10.7554 10.8274 10.8274 10.9082 10.9082 k = 0.0691 0.0978 0.1694 ( 3946 PWs) bands (ev): -27.9256 -27.9256 -24.4987 -24.4987 -24.4880 -24.4880 -24.4843 -24.4843 -23.0865 -23.0865 -23.0864 -23.0864 -12.4237 -12.4237 -8.4459 -8.4459 -8.4306 -8.4306 -8.4241 -8.4241 -5.8587 -5.8587 -5.8461 -5.8461 -5.7648 -5.7648 -5.3469 -5.3469 -5.3444 -5.3444 -3.4368 -3.4368 -3.4003 -3.4003 -3.3765 -3.3765 -3.3208 -3.3208 -3.2033 -3.2033 -3.1690 -3.1690 -2.0459 -2.0459 -2.0108 -2.0108 -2.0103 -2.0103 5.1736 5.1736 8.8638 8.8638 10.7333 10.7333 10.8038 10.8038 10.9009 10.9009 k = 0.0745 0.1053 0.1824 ( 3940 PWs) bands (ev): -27.9244 -27.9244 -24.5007 -24.5007 -24.4896 -24.4896 -24.4856 -24.4856 -23.0849 -23.0849 -23.0849 -23.0849 -12.4117 -12.4117 -8.4573 -8.4573 -8.4422 -8.4422 -8.4350 -8.4350 -5.8627 -5.8627 -5.8500 -5.8500 -5.7579 -5.7579 -5.3304 -5.3304 -5.3277 -5.3277 -3.4309 -3.4309 -3.3892 -3.3892 -3.3657 -3.3657 -3.3396 -3.3396 -3.2083 -3.2083 -3.1730 -3.1730 -2.0499 -2.0499 -2.0149 -2.0149 -2.0143 -2.0143 5.2110 5.2110 8.8885 8.8885 10.7094 10.7094 10.7786 10.7786 10.8936 10.8936 k = 0.0798 0.1128 0.1954 ( 3946 PWs) bands (ev): -27.9231 -27.9231 -24.5029 -24.5029 -24.4912 -24.4912 -24.4870 -24.4870 -23.0833 -23.0833 -23.0833 -23.0833 -12.3992 -12.3992 -8.4693 -8.4693 -8.4542 -8.4542 -8.4465 -8.4465 -5.8667 -5.8667 -5.8540 -5.8540 -5.7509 -5.7509 -5.3130 -5.3130 -5.3101 -5.3101 -3.4246 -3.4246 -3.3777 -3.3777 -3.3591 -3.3591 -3.3546 -3.3546 -3.2132 -3.2132 -3.1773 -3.1773 -2.0542 -2.0542 -2.0192 -2.0192 -2.0185 -2.0185 5.2501 5.2501 8.9147 8.9147 10.6838 10.6838 10.7518 10.7518 10.8866 10.8866 k = 0.0851 0.1204 0.2085 ( 3934 PWs) bands (ev): -27.9218 -27.9218 -24.5051 -24.5051 -24.4929 -24.4929 -24.4884 -24.4884 -23.0816 -23.0816 -23.0815 -23.0815 -12.3860 -12.3860 -8.4817 -8.4817 -8.4667 -8.4667 -8.4585 -8.4585 -5.8707 -5.8707 -5.8580 -5.8580 -5.7438 -5.7438 -5.2948 -5.2948 -5.2918 -5.2918 -3.4181 -3.4181 -3.3787 -3.3787 -3.3660 -3.3660 -3.3432 -3.3432 -3.2182 -3.2182 -3.1818 -3.1818 -2.0586 -2.0586 -2.0238 -2.0238 -2.0229 -2.0229 5.2909 5.2909 8.9422 8.9422 10.6567 10.6567 10.7236 10.7236 10.8798 10.8798 k = 0.0904 0.1279 0.2215 ( 3940 PWs) bands (ev): -27.9205 -27.9205 -24.5074 -24.5074 -24.4946 -24.4946 -24.4900 -24.4900 -23.0798 -23.0798 -23.0798 -23.0798 -12.3724 -12.3724 -8.4945 -8.4945 -8.4796 -8.4796 -8.4711 -8.4711 -5.8747 -5.8747 -5.8620 -5.8620 -5.7368 -5.7368 -5.2760 -5.2760 -5.2728 -5.2728 -3.4117 -3.4117 -3.3983 -3.3983 -3.3542 -3.3542 -3.3317 -3.3317 -3.2233 -3.2233 -3.1866 -3.1866 -2.0633 -2.0633 -2.0285 -2.0285 -2.0275 -2.0275 5.3330 5.3330 8.9709 8.9709 10.6280 10.6280 10.6939 10.6939 10.8735 10.8735 k = 0.0957 0.1354 0.2345 ( 3922 PWs) bands (ev): -27.9191 -27.9191 -24.5098 -24.5098 -24.4963 -24.4963 -24.4915 -24.4915 -23.0780 -23.0780 -23.0779 -23.0779 -12.3582 -12.3582 -8.5076 -8.5076 -8.4927 -8.4927 -8.4840 -8.4840 -5.8787 -5.8787 -5.8660 -5.8660 -5.7300 -5.7300 -5.2567 -5.2567 -5.2533 -5.2533 -3.4191 -3.4191 -3.4036 -3.4036 -3.3422 -3.3422 -3.3201 -3.3201 -3.2285 -3.2285 -3.1916 -3.1916 -2.0681 -2.0681 -2.0334 -2.0334 -2.0322 -2.0322 5.3764 5.3764 9.0009 9.0009 10.5980 10.5980 10.6628 10.6628 10.8678 10.8678 k = 0.1011 0.1429 0.2476 ( 3925 PWs) bands (ev): -27.9177 -27.9177 -24.5122 -24.5122 -24.4981 -24.4981 -24.4932 -24.4932 -23.0761 -23.0761 -23.0760 -23.0760 -12.3438 -12.3438 -8.5209 -8.5209 -8.5061 -8.5061 -8.4973 -8.4973 -5.8825 -5.8825 -5.8698 -5.8698 -5.7235 -5.7235 -5.2368 -5.2368 -5.2334 -5.2334 -3.4383 -3.4383 -3.3966 -3.3966 -3.3303 -3.3303 -3.3086 -3.3086 -3.2336 -3.2336 -3.1969 -3.1969 -2.0730 -2.0730 -2.0384 -2.0384 -2.0371 -2.0371 5.4208 5.4208 9.0319 9.0319 10.5667 10.5667 10.6305 10.6305 10.8628 10.8628 k = 0.1064 0.1504 0.2606 ( 3922 PWs) bands (ev): -27.9163 -27.9163 -24.5147 -24.5147 -24.4999 -24.4999 -24.4948 -24.4948 -23.0741 -23.0741 -23.0741 -23.0741 -12.3289 -12.3289 -8.5345 -8.5345 -8.5197 -8.5197 -8.5109 -8.5109 -5.8862 -5.8862 -5.8735 -5.8735 -5.7174 -5.7174 -5.2166 -5.2166 -5.2130 -5.2130 -3.4572 -3.4572 -3.3891 -3.3891 -3.3185 -3.3185 -3.2976 -3.2976 -3.2386 -3.2386 -3.2023 -3.2023 -2.0781 -2.0781 -2.0436 -2.0436 -2.0421 -2.0421 5.4660 5.4660 9.0638 9.0638 10.5342 10.5342 10.5971 10.5971 10.8586 10.8586 k = 0.1117 0.1580 0.2736 ( 3910 PWs) bands (ev): -27.9148 -27.9148 -24.5171 -24.5171 -24.5017 -24.5017 -24.4966 -24.4966 -23.0721 -23.0721 -23.0721 -23.0721 -12.3139 -12.3139 -8.5482 -8.5482 -8.5334 -8.5334 -8.5247 -8.5247 -5.8897 -5.8897 -5.8770 -5.8770 -5.7118 -5.7118 -5.1960 -5.1960 -5.1924 -5.1924 -3.4754 -3.4754 -3.3813 -3.3813 -3.3070 -3.3070 -3.2873 -3.2873 -3.2431 -3.2431 -3.2078 -3.2078 -2.0832 -2.0832 -2.0488 -2.0488 -2.0471 -2.0471 5.5118 5.5118 9.0965 9.0965 10.5007 10.5007 10.5626 10.5626 10.8555 10.8555 k = 0.1170 0.1655 0.2866 ( 3919 PWs) bands (ev): -27.9134 -27.9134 -24.5196 -24.5196 -24.5036 -24.5036 -24.4983 -24.4983 -23.0701 -23.0701 -23.0701 -23.0701 -12.2986 -12.2986 -8.5620 -8.5620 -8.5471 -8.5471 -8.5388 -8.5388 -5.8930 -5.8930 -5.8803 -5.8803 -5.7069 -5.7069 -5.1752 -5.1752 -5.1716 -5.1716 -3.4927 -3.4927 -3.3734 -3.3734 -3.2958 -3.2958 -3.2789 -3.2789 -3.2461 -3.2461 -3.2135 -3.2135 -2.0884 -2.0884 -2.0541 -2.0541 -2.0523 -2.0523 5.5580 5.5580 9.1297 9.1297 10.4662 10.4662 10.5272 10.5272 10.8537 10.8537 k = 0.1223 0.1730 0.2997 ( 3895 PWs) bands (ev): -27.9120 -27.9120 -24.5219 -24.5219 -24.5054 -24.5054 -24.5001 -24.5001 -23.0680 -23.0680 -23.0680 -23.0680 -12.2832 -12.2832 -8.5758 -8.5758 -8.5608 -8.5608 -8.5529 -8.5529 -5.8960 -5.8960 -5.8833 -5.8833 -5.7026 -5.7026 -5.1543 -5.1543 -5.1507 -5.1507 -3.5088 -3.5088 -3.3653 -3.3653 -3.2851 -3.2851 -3.2745 -3.2745 -3.2456 -3.2456 -3.2191 -3.2191 -2.0936 -2.0936 -2.0594 -2.0594 -2.0575 -2.0575 5.6045 5.6045 9.1635 9.1635 10.4311 10.4311 10.4911 10.4911 10.8534 10.8534 k = 0.1277 0.1805 0.3127 ( 3895 PWs) bands (ev): -27.9106 -27.9106 -24.5243 -24.5243 -24.5073 -24.5073 -24.5019 -24.5019 -23.0659 -23.0659 -23.0659 -23.0659 -12.2678 -12.2678 -8.5896 -8.5896 -8.5745 -8.5745 -8.5672 -8.5672 -5.8988 -5.8988 -5.8861 -5.8861 -5.6991 -5.6991 -5.1334 -5.1334 -5.1297 -5.1297 -3.5237 -3.5237 -3.3571 -3.3571 -3.2753 -3.2753 -3.2752 -3.2752 -3.2404 -3.2404 -3.2246 -3.2246 -2.0989 -2.0989 -2.0647 -2.0647 -2.0626 -2.0626 5.6509 5.6509 9.1974 9.1974 10.3952 10.3952 10.4543 10.4543 10.8548 10.8548 k = 0.1330 0.1881 0.3257 ( 3907 PWs) bands (ev): -27.9093 -27.9093 -24.5266 -24.5266 -24.5092 -24.5092 -24.5038 -24.5038 -23.0639 -23.0639 -23.0638 -23.0638 -12.2524 -12.2524 -8.6032 -8.6032 -8.5881 -8.5881 -8.5814 -8.5814 -5.9013 -5.9013 -5.8885 -5.8885 -5.6965 -5.6965 -5.1125 -5.1125 -5.1089 -5.1089 -3.5372 -3.5372 -3.3487 -3.3487 -3.2793 -3.2793 -3.2668 -3.2668 -3.2325 -3.2325 -3.2292 -3.2292 -2.1041 -2.1041 -2.0701 -2.0701 -2.0678 -2.0678 5.6971 5.6971 9.2315 9.2315 10.3589 10.3589 10.4170 10.4170 10.8581 10.8581 k = 0.1383 0.1956 0.3388 ( 3907 PWs) bands (ev): -27.9079 -27.9079 -24.5288 -24.5288 -24.5111 -24.5111 -24.5057 -24.5057 -23.0618 -23.0618 -23.0617 -23.0617 -12.2371 -12.2371 -8.6168 -8.6168 -8.6015 -8.6015 -8.5956 -8.5956 -5.9034 -5.9034 -5.8905 -5.8905 -5.6948 -5.6948 -5.0918 -5.0918 -5.0882 -5.0882 -3.5491 -3.5491 -3.3403 -3.3403 -3.2849 -3.2849 -3.2611 -3.2611 -3.2317 -3.2317 -3.2237 -3.2237 -2.1093 -2.1093 -2.0753 -2.0753 -2.0730 -2.0730 5.7428 5.7428 9.2654 9.2654 10.3223 10.3223 10.3794 10.3794 10.8637 10.8637 k = 0.1436 0.2031 0.3518 ( 3901 PWs) bands (ev): -27.9066 -27.9066 -24.5309 -24.5309 -24.5130 -24.5130 -24.5075 -24.5075 -23.0597 -23.0597 -23.0596 -23.0596 -12.2220 -12.2220 -8.6302 -8.6302 -8.6146 -8.6146 -8.6096 -8.6096 -5.9051 -5.9051 -5.8922 -5.8922 -5.6942 -5.6942 -5.0713 -5.0713 -5.0677 -5.0677 -3.5593 -3.5593 -3.3319 -3.3319 -3.2911 -3.2911 -3.2601 -3.2601 -3.2303 -3.2303 -3.2149 -3.2149 -2.1144 -2.1144 -2.0805 -2.0805 -2.0781 -2.0781 5.7880 5.7880 9.2990 9.2990 10.2856 10.2856 10.3417 10.3417 10.8718 10.8718 k = 0.1489 0.2106 0.3648 ( 3913 PWs) bands (ev): -27.9054 -27.9054 -24.5329 -24.5329 -24.5149 -24.5149 -24.5094 -24.5094 -23.0576 -23.0576 -23.0576 -23.0576 -12.2071 -12.2071 -8.6433 -8.6433 -8.6275 -8.6275 -8.6234 -8.6234 -5.9065 -5.9065 -5.8936 -5.8936 -5.6946 -5.6946 -5.0511 -5.0511 -5.0475 -5.0475 -3.5678 -3.5678 -3.3236 -3.3236 -3.2975 -3.2975 -3.2635 -3.2635 -3.2254 -3.2254 -3.2064 -3.2064 -2.1194 -2.1194 -2.0855 -2.0855 -2.0831 -2.0831 5.8323 5.8323 9.3320 9.3320 10.2488 10.2488 10.3039 10.3039 10.8826 10.8826 k = 0.1543 0.2181 0.3778 ( 3913 PWs) bands (ev): -27.9041 -27.9041 -24.5348 -24.5348 -24.5168 -24.5168 -24.5113 -24.5113 -23.0556 -23.0556 -23.0555 -23.0555 -12.1925 -12.1925 -8.6561 -8.6561 -8.6400 -8.6400 -8.6368 -8.6368 -5.9075 -5.9075 -5.8945 -5.8945 -5.6960 -5.6960 -5.0312 -5.0312 -5.0278 -5.0278 -3.5745 -3.5745 -3.3161 -3.3161 -3.3035 -3.3035 -3.2690 -3.2690 -3.2190 -3.2190 -3.1984 -3.1984 -2.1242 -2.1242 -2.0904 -2.0904 -2.0880 -2.0880 5.8756 5.8756 9.3643 9.3643 10.2123 10.2123 10.2664 10.2664 10.8964 10.8964 k = 0.1596 0.2257 0.3909 ( 3907 PWs) bands (ev): -27.9030 -27.9030 -24.5366 -24.5366 -24.5186 -24.5186 -24.5131 -24.5131 -23.0536 -23.0536 -23.0535 -23.0535 -12.1783 -12.1783 -8.6686 -8.6686 -8.6522 -8.6522 -8.6500 -8.6500 -5.9081 -5.9081 -5.8950 -5.8950 -5.6985 -5.6985 -5.0119 -5.0119 -5.0085 -5.0085 -3.5792 -3.5792 -3.3148 -3.3148 -3.3034 -3.3034 -3.2756 -3.2756 -3.2124 -3.2124 -3.1910 -3.1910 -2.1289 -2.1289 -2.0952 -2.0952 -2.0927 -2.0927 5.9176 5.9176 9.3957 9.3957 10.1762 10.1762 10.2292 10.2292 10.9135 10.9135 k = 0.1649 0.2332 0.4039 ( 3907 PWs) bands (ev): -27.9018 -27.9018 -24.5382 -24.5382 -24.5204 -24.5204 -24.5150 -24.5150 -23.0516 -23.0516 -23.0516 -23.0516 -12.1645 -12.1645 -8.6808 -8.6808 -8.6640 -8.6640 -8.6627 -8.6627 -5.9083 -5.9083 -5.8951 -5.8951 -5.7021 -5.7021 -4.9931 -4.9931 -4.9898 -4.9898 -3.5822 -3.5822 -3.3209 -3.3209 -3.2961 -3.2961 -3.2827 -3.2827 -3.2062 -3.2062 -3.1842 -3.1842 -2.1335 -2.1335 -2.0997 -2.0997 -2.0974 -2.0974 5.9583 5.9583 9.4260 9.4260 10.1405 10.1405 10.1925 10.1925 10.9341 10.9341 k = 0.1702 0.2407 0.4169 ( 3901 PWs) bands (ev): -27.9008 -27.9008 -24.5397 -24.5397 -24.5222 -24.5222 -24.5168 -24.5168 -23.0497 -23.0497 -23.0497 -23.0497 -12.1513 -12.1513 -8.6925 -8.6925 -8.6753 -8.6753 -8.6749 -8.6749 -5.9081 -5.9081 -5.8948 -5.8948 -5.7067 -5.7067 -4.9749 -4.9749 -4.9717 -4.9717 -3.5832 -3.5832 -3.3282 -3.3282 -3.2902 -3.2902 -3.2879 -3.2879 -3.2004 -3.2004 -3.1781 -3.1781 -2.1378 -2.1378 -2.1041 -2.1041 -2.1018 -2.1018 5.9973 5.9973 9.4551 9.4551 10.1056 10.1056 10.1566 10.1566 10.9585 10.9585 k = 0.1755 0.2482 0.4300 ( 3913 PWs) bands (ev): -27.8998 -27.8998 -24.5410 -24.5410 -24.5239 -24.5239 -24.5185 -24.5185 -23.0479 -23.0479 -23.0479 -23.0479 -12.1386 -12.1386 -8.7037 -8.7037 -8.6865 -8.6865 -8.6861 -8.6861 -5.9075 -5.9075 -5.8941 -5.8941 -5.7124 -5.7124 -4.9574 -4.9574 -4.9544 -4.9544 -3.5825 -3.5825 -3.3357 -3.3357 -3.2979 -3.2979 -3.2796 -3.2796 -3.1952 -3.1952 -3.1727 -3.1727 -2.1419 -2.1419 -2.1082 -2.1082 -2.1060 -2.1060 6.0346 6.0346 9.4829 9.4829 10.0716 10.0716 10.1214 10.1214 10.9867 10.9867 k = 0.1809 0.2558 0.4430 ( 3913 PWs) bands (ev): -27.8989 -27.8989 -24.5422 -24.5422 -24.5256 -24.5256 -24.5203 -24.5203 -23.0461 -23.0461 -23.0461 -23.0461 -12.1266 -12.1266 -8.7145 -8.7145 -8.6975 -8.6975 -8.6964 -8.6964 -5.9065 -5.9065 -5.8930 -5.8930 -5.7190 -5.7190 -4.9407 -4.9407 -4.9378 -4.9378 -3.5799 -3.5799 -3.3434 -3.3434 -3.3057 -3.3057 -3.2714 -3.2714 -3.1908 -3.1908 -3.1680 -3.1680 -2.1458 -2.1458 -2.1120 -2.1120 -2.1100 -2.1100 6.0700 6.0700 9.5093 9.5093 10.0385 10.0385 10.0874 10.0874 11.0189 11.0189 k = 0.1862 0.2633 0.4560 ( 3916 PWs) bands (ev): -27.8980 -27.8980 -24.5432 -24.5432 -24.5272 -24.5272 -24.5219 -24.5219 -23.0444 -23.0444 -23.0444 -23.0444 -12.1153 -12.1153 -8.7246 -8.7246 -8.7079 -8.7079 -8.7061 -8.7061 -5.9050 -5.9050 -5.8915 -5.8915 -5.7265 -5.7265 -4.9249 -4.9249 -4.9222 -4.9222 -3.5757 -3.5757 -3.3512 -3.3512 -3.3137 -3.3137 -3.2632 -3.2632 -3.1870 -3.1870 -3.1640 -3.1640 -2.1494 -2.1494 -2.1156 -2.1156 -2.1138 -2.1138 6.1032 6.1032 9.5343 9.5343 10.0067 10.0067 10.0544 10.0544 11.0552 11.0552 k = 0.1915 0.2708 0.4691 ( 3916 PWs) bands (ev): -27.8972 -27.8972 -24.5440 -24.5440 -24.5287 -24.5287 -24.5235 -24.5235 -23.0428 -23.0428 -23.0428 -23.0428 -12.1047 -12.1047 -8.7342 -8.7342 -8.7175 -8.7175 -8.7153 -8.7153 -5.9032 -5.9032 -5.8896 -5.8896 -5.7348 -5.7348 -4.9100 -4.9100 -4.9074 -4.9074 -3.5699 -3.5699 -3.3590 -3.3590 -3.3218 -3.3218 -3.2552 -3.2552 -3.1839 -3.1839 -3.1607 -3.1607 -2.1528 -2.1528 -2.1189 -2.1189 -2.1173 -2.1173 6.1342 6.1342 9.5580 9.5580 9.9762 9.9762 10.0228 10.0228 11.0957 11.0957 k = 0.1968 0.2783 0.4821 ( 3913 PWs) bands (ev): -27.8965 -27.8965 -24.5447 -24.5447 -24.5301 -24.5301 -24.5251 -24.5251 -23.0414 -23.0414 -23.0413 -23.0413 -12.0949 -12.0949 -8.7430 -8.7430 -8.7265 -8.7265 -8.7237 -8.7237 -5.9010 -5.9010 -5.8873 -5.8873 -5.7438 -5.7438 -4.8961 -4.8961 -4.8936 -4.8936 -3.5625 -3.5625 -3.3667 -3.3667 -3.3300 -3.3300 -3.2474 -3.2474 -3.1815 -3.1815 -3.1581 -3.1581 -2.1558 -2.1558 -2.1220 -2.1220 -2.1205 -2.1205 6.1628 6.1628 9.5803 9.5803 9.9471 9.9471 9.9926 9.9926 11.1402 11.1402 k = 0.2021 0.2859 0.4951 ( 3913 PWs) bands (ev): -27.8959 -27.8959 -24.5453 -24.5453 -24.5315 -24.5315 -24.5266 -24.5266 -23.0400 -23.0400 -23.0399 -23.0399 -12.0859 -12.0859 -8.7511 -8.7511 -8.7346 -8.7346 -8.7316 -8.7316 -5.8984 -5.8984 -5.8847 -5.8847 -5.7534 -5.7534 -4.8832 -4.8832 -4.8810 -4.8810 -3.5539 -3.5539 -3.3745 -3.3745 -3.3382 -3.3382 -3.2398 -3.2398 -3.1798 -3.1798 -3.1562 -3.1562 -2.1586 -2.1586 -2.1247 -2.1247 -2.1235 -2.1235 6.1890 6.1890 9.6015 9.6015 9.9197 9.9197 9.9640 9.9640 11.1888 11.1888 k = 0.2074 0.2934 0.5081 ( 3907 PWs) bands (ev): -27.8953 -27.8953 -24.5457 -24.5457 -24.5327 -24.5327 -24.5280 -24.5280 -23.0387 -23.0387 -23.0387 -23.0387 -12.0779 -12.0779 -8.7585 -8.7585 -8.7420 -8.7420 -8.7387 -8.7387 -5.8955 -5.8955 -5.8817 -5.8817 -5.7635 -5.7635 -4.8714 -4.8714 -4.8694 -4.8694 -3.5441 -3.5441 -3.3821 -3.3821 -3.3464 -3.3464 -3.2325 -3.2325 -3.1787 -3.1787 -3.1549 -3.1549 -2.1611 -2.1611 -2.1271 -2.1271 -2.1261 -2.1261 6.2125 6.2125 9.6215 9.6215 9.8940 9.8940 9.9371 9.9371 11.2414 11.2414 k = 0.2128 0.3009 0.5212 ( 3913 PWs) bands (ev): -27.8948 -27.8948 -24.5460 -24.5460 -24.5338 -24.5338 -24.5293 -24.5293 -23.0376 -23.0376 -23.0375 -23.0375 -12.0707 -12.0707 -8.7650 -8.7650 -8.7485 -8.7485 -8.7452 -8.7452 -5.8922 -5.8922 -5.8785 -5.8785 -5.7741 -5.7741 -4.8609 -4.8609 -4.8591 -4.8591 -3.5334 -3.5334 -3.3895 -3.3895 -3.3546 -3.3546 -3.2254 -3.2254 -3.1783 -3.1783 -3.1541 -3.1541 -2.1633 -2.1633 -2.1293 -2.1293 -2.1285 -2.1285 6.2333 6.2333 9.6405 9.6405 9.8702 9.8702 9.9119 9.9119 11.2978 11.2978 k = 0.2181 0.3084 0.5342 ( 3910 PWs) bands (ev): -27.8944 -27.8944 -24.5461 -24.5461 -24.5347 -24.5347 -24.5306 -24.5306 -23.0366 -23.0366 -23.0365 -23.0365 -12.0645 -12.0645 -8.7707 -8.7707 -8.7542 -8.7542 -8.7509 -8.7509 -5.8886 -5.8886 -5.8749 -5.8749 -5.7849 -5.7849 -4.8515 -4.8515 -4.8500 -4.8500 -3.5219 -3.5219 -3.3967 -3.3967 -3.3628 -3.3628 -3.2186 -3.2186 -3.1784 -3.1784 -3.1539 -3.1539 -2.1652 -2.1652 -2.1311 -2.1311 -2.1305 -2.1305 6.2514 6.2514 9.6587 9.6587 9.8484 9.8484 9.8886 9.8886 11.3578 11.3578 k = 0.2234 0.3159 0.5472 ( 3910 PWs) bands (ev): -27.8940 -27.8940 -24.5462 -24.5462 -24.5355 -24.5355 -24.5317 -24.5317 -23.0357 -23.0357 -23.0356 -23.0356 -12.0592 -12.0592 -8.7755 -8.7755 -8.7590 -8.7590 -8.7558 -8.7558 -5.8847 -5.8847 -5.8711 -5.8711 -5.7957 -5.7957 -4.8435 -4.8435 -4.8422 -4.8422 -3.5101 -3.5101 -3.4033 -3.4033 -3.3709 -3.3709 -3.2122 -3.2122 -3.1791 -3.1791 -3.1541 -3.1541 -2.1668 -2.1668 -2.1327 -2.1327 -2.1323 -2.1323 6.2667 6.2667 9.6760 9.6760 9.8289 9.8289 9.8672 9.8672 11.4212 11.4212 k = 0.2287 0.3235 0.5603 ( 3916 PWs) bands (ev): -27.8938 -27.8938 -24.5462 -24.5462 -24.5361 -24.5361 -24.5328 -24.5328 -23.0350 -23.0350 -23.0349 -23.0349 -12.0549 -12.0549 -8.7794 -8.7794 -8.7629 -8.7629 -8.7600 -8.7600 -5.8805 -5.8805 -5.8673 -5.8673 -5.8066 -5.8066 -4.8368 -4.8368 -4.8357 -4.8357 -3.4982 -3.4982 -3.4093 -3.4093 -3.3789 -3.3789 -3.2063 -3.2063 -3.1802 -3.1802 -3.1547 -3.1547 -2.1681 -2.1681 -2.1339 -2.1339 -2.1337 -2.1337 6.2791 6.2791 9.6925 9.6925 9.8119 9.8119 9.8479 9.8479 11.4877 11.4877 k = 0.2340 0.3310 0.5733 ( 3913 PWs) bands (ev): -27.8936 -27.8936 -24.5462 -24.5462 -24.5364 -24.5364 -24.5337 -24.5337 -23.0344 -23.0344 -23.0343 -23.0343 -12.0516 -12.0516 -8.7824 -8.7824 -8.7658 -8.7658 -8.7634 -8.7634 -5.8761 -5.8761 -5.8635 -5.8635 -5.8171 -5.8171 -4.8315 -4.8315 -4.8307 -4.8307 -3.4869 -3.4869 -3.4140 -3.4140 -3.3869 -3.3869 -3.2008 -3.2008 -3.1818 -3.1818 -3.1554 -3.1554 -2.1691 -2.1691 -2.1349 -2.1349 -2.1348 -2.1348 6.2888 6.2888 9.7077 9.7077 9.7981 9.7981 9.8306 9.8306 11.5566 11.5566 k = 0.2394 0.3385 0.5863 ( 3892 PWs) bands (ev): -27.8934 -27.8934 -24.5462 -24.5462 -24.5365 -24.5365 -24.5346 -24.5346 -23.0339 -23.0339 -23.0339 -23.0339 -12.0492 -12.0492 -8.7845 -8.7845 -8.7678 -8.7678 -8.7659 -8.7659 -5.8714 -5.8714 -5.8601 -5.8601 -5.8267 -5.8267 -4.8276 -4.8276 -4.8271 -4.8271 -3.4774 -3.4774 -3.4165 -3.4165 -3.3947 -3.3947 -3.1958 -3.1958 -3.1838 -3.1838 -3.1563 -3.1563 -2.1698 -2.1698 -2.1356 -2.1356 -2.1355 -2.1355 6.2956 6.2956 9.7207 9.7207 9.7887 9.7887 9.8155 9.8155 11.6269 11.6269 k = 0.2447 0.3460 0.5993 ( 3892 PWs) bands (ev): -27.8933 -27.8933 -24.5462 -24.5462 -24.5363 -24.5363 -24.5353 -24.5353 -23.0337 -23.0337 -23.0336 -23.0336 -12.0478 -12.0478 -8.7857 -8.7857 -8.7688 -8.7688 -8.7677 -8.7677 -5.8665 -5.8665 -5.8587 -5.8587 -5.8341 -5.8341 -4.8252 -4.8252 -4.8250 -4.8250 -3.4712 -3.4712 -3.4155 -3.4155 -3.4025 -3.4025 -3.1917 -3.1917 -3.1860 -3.1860 -3.1570 -3.1570 -2.1702 -2.1702 -2.1360 -2.1360 -2.1360 -2.1360 6.2996 6.2996 9.7293 9.7293 9.7860 9.7860 9.8025 9.8025 11.6934 11.6934 k = 0.2500 0.3536 0.6124 ( 3892 PWs) bands (ev): -27.8933 -27.8933 -24.5461 -24.5461 -24.5359 -24.5359 -24.5359 -24.5359 -23.0336 -23.0336 -23.0336 -23.0336 -12.0473 -12.0473 -8.7862 -8.7862 -8.7687 -8.7687 -8.7687 -8.7687 -5.8614 -5.8614 -5.8614 -5.8614 -5.8368 -5.8368 -4.8244 -4.8244 -4.8243 -4.8243 -3.4692 -3.4692 -3.4100 -3.4100 -3.4100 -3.4100 -3.1885 -3.1885 -3.1885 -3.1885 -3.1572 -3.1572 -2.1704 -2.1704 -2.1361 -2.1361 -2.1361 -2.1361 6.3010 6.3010 9.7319 9.7319 9.7917 9.7917 9.7917 9.7917 11.7270 11.7270 k = 0.2500 0.3536 0.6124 ( 3892 PWs) bands (ev): -27.8933 -27.8933 -24.5461 -24.5461 -24.5359 -24.5359 -24.5359 -24.5359 -23.0336 -23.0336 -23.0336 -23.0336 -12.0473 -12.0473 -8.7862 -8.7862 -8.7687 -8.7687 -8.7687 -8.7687 -5.8614 -5.8614 -5.8614 -5.8614 -5.8368 -5.8368 -4.8244 -4.8244 -4.8243 -4.8243 -3.4692 -3.4692 -3.4100 -3.4100 -3.4100 -3.4100 -3.1885 -3.1885 -3.1885 -3.1885 -3.1572 -3.1572 -2.1704 -2.1704 -2.1361 -2.1361 -2.1361 -2.1361 6.3010 6.3010 9.7319 9.7319 9.7917 9.7917 9.7917 9.7917 11.7270 11.7270 k = 0.2553 0.3385 0.6124 ( 3892 PWs) bands (ev): -27.8933 -27.8933 -24.5461 -24.5461 -24.5364 -24.5364 -24.5352 -24.5352 -23.0337 -23.0337 -23.0336 -23.0336 -12.0477 -12.0477 -8.7858 -8.7858 -8.7689 -8.7689 -8.7676 -8.7676 -5.8682 -5.8682 -5.8561 -5.8561 -5.8349 -5.8349 -4.8253 -4.8253 -4.8250 -4.8250 -3.4707 -3.4707 -3.4174 -3.4174 -3.4010 -3.4010 -3.1912 -3.1912 -3.1865 -3.1865 -3.1569 -3.1569 -2.1702 -2.1702 -2.1360 -2.1360 -2.1360 -2.1360 6.2996 6.2996 9.7305 9.7305 9.7832 9.7832 9.8041 9.8041 11.7093 11.7093 k = 0.2606 0.3235 0.6124 ( 3898 PWs) bands (ev): -27.8934 -27.8934 -24.5461 -24.5461 -24.5368 -24.5368 -24.5343 -24.5343 -23.0340 -23.0340 -23.0339 -23.0339 -12.0491 -12.0491 -8.7846 -8.7846 -8.7682 -8.7682 -8.7654 -8.7654 -5.8765 -5.8765 -5.8507 -5.8507 -5.8309 -5.8309 -4.8277 -4.8277 -4.8271 -4.8271 -3.4744 -3.4744 -3.4247 -3.4247 -3.3899 -3.3899 -3.1941 -3.1941 -3.1857 -3.1857 -3.1557 -3.1557 -2.1698 -2.1698 -2.1356 -2.1356 -2.1355 -2.1355 6.2958 6.2958 9.7282 9.7282 9.7769 9.7769 9.8201 9.8201 11.6817 11.6817 k = 0.2660 0.3084 0.6124 ( 3910 PWs) bands (ev): -27.8935 -27.8935 -24.5461 -24.5461 -24.5370 -24.5370 -24.5333 -24.5333 -23.0344 -23.0344 -23.0344 -23.0344 -12.0513 -12.0513 -8.7826 -8.7826 -8.7668 -8.7668 -8.7622 -8.7622 -5.8851 -5.8851 -5.8452 -5.8452 -5.8260 -5.8260 -4.8317 -4.8317 -4.8308 -4.8308 -3.4792 -3.4792 -3.4317 -3.4317 -3.3781 -3.3781 -3.1970 -3.1970 -3.1860 -3.1860 -3.1539 -3.1539 -2.1692 -2.1692 -2.1350 -2.1350 -2.1348 -2.1348 6.2895 6.2895 9.7267 9.7267 9.7729 9.7729 9.8381 9.8381 11.6543 11.6543 k = 0.2713 0.2934 0.6124 ( 3910 PWs) bands (ev): -27.8937 -27.8937 -24.5459 -24.5459 -24.5372 -24.5372 -24.5320 -24.5320 -23.0350 -23.0350 -23.0350 -23.0350 -12.0544 -12.0544 -8.7799 -8.7799 -8.7645 -8.7645 -8.7579 -8.7579 -5.8933 -5.8933 -5.8396 -5.8396 -5.8206 -5.8206 -4.8373 -4.8373 -4.8361 -4.8361 -3.4845 -3.4845 -3.4386 -3.4386 -3.3660 -3.3660 -3.2000 -3.2000 -3.1871 -3.1871 -3.1515 -3.1515 -2.1682 -2.1682 -2.1342 -2.1342 -2.1337 -2.1337 6.2810 6.2810 9.7267 9.7267 9.7711 9.7711 9.8575 9.8575 11.6290 11.6290 k = 0.2766 0.2783 0.6124 ( 3916 PWs) bands (ev): -27.8939 -27.8939 -24.5457 -24.5457 -24.5372 -24.5372 -24.5307 -24.5307 -23.0358 -23.0358 -23.0358 -23.0358 -12.0582 -12.0582 -8.7764 -8.7764 -8.7614 -8.7614 -8.7526 -8.7526 -5.9011 -5.9011 -5.8339 -5.8339 -5.8150 -5.8150 -4.8444 -4.8444 -4.8429 -4.8429 -3.4901 -3.4901 -3.4453 -3.4453 -3.3542 -3.3542 -3.2029 -3.2029 -3.1888 -3.1888 -3.1489 -3.1489 -2.1671 -2.1671 -2.1331 -2.1331 -2.1325 -2.1325 6.2703 6.2703 9.7286 9.7286 9.7717 9.7717 9.8779 9.8779 11.6061 11.6061 k = 0.2819 0.2633 0.6124 ( 3910 PWs) bands (ev): -27.8941 -27.8941 -24.5455 -24.5455 -24.5370 -24.5370 -24.5292 -24.5292 -23.0368 -23.0368 -23.0368 -23.0368 -12.0628 -12.0628 -8.7721 -8.7721 -8.7575 -8.7575 -8.7463 -8.7463 -5.9083 -5.9083 -5.8282 -5.8282 -5.8093 -5.8093 -4.8531 -4.8531 -4.8512 -4.8512 -3.4957 -3.4957 -3.4518 -3.4518 -3.3429 -3.3429 -3.2057 -3.2057 -3.1907 -3.1907 -3.1462 -3.1462 -2.1657 -2.1657 -2.1317 -2.1317 -2.1309 -2.1309 6.2575 6.2575 9.7325 9.7325 9.7744 9.7744 9.8993 9.8993 11.5857 11.5857 k = 0.2872 0.2482 0.6124 ( 3916 PWs) bands (ev): -27.8944 -27.8944 -24.5451 -24.5451 -24.5368 -24.5368 -24.5276 -24.5276 -23.0379 -23.0379 -23.0379 -23.0379 -12.0681 -12.0681 -8.7671 -8.7671 -8.7528 -8.7528 -8.7391 -8.7391 -5.9147 -5.9147 -5.8225 -5.8225 -5.8035 -5.8035 -4.8632 -4.8632 -4.8610 -4.8610 -3.5013 -3.5013 -3.4581 -3.4581 -3.3324 -3.3324 -3.2084 -3.2084 -3.1927 -3.1927 -3.1436 -3.1436 -2.1640 -2.1640 -2.1302 -2.1302 -2.1291 -2.1291 6.2430 6.2430 9.7384 9.7384 9.7794 9.7794 9.9216 9.9216 11.5679 11.5679 k = 0.2926 0.2332 0.6124 ( 3922 PWs) bands (ev): -27.8947 -27.8947 -24.5446 -24.5446 -24.5364 -24.5364 -24.5260 -24.5260 -23.0393 -23.0393 -23.0392 -23.0392 -12.0740 -12.0740 -8.7614 -8.7614 -8.7473 -8.7473 -8.7310 -8.7310 -5.9204 -5.9204 -5.8167 -5.8167 -5.7977 -5.7977 -4.8748 -4.8748 -4.8724 -4.8724 -3.5069 -3.5069 -3.4642 -3.4642 -3.3227 -3.3227 -3.2109 -3.2109 -3.1948 -3.1948 -3.1410 -3.1410 -2.1622 -2.1622 -2.1284 -2.1284 -2.1271 -2.1271 6.2267 6.2267 9.7464 9.7464 9.7867 9.7867 9.9446 9.9446 11.5527 11.5527 k = 0.2979 0.2181 0.6124 ( 3922 PWs) bands (ev): -27.8950 -27.8950 -24.5440 -24.5440 -24.5359 -24.5359 -24.5243 -24.5243 -23.0408 -23.0408 -23.0407 -23.0407 -12.0804 -12.0804 -8.7549 -8.7549 -8.7410 -8.7410 -8.7220 -8.7220 -5.9252 -5.9252 -5.8109 -5.8109 -5.7918 -5.7918 -4.8879 -4.8879 -4.8851 -4.8851 -3.5124 -3.5124 -3.4702 -3.4702 -3.3141 -3.3141 -3.2132 -3.2132 -3.1967 -3.1967 -3.1386 -3.1386 -2.1601 -2.1601 -2.1265 -2.1265 -2.1249 -2.1249 6.2089 6.2089 9.7565 9.7565 9.7961 9.7961 9.9684 9.9684 11.5400 11.5400 k = 0.3032 0.2031 0.6124 ( 3928 PWs) bands (ev): -27.8953 -27.8953 -24.5433 -24.5433 -24.5353 -24.5353 -24.5225 -24.5225 -23.0424 -23.0424 -23.0424 -23.0424 -12.0875 -12.0875 -8.7477 -8.7477 -8.7339 -8.7339 -8.7123 -8.7123 -5.9292 -5.9292 -5.8052 -5.8052 -5.7859 -5.7859 -4.9023 -4.9023 -4.8993 -4.8993 -3.5179 -3.5179 -3.4760 -3.4760 -3.3066 -3.3066 -3.2153 -3.2153 -3.1984 -3.1984 -3.1363 -3.1363 -2.1579 -2.1579 -2.1243 -2.1243 -2.1225 -2.1225 6.1898 6.1898 9.7687 9.7687 9.8078 9.8078 9.9929 9.9929 11.5297 11.5297 k = 0.3085 0.1881 0.6124 ( 3928 PWs) bands (ev): -27.8957 -27.8957 -24.5425 -24.5425 -24.5345 -24.5345 -24.5208 -24.5208 -23.0443 -23.0443 -23.0442 -23.0442 -12.0950 -12.0950 -8.7398 -8.7398 -8.7262 -8.7262 -8.7019 -8.7019 -5.9323 -5.9323 -5.7996 -5.7996 -5.7801 -5.7801 -4.9181 -4.9181 -4.9148 -4.9148 -3.5232 -3.5232 -3.4816 -3.4816 -3.3004 -3.3004 -3.2170 -3.2170 -3.1999 -3.1999 -3.1342 -3.1342 -2.1555 -2.1555 -2.1220 -2.1220 -2.1199 -2.1199 6.1695 6.1695 9.7831 9.7831 9.8216 9.8216 10.0181 10.0181 11.5217 11.5217 k = 0.3138 0.1730 0.6124 ( 3931 PWs) bands (ev): -27.8960 -27.8960 -24.5415 -24.5415 -24.5336 -24.5336 -24.5190 -24.5190 -23.0463 -23.0463 -23.0462 -23.0462 -12.1029 -12.1029 -8.7312 -8.7312 -8.7177 -8.7177 -8.6909 -8.6909 -5.9344 -5.9344 -5.7939 -5.7939 -5.7743 -5.7743 -4.9352 -4.9352 -4.9316 -4.9316 -3.5284 -3.5284 -3.4871 -3.4871 -3.2954 -3.2954 -3.2184 -3.2184 -3.2012 -3.2012 -3.1323 -3.1323 -2.1529 -2.1529 -2.1195 -2.1195 -2.1171 -2.1171 6.1482 6.1482 9.7994 9.7994 9.8375 9.8375 10.0439 10.0439 11.5154 11.5154 k = 0.3191 0.1580 0.6124 ( 3928 PWs) bands (ev): -27.8964 -27.8964 -24.5405 -24.5405 -24.5326 -24.5326 -24.5172 -24.5172 -23.0484 -23.0484 -23.0484 -23.0484 -12.1111 -12.1111 -8.7219 -8.7219 -8.7085 -8.7085 -8.6792 -8.6792 -5.9357 -5.9357 -5.7884 -5.7884 -5.7685 -5.7685 -4.9535 -4.9535 -4.9495 -4.9495 -3.5336 -3.5336 -3.4925 -3.4925 -3.2918 -3.2918 -3.2195 -3.2195 -3.2021 -3.2021 -3.1306 -3.1306 -2.1502 -2.1502 -2.1168 -2.1168 -2.1142 -2.1142 6.1260 6.1260 9.8178 9.8178 9.8556 9.8556 10.0703 10.0703 11.5094 11.5094 k = 0.3245 0.1429 0.6124 ( 3922 PWs) bands (ev): -27.8967 -27.8967 -24.5393 -24.5393 -24.5315 -24.5315 -24.5154 -24.5154 -23.0507 -23.0507 -23.0506 -23.0506 -12.1197 -12.1197 -8.7120 -8.7120 -8.6987 -8.6987 -8.6671 -8.6671 -5.9359 -5.9359 -5.7829 -5.7829 -5.7628 -5.7628 -4.9729 -4.9729 -4.9687 -4.9687 -3.5387 -3.5387 -3.4977 -3.4977 -3.2895 -3.2895 -3.2202 -3.2202 -3.2027 -3.2027 -3.1290 -3.1290 -2.1473 -2.1473 -2.1140 -2.1140 -2.1111 -2.1111 6.1032 6.1032 9.8382 9.8382 9.8757 9.8757 10.0973 10.0973 11.4984 11.4984 k = 0.3298 0.1279 0.6124 ( 3922 PWs) bands (ev): -27.8971 -27.8971 -24.5381 -24.5381 -24.5303 -24.5303 -24.5136 -24.5136 -23.0531 -23.0531 -23.0531 -23.0531 -12.1285 -12.1285 -8.7015 -8.7015 -8.6883 -8.6883 -8.6545 -8.6545 -5.9352 -5.9352 -5.7775 -5.7775 -5.7573 -5.7573 -4.9933 -4.9933 -4.9889 -4.9889 -3.5438 -3.5438 -3.5029 -3.5029 -3.2887 -3.2887 -3.2205 -3.2205 -3.2029 -3.2029 -3.1276 -3.1276 -2.1443 -2.1443 -2.1111 -2.1111 -2.1080 -2.1080 6.0798 6.0798 9.8606 9.8606 9.8978 9.8978 10.1247 10.1247 11.4807 11.4807 k = 0.3351 0.1128 0.6124 ( 3925 PWs) bands (ev): -27.8974 -27.8974 -24.5368 -24.5368 -24.5289 -24.5289 -24.5119 -24.5119 -23.0557 -23.0557 -23.0557 -23.0557 -12.1374 -12.1374 -8.6904 -8.6904 -8.6772 -8.6772 -8.6416 -8.6416 -5.9335 -5.9335 -5.7723 -5.7723 -5.7518 -5.7518 -5.0147 -5.0147 -5.0101 -5.0101 -3.5488 -3.5488 -3.5079 -3.5079 -3.2893 -3.2893 -3.2204 -3.2204 -3.2027 -3.2027 -3.1263 -3.1263 -2.1412 -2.1412 -2.1080 -2.1080 -2.1047 -2.1047 6.0560 6.0560 9.8848 9.8848 9.9218 9.9218 10.1525 10.1525 11.4609 11.4609 k = 0.3404 0.0978 0.6124 ( 3928 PWs) bands (ev): -27.8978 -27.8978 -24.5353 -24.5353 -24.5275 -24.5275 -24.5101 -24.5101 -23.0584 -23.0584 -23.0583 -23.0583 -12.1466 -12.1466 -8.6787 -8.6787 -8.6656 -8.6656 -8.6283 -8.6283 -5.9309 -5.9309 -5.7671 -5.7671 -5.7464 -5.7464 -5.0371 -5.0371 -5.0322 -5.0322 -3.5537 -3.5537 -3.5129 -3.5129 -3.2914 -3.2914 -3.2200 -3.2200 -3.2022 -3.2022 -3.1252 -3.1252 -2.1380 -2.1380 -2.1048 -2.1048 -2.1014 -2.1014 6.0319 6.0319 9.9110 9.9110 9.9478 9.9478 10.1807 10.1807 11.4405 11.4405 k = 0.3457 0.0827 0.6124 ( 3922 PWs) bands (ev): -27.8981 -27.8981 -24.5338 -24.5338 -24.5260 -24.5260 -24.5084 -24.5084 -23.0612 -23.0612 -23.0611 -23.0611 -12.1558 -12.1558 -8.6666 -8.6666 -8.6535 -8.6535 -8.6147 -8.6147 -5.9274 -5.9274 -5.7621 -5.7621 -5.7412 -5.7412 -5.0601 -5.0601 -5.0550 -5.0550 -3.5587 -3.5587 -3.5178 -3.5178 -3.2949 -3.2949 -3.2191 -3.2191 -3.2013 -3.2013 -3.1242 -3.1242 -2.1347 -2.1347 -2.1016 -2.1016 -2.0980 -2.0980 6.0077 6.0077 9.9389 9.9389 9.9757 9.9757 10.2092 10.2092 11.4202 11.4202 k = 0.3511 0.0677 0.6124 ( 3925 PWs) bands (ev): -27.8984 -27.8984 -24.5322 -24.5322 -24.5244 -24.5244 -24.5068 -24.5068 -23.0641 -23.0641 -23.0640 -23.0640 -12.1650 -12.1650 -8.6540 -8.6540 -8.6409 -8.6409 -8.6010 -8.6010 -5.9229 -5.9229 -5.7572 -5.7572 -5.7361 -5.7361 -5.0839 -5.0839 -5.0786 -5.0786 -3.5636 -3.5636 -3.5227 -3.5227 -3.2999 -3.2999 -3.2178 -3.2178 -3.2000 -3.2000 -3.1233 -3.1233 -2.1314 -2.1314 -2.0982 -2.0982 -2.0946 -2.0946 5.9835 5.9835 9.9686 9.9686 10.0054 10.0054 10.2379 10.2379 11.4002 11.4002 k = 0.3564 0.0527 0.6124 ( 3925 PWs) bands (ev): -27.8987 -27.8987 -24.5305 -24.5305 -24.5227 -24.5227 -24.5052 -24.5052 -23.0670 -23.0670 -23.0670 -23.0670 -12.1743 -12.1743 -8.6409 -8.6409 -8.6279 -8.6279 -8.5872 -8.5872 -5.9175 -5.9175 -5.7525 -5.7525 -5.7312 -5.7312 -5.1083 -5.1083 -5.1029 -5.1029 -3.5685 -3.5685 -3.5275 -3.5275 -3.3063 -3.3063 -3.2161 -3.2161 -3.1983 -3.1983 -3.1226 -3.1226 -2.1280 -2.1280 -2.0948 -2.0948 -2.0912 -2.0912 5.9594 5.9594 9.9999 9.9999 10.0369 10.0369 10.2667 10.2667 11.3805 11.3805 k = 0.3617 0.0376 0.6124 ( 3931 PWs) bands (ev): -27.8990 -27.8990 -24.5288 -24.5288 -24.5210 -24.5210 -24.5037 -24.5037 -23.0701 -23.0701 -23.0701 -23.0701 -12.1835 -12.1835 -8.6275 -8.6275 -8.6145 -8.6145 -8.5732 -8.5732 -5.9112 -5.9112 -5.7479 -5.7479 -5.7264 -5.7264 -5.1332 -5.1332 -5.1276 -5.1276 -3.5734 -3.5734 -3.5323 -3.5323 -3.3140 -3.3140 -3.2141 -3.2141 -3.1963 -3.1963 -3.1219 -3.1219 -2.1246 -2.1246 -2.0914 -2.0914 -2.0878 -2.0878 5.9356 5.9356 10.0329 10.0329 10.0700 10.0700 10.2955 10.2955 11.3614 11.3614 k = 0.3670 0.0226 0.6124 ( 3931 PWs) bands (ev): -27.8992 -27.8992 -24.5270 -24.5270 -24.5192 -24.5192 -24.5022 -24.5022 -23.0732 -23.0732 -23.0732 -23.0732 -12.1926 -12.1926 -8.6138 -8.6138 -8.6008 -8.6008 -8.5593 -8.5593 -5.9041 -5.9041 -5.7435 -5.7435 -5.7217 -5.7217 -5.1584 -5.1584 -5.1527 -5.1527 -3.5783 -3.5783 -3.5371 -3.5371 -3.3230 -3.3230 -3.2117 -3.2117 -3.1940 -3.1940 -3.1213 -3.1213 -2.1212 -2.1212 -2.0879 -2.0879 -2.0843 -2.0843 5.9120 5.9120 10.0673 10.0673 10.1048 10.1048 10.3244 10.3244 11.3429 11.3429 k = 0.3723 0.0075 0.6124 ( 3943 PWs) bands (ev): -27.8995 -27.8995 -24.5252 -24.5252 -24.5173 -24.5173 -24.5008 -24.5008 -23.0764 -23.0764 -23.0764 -23.0764 -12.2016 -12.2016 -8.5997 -8.5997 -8.5868 -8.5868 -8.5454 -8.5454 -5.8961 -5.8961 -5.7392 -5.7392 -5.7172 -5.7172 -5.1840 -5.1840 -5.1781 -5.1781 -3.5831 -3.5831 -3.5418 -3.5418 -3.3333 -3.3333 -3.2090 -3.2090 -3.1913 -3.1913 -3.1207 -3.1207 -2.1178 -2.1178 -2.0844 -2.0844 -2.0809 -2.0809 5.8888 5.8888 10.1032 10.1032 10.1411 10.1411 10.3531 10.3531 11.3252 11.3252 k = 0.3777-0.0075 0.6124 ( 3943 PWs) bands (ev): -27.8997 -27.8997 -24.5233 -24.5233 -24.5154 -24.5154 -24.4995 -24.4995 -23.0796 -23.0796 -23.0796 -23.0796 -12.2104 -12.2104 -8.5855 -8.5855 -8.5726 -8.5726 -8.5317 -8.5317 -5.8875 -5.8875 -5.7350 -5.7350 -5.7128 -5.7128 -5.2096 -5.2096 -5.2037 -5.2037 -3.5880 -3.5880 -3.5465 -3.5465 -3.3447 -3.3447 -3.2059 -3.2059 -3.1884 -3.1884 -3.1202 -3.1202 -2.1144 -2.1144 -2.0810 -2.0810 -2.0776 -2.0776 5.8662 5.8662 10.1403 10.1403 10.1788 10.1788 10.3816 10.3816 11.3084 11.3084 k = 0.3830-0.0226 0.6124 ( 3931 PWs) bands (ev): -27.8999 -27.8999 -24.5214 -24.5214 -24.5135 -24.5135 -24.4982 -24.4982 -23.0828 -23.0828 -23.0828 -23.0828 -12.2190 -12.2190 -8.5711 -8.5711 -8.5582 -8.5582 -8.5181 -8.5181 -5.8781 -5.8781 -5.7311 -5.7311 -5.7086 -5.7086 -5.2354 -5.2354 -5.2293 -5.2293 -3.5928 -3.5928 -3.5512 -3.5512 -3.3572 -3.3572 -3.2025 -3.2025 -3.1851 -3.1851 -3.1198 -3.1198 -2.1110 -2.1110 -2.0775 -2.0775 -2.0743 -2.0743 5.8441 5.8441 10.1786 10.1786 10.2178 10.2178 10.4098 10.4098 11.2927 11.2927 k = 0.3883-0.0376 0.6124 ( 3925 PWs) bands (ev): -27.9001 -27.9001 -24.5195 -24.5195 -24.5116 -24.5116 -24.4970 -24.4970 -23.0861 -23.0861 -23.0860 -23.0860 -12.2274 -12.2274 -8.5566 -8.5566 -8.5437 -8.5437 -8.5047 -8.5047 -5.8681 -5.8681 -5.7272 -5.7272 -5.7046 -5.7046 -5.2610 -5.2610 -5.2549 -5.2549 -3.5977 -3.5977 -3.5558 -3.5558 -3.3707 -3.3707 -3.1989 -3.1989 -3.1817 -3.1817 -3.1193 -3.1193 -2.1077 -2.1077 -2.0741 -2.0741 -2.0711 -2.0711 5.8226 5.8226 10.2178 10.2178 10.2579 10.2579 10.4377 10.4377 11.2784 11.2784 k = 0.3936-0.0527 0.6124 ( 3913 PWs) bands (ev): -27.9002 -27.9002 -24.5176 -24.5176 -24.5096 -24.5096 -24.4958 -24.4958 -23.0893 -23.0893 -23.0892 -23.0892 -12.2355 -12.2355 -8.5421 -8.5421 -8.5291 -8.5291 -8.4916 -8.4916 -5.8574 -5.8574 -5.7236 -5.7236 -5.7007 -5.7007 -5.2865 -5.2865 -5.2803 -5.2803 -3.6025 -3.6025 -3.5603 -3.5603 -3.3850 -3.3850 -3.1951 -3.1951 -3.1781 -3.1781 -3.1189 -3.1189 -2.1045 -2.1045 -2.0708 -2.0708 -2.0679 -2.0679 5.8018 5.8018 10.2577 10.2577 10.2991 10.2991 10.4651 10.4651 11.2656 11.2656 k = 0.3989-0.0677 0.6124 ( 3907 PWs) bands (ev): -27.9003 -27.9003 -24.5157 -24.5157 -24.5076 -24.5076 -24.4947 -24.4947 -23.0925 -23.0925 -23.0924 -23.0924 -12.2434 -12.2434 -8.5277 -8.5277 -8.5146 -8.5146 -8.4788 -8.4788 -5.8463 -5.8463 -5.7201 -5.7201 -5.6970 -5.6970 -5.3117 -5.3117 -5.3055 -5.3055 -3.6072 -3.6072 -3.5647 -3.5647 -3.4000 -3.4000 -3.1911 -3.1911 -3.1744 -3.1744 -3.1185 -3.1185 -2.1014 -2.1014 -2.0676 -2.0676 -2.0649 -2.0649 5.7818 5.7818 10.2981 10.2981 10.3409 10.3409 10.4920 10.4920 11.2545 11.2545 k = 0.4043-0.0827 0.6124 ( 3913 PWs) bands (ev): -27.9005 -27.9005 -24.5138 -24.5138 -24.5057 -24.5057 -24.4937 -24.4937 -23.0956 -23.0956 -23.0956 -23.0956 -12.2509 -12.2509 -8.5133 -8.5133 -8.5003 -8.5003 -8.4664 -8.4664 -5.8349 -5.8349 -5.7167 -5.7167 -5.6935 -5.6935 -5.3364 -5.3364 -5.3302 -5.3302 -3.6120 -3.6120 -3.5691 -3.5691 -3.4157 -3.4157 -3.1870 -3.1870 -3.1706 -3.1706 -3.1180 -3.1180 -2.0984 -2.0984 -2.0644 -2.0644 -2.0620 -2.0620 5.7625 5.7625 10.3387 10.3387 10.3833 10.3833 10.5183 10.5183 11.2456 11.2456 k = 0.4096-0.0978 0.6124 ( 3913 PWs) bands (ev): -27.9006 -27.9006 -24.5120 -24.5120 -24.5037 -24.5037 -24.4928 -24.4928 -23.0987 -23.0987 -23.0987 -23.0987 -12.2582 -12.2582 -8.4992 -8.4992 -8.4861 -8.4861 -8.4543 -8.4543 -5.8230 -5.8230 -5.7136 -5.7136 -5.6902 -5.6902 -5.3607 -5.3607 -5.3545 -5.3545 -3.6166 -3.6166 -3.5734 -3.5734 -3.4318 -3.4318 -3.1828 -3.1828 -3.1667 -3.1667 -3.1176 -3.1176 -2.0954 -2.0954 -2.0614 -2.0614 -2.0592 -2.0592 5.7441 5.7441 10.3790 10.3790 10.4259 10.4259 10.5439 10.5439 11.2392 11.2392 k = 0.4149-0.1128 0.6124 ( 3913 PWs) bands (ev): -27.9007 -27.9007 -24.5102 -24.5102 -24.5019 -24.5019 -24.4919 -24.4919 -23.1017 -23.1017 -23.1017 -23.1017 -12.2651 -12.2651 -8.4853 -8.4853 -8.4721 -8.4721 -8.4428 -8.4428 -5.8110 -5.8110 -5.7106 -5.7106 -5.6871 -5.6871 -5.3843 -5.3843 -5.3781 -5.3781 -3.6212 -3.6212 -3.5776 -3.5776 -3.4481 -3.4481 -3.1785 -3.1785 -3.1629 -3.1629 -3.1170 -3.1170 -2.0926 -2.0926 -2.0585 -2.0585 -2.0565 -2.0565 5.7266 5.7266 10.4187 10.4187 10.4682 10.4682 10.5689 10.5689 11.2357 11.2357 k = 0.4202-0.1279 0.6124 ( 3919 PWs) bands (ev): -27.9007 -27.9007 -24.5084 -24.5084 -24.5000 -24.5000 -24.4910 -24.4910 -23.1047 -23.1047 -23.1046 -23.1046 -12.2716 -12.2716 -8.4718 -8.4718 -8.4585 -8.4585 -8.4317 -8.4317 -5.7989 -5.7989 -5.7078 -5.7078 -5.6841 -5.6841 -5.4071 -5.4071 -5.4010 -5.4010 -3.6258 -3.6258 -3.5817 -3.5817 -3.4647 -3.4647 -3.1741 -3.1741 -3.1591 -3.1591 -3.1165 -3.1165 -2.0900 -2.0900 -2.0557 -2.0557 -2.0539 -2.0539 5.7100 5.7100 10.4570 10.4570 10.5098 10.5098 10.5932 10.5932 11.2356 11.2356 k = 0.4255-0.1429 0.6124 ( 3919 PWs) bands (ev): -27.9008 -27.9008 -24.5067 -24.5067 -24.4982 -24.4982 -24.4903 -24.4903 -23.1075 -23.1075 -23.1075 -23.1075 -12.2778 -12.2778 -8.4587 -8.4587 -8.4453 -8.4453 -8.4211 -8.4211 -5.7868 -5.7868 -5.7052 -5.7052 -5.6814 -5.6814 -5.4290 -5.4290 -5.4231 -5.4231 -3.6302 -3.6302 -3.5856 -3.5856 -3.4812 -3.4812 -3.1699 -3.1699 -3.1555 -3.1555 -3.1158 -3.1158 -2.0875 -2.0875 -2.0531 -2.0531 -2.0515 -2.0515 5.6944 5.6944 10.4935 10.4935 10.5502 10.5502 10.6168 10.6168 11.2396 11.2396 k = 0.4309-0.1580 0.6124 ( 3919 PWs) bands (ev): -27.9009 -27.9009 -24.5051 -24.5051 -24.4965 -24.4965 -24.4895 -24.4895 -23.1102 -23.1102 -23.1102 -23.1102 -12.2836 -12.2836 -8.4461 -8.4461 -8.4326 -8.4326 -8.4111 -8.4111 -5.7748 -5.7748 -5.7028 -5.7028 -5.6788 -5.6788 -5.4499 -5.4499 -5.4442 -5.4442 -3.6346 -3.6346 -3.5893 -3.5893 -3.4974 -3.4974 -3.1656 -3.1656 -3.1521 -3.1521 -3.1150 -3.1150 -2.0851 -2.0851 -2.0506 -2.0506 -2.0492 -2.0492 5.6797 5.6797 10.5275 10.5275 10.5886 10.5886 10.6397 10.6397 11.2481 11.2481 k = 0.4362-0.1730 0.6124 ( 3925 PWs) bands (ev): -27.9009 -27.9009 -24.5036 -24.5036 -24.4949 -24.4949 -24.4889 -24.4889 -23.1128 -23.1128 -23.1127 -23.1127 -12.2890 -12.2890 -8.4341 -8.4341 -8.4204 -8.4204 -8.4016 -8.4016 -5.7630 -5.7630 -5.7006 -5.7006 -5.6764 -5.6764 -5.4697 -5.4697 -5.4642 -5.4642 -3.6389 -3.6389 -3.5929 -3.5929 -3.5133 -3.5133 -3.1615 -3.1615 -3.1489 -3.1489 -3.1140 -3.1140 -2.0829 -2.0829 -2.0483 -2.0483 -2.0471 -2.0471 5.6661 5.6661 10.5584 10.5584 10.6245 10.6245 10.6617 10.6617 11.2618 11.2618 k = 0.4415-0.1881 0.6124 ( 3919 PWs) bands (ev): -27.9009 -27.9009 -24.5022 -24.5022 -24.4933 -24.4933 -24.4882 -24.4882 -23.1152 -23.1152 -23.1152 -23.1152 -12.2940 -12.2940 -8.4227 -8.4227 -8.4088 -8.4088 -8.3927 -8.3927 -5.7516 -5.7516 -5.6985 -5.6985 -5.6742 -5.6742 -5.4883 -5.4883 -5.4830 -5.4830 -3.6431 -3.6431 -3.5962 -3.5962 -3.5286 -3.5286 -3.1576 -3.1576 -3.1460 -3.1460 -3.1129 -3.1129 -2.0808 -2.0808 -2.0461 -2.0461 -2.0451 -2.0451 5.6534 5.6534 10.5858 10.5858 10.6571 10.6571 10.6827 10.6827 11.2813 11.2813 k = 0.4468-0.2031 0.6124 ( 3914 PWs) bands (ev): -27.9009 -27.9009 -24.5009 -24.5009 -24.4919 -24.4919 -24.4876 -24.4876 -23.1175 -23.1175 -23.1174 -23.1174 -12.2985 -12.2985 -8.4121 -8.4121 -8.3980 -8.3980 -8.3845 -8.3845 -5.7408 -5.7408 -5.6966 -5.6966 -5.6721 -5.6721 -5.5055 -5.5055 -5.5006 -5.5006 -3.6472 -3.6472 -3.5994 -3.5994 -3.5430 -3.5430 -3.1538 -3.1538 -3.1435 -3.1435 -3.1117 -3.1117 -2.0789 -2.0789 -2.0441 -2.0441 -2.0433 -2.0433 5.6418 5.6418 10.6096 10.6096 10.6860 10.6860 10.7022 10.7022 11.3069 11.3069 k = 0.4521-0.2181 0.6124 ( 3914 PWs) bands (ev): -27.9009 -27.9009 -24.4997 -24.4997 -24.4905 -24.4905 -24.4871 -24.4871 -23.1196 -23.1196 -23.1195 -23.1195 -12.3027 -12.3027 -8.4023 -8.4023 -8.3879 -8.3879 -8.3769 -8.3769 -5.7307 -5.7307 -5.6950 -5.6950 -5.6702 -5.6702 -5.5213 -5.5213 -5.5167 -5.5167 -3.6512 -3.6512 -3.6023 -3.6023 -3.5565 -3.5565 -3.1503 -3.1503 -3.1413 -3.1413 -3.1104 -3.1104 -2.0772 -2.0772 -2.0423 -2.0423 -2.0417 -2.0417 5.6313 5.6313 10.6298 10.6298 10.7108 10.7108 10.7201 10.7201 11.3388 11.3388 k = 0.4574-0.2332 0.6124 ( 3926 PWs) bands (ev): -27.9010 -27.9010 -24.4987 -24.4987 -24.4893 -24.4893 -24.4866 -24.4866 -23.1215 -23.1215 -23.1214 -23.1214 -12.3065 -12.3065 -8.3934 -8.3934 -8.3787 -8.3787 -8.3700 -8.3700 -5.7214 -5.7214 -5.6935 -5.6935 -5.6685 -5.6685 -5.5355 -5.5355 -5.5315 -5.5315 -3.6552 -3.6552 -3.6049 -3.6049 -3.5689 -3.5689 -3.1470 -3.1470 -3.1394 -3.1394 -3.1090 -3.1090 -2.0757 -2.0757 -2.0407 -2.0407 -2.0402 -2.0402 5.6218 5.6218 10.6467 10.6467 10.7314 10.7314 10.7358 10.7358 11.3770 11.3770 k = 0.4628-0.2482 0.6124 ( 3932 PWs) bands (ev): -27.9010 -27.9010 -24.4978 -24.4978 -24.4882 -24.4882 -24.4861 -24.4861 -23.1232 -23.1232 -23.1231 -23.1231 -12.3098 -12.3098 -8.3855 -8.3855 -8.3704 -8.3704 -8.3637 -8.3637 -5.7132 -5.7132 -5.6923 -5.6923 -5.6669 -5.6669 -5.5481 -5.5481 -5.5446 -5.5446 -3.6590 -3.6590 -3.6073 -3.6073 -3.5800 -3.5800 -3.1440 -3.1440 -3.1379 -3.1379 -3.1076 -3.1076 -2.0743 -2.0743 -2.0393 -2.0393 -2.0389 -2.0389 5.6135 5.6135 10.6607 10.6607 10.7481 10.7481 10.7494 10.7494 11.4210 11.4210 k = 0.4681-0.2633 0.6124 ( 3932 PWs) bands (ev): -27.9010 -27.9010 -24.4970 -24.4970 -24.4872 -24.4872 -24.4857 -24.4857 -23.1247 -23.1247 -23.1246 -23.1246 -12.3127 -12.3127 -8.3786 -8.3786 -8.3631 -8.3631 -8.3582 -8.3582 -5.7060 -5.7060 -5.6913 -5.6913 -5.6653 -5.6653 -5.5590 -5.5590 -5.5561 -5.5561 -3.6626 -3.6626 -3.6094 -3.6094 -3.5895 -3.5895 -3.1414 -3.1414 -3.1367 -3.1367 -3.1062 -3.1062 -2.0731 -2.0731 -2.0381 -2.0381 -2.0378 -2.0378 5.6062 5.6062 10.6721 10.6721 10.7608 10.7608 10.7612 10.7612 11.4704 11.4704 k = 0.4734-0.2783 0.6124 ( 3920 PWs) bands (ev): -27.9009 -27.9009 -24.4963 -24.4963 -24.4863 -24.4863 -24.4853 -24.4853 -23.1260 -23.1260 -23.1259 -23.1259 -12.3151 -12.3151 -8.3727 -8.3727 -8.3568 -8.3568 -8.3534 -8.3534 -5.7002 -5.7002 -5.6904 -5.6904 -5.6638 -5.6638 -5.5682 -5.5682 -5.5659 -5.5659 -3.6660 -3.6660 -3.6111 -3.6111 -3.5976 -3.5976 -3.1391 -3.1391 -3.1357 -3.1357 -3.1050 -3.1050 -2.0721 -2.0721 -2.0370 -2.0370 -2.0368 -2.0368 5.6000 5.6000 10.6812 10.6812 10.7701 10.7701 10.7712 10.7712 11.5244 11.5244 k = 0.4787-0.2934 0.6124 ( 3911 PWs) bands (ev): -27.9009 -27.9009 -24.4957 -24.4957 -24.4856 -24.4856 -24.4850 -24.4850 -23.1270 -23.1270 -23.1270 -23.1270 -12.3171 -12.3171 -8.3679 -8.3679 -8.3516 -8.3516 -8.3495 -8.3495 -5.6957 -5.6957 -5.6897 -5.6897 -5.6623 -5.6623 -5.5756 -5.5756 -5.5740 -5.5740 -3.6690 -3.6690 -3.6126 -3.6126 -3.6041 -3.6041 -3.1372 -3.1372 -3.1349 -3.1349 -3.1038 -3.1038 -2.0713 -2.0713 -2.0361 -2.0361 -2.0360 -2.0360 5.5950 5.5950 10.6882 10.6882 10.7775 10.7775 10.7786 10.7786 11.5820 11.5820 k = 0.4840-0.3084 0.6124 ( 3899 PWs) bands (ev): -27.9009 -27.9009 -24.4953 -24.4953 -24.4851 -24.4851 -24.4847 -24.4847 -23.1279 -23.1279 -23.1278 -23.1278 -12.3186 -12.3186 -8.3641 -8.3641 -8.3475 -8.3475 -8.3463 -8.3463 -5.6924 -5.6924 -5.6893 -5.6893 -5.6609 -5.6609 -5.5813 -5.5813 -5.5803 -5.5803 -3.6716 -3.6716 -3.6137 -3.6137 -3.6090 -3.6090 -3.1357 -3.1357 -3.1344 -3.1344 -3.1029 -3.1029 -2.0707 -2.0707 -2.0355 -2.0355 -2.0354 -2.0354 5.5910 5.5910 10.6934 10.6934 10.7831 10.7831 10.7839 10.7839 11.6417 11.6418 k = 0.4894-0.3235 0.6124 ( 3884 PWs) bands (ev): -27.9008 -27.9008 -24.4950 -24.4950 -24.4847 -24.4847 -24.4845 -24.4845 -23.1284 -23.1284 -23.1284 -23.1284 -12.3197 -12.3197 -8.3614 -8.3614 -8.3445 -8.3445 -8.3440 -8.3440 -5.6902 -5.6902 -5.6889 -5.6889 -5.6597 -5.6597 -5.5853 -5.5853 -5.5848 -5.5848 -3.6736 -3.6736 -3.6146 -3.6146 -3.6125 -3.6125 -3.1346 -3.1346 -3.1340 -3.1340 -3.1022 -3.1022 -2.0702 -2.0702 -2.0350 -2.0350 -2.0349 -2.0349 5.5882 5.5882 10.6970 10.6970 10.7870 10.7870 10.7874 10.7874 11.7006 11.7007 k = 0.4947-0.3385 0.6124 ( 3884 PWs) bands (ev): -27.9008 -27.9008 -24.4948 -24.4948 -24.4844 -24.4844 -24.4844 -24.4844 -23.1288 -23.1288 -23.1288 -23.1288 -12.3204 -12.3204 -8.3598 -8.3598 -8.3427 -8.3427 -8.3426 -8.3426 -5.6890 -5.6890 -5.6887 -5.6887 -5.6590 -5.6590 -5.5877 -5.5877 -5.5876 -5.5876 -3.6749 -3.6749 -3.6151 -3.6151 -3.6146 -3.6146 -3.1339 -3.1339 -3.1338 -3.1338 -3.1017 -3.1017 -2.0699 -2.0699 -2.0347 -2.0347 -2.0347 -2.0347 5.5865 5.5865 10.6991 10.6991 10.7893 10.7893 10.7894 10.7894 11.7513 11.7519 k = 0.5000-0.3536 0.6124 ( 3884 PWs) bands (ev): -27.9008 -27.9008 -24.4948 -24.4948 -24.4844 -24.4844 -24.4843 -24.4843 -23.1289 -23.1289 -23.1289 -23.1289 -12.3206 -12.3206 -8.3593 -8.3593 -8.3421 -8.3421 -8.3421 -8.3421 -5.6887 -5.6887 -5.6887 -5.6887 -5.6587 -5.6587 -5.5885 -5.5885 -5.5884 -5.5884 -3.6753 -3.6753 -3.6152 -3.6152 -3.6152 -3.6152 -3.1337 -3.1337 -3.1337 -3.1337 -3.1016 -3.1016 -2.0698 -2.0698 -2.0346 -2.0346 -2.0346 -2.0346 5.5860 5.5860 10.6998 10.6998 10.7901 10.7901 10.7901 10.7901 11.7741 11.7741 k = 0.2500 0.3536 0.6124 ( 3892 PWs) bands (ev): -27.8933 -27.8933 -24.5461 -24.5461 -24.5359 -24.5359 -24.5359 -24.5359 -23.0336 -23.0336 -23.0336 -23.0336 -12.0473 -12.0473 -8.7862 -8.7862 -8.7687 -8.7687 -8.7687 -8.7687 -5.8614 -5.8614 -5.8614 -5.8614 -5.8368 -5.8368 -4.8244 -4.8244 -4.8243 -4.8243 -3.4692 -3.4692 -3.4100 -3.4100 -3.4100 -3.4100 -3.1885 -3.1885 -3.1885 -3.1885 -3.1572 -3.1572 -2.1704 -2.1704 -2.1361 -2.1361 -2.1361 -2.1361 6.3010 6.3010 9.7319 9.7319 9.7917 9.7917 9.7917 9.7917 11.7270 11.7270 k = 0.2411 0.3409 0.6124 ( 3892 PWs) bands (ev): -27.8933 -27.8933 -24.5461 -24.5461 -24.5364 -24.5364 -24.5353 -24.5353 -23.0338 -23.0338 -23.0336 -23.0336 -12.0477 -12.0477 -8.7858 -8.7858 -8.7689 -8.7689 -8.7676 -8.7676 -5.8672 -5.8672 -5.8574 -5.8574 -5.8346 -5.8346 -4.8258 -4.8258 -4.8243 -4.8243 -3.4709 -3.4709 -3.4163 -3.4163 -3.4020 -3.4020 -3.1914 -3.1914 -3.1863 -3.1863 -3.1569 -3.1569 -2.1703 -2.1703 -2.1361 -2.1361 -2.1359 -2.1359 6.2997 6.2997 9.7300 9.7300 9.7849 9.7849 9.8028 9.8028 11.7042 11.7042 k = 0.2321 0.3283 0.6124 ( 3892 PWs) bands (ev): -27.8934 -27.8934 -24.5462 -24.5462 -24.5366 -24.5366 -24.5345 -24.5345 -23.0342 -23.0342 -23.0336 -23.0336 -12.0490 -12.0490 -8.7850 -8.7850 -8.7688 -8.7688 -8.7648 -8.7648 -5.8740 -5.8740 -5.8554 -5.8554 -5.8289 -5.8289 -4.8301 -4.8301 -4.8243 -4.8243 -3.4759 -3.4759 -3.4200 -3.4200 -3.3930 -3.3930 -3.1949 -3.1949 -3.1846 -3.1846 -3.1561 -3.1561 -2.1699 -2.1699 -2.1359 -2.1359 -2.1353 -2.1353 6.2960 6.2960 9.7239 9.7239 9.7844 9.7844 9.8162 9.8162 11.6624 11.6624 k = 0.2232 0.3157 0.6124 ( 3908 PWs) bands (ev): -27.8935 -27.8935 -24.5463 -24.5463 -24.5366 -24.5366 -24.5337 -24.5337 -23.0351 -23.0351 -23.0336 -23.0336 -12.0512 -12.0512 -8.7842 -8.7842 -8.7684 -8.7684 -8.7598 -8.7598 -5.8811 -5.8811 -5.8544 -5.8544 -5.8211 -5.8211 -4.8372 -4.8372 -4.8243 -4.8243 -3.4839 -3.4839 -3.4211 -3.4211 -3.3835 -3.3835 -3.1990 -3.1990 -3.1834 -3.1834 -3.1548 -3.1548 -2.1693 -2.1693 -2.1356 -2.1356 -2.1343 -2.1343 6.2900 6.2900 9.7141 9.7141 9.7907 9.7907 9.8308 9.8308 11.6176 11.6176 k = 0.2143 0.3030 0.6124 ( 3912 PWs) bands (ev): -27.8937 -27.8937 -24.5464 -24.5464 -24.5362 -24.5362 -24.5327 -24.5327 -23.0362 -23.0362 -23.0336 -23.0336 -12.0541 -12.0541 -8.7838 -8.7838 -8.7679 -8.7679 -8.7520 -8.7520 -5.8881 -5.8881 -5.8540 -5.8540 -5.8122 -5.8122 -4.8469 -4.8469 -4.8243 -4.8243 -3.4941 -3.4941 -3.4200 -3.4200 -3.3740 -3.3740 -3.2037 -3.2037 -3.1825 -3.1825 -3.1533 -3.1533 -2.1684 -2.1684 -2.1352 -2.1352 -2.1328 -2.1328 6.2816 6.2816 9.7022 9.7022 9.8027 9.8027 9.8462 9.8462 11.5729 11.5729 k = 0.2054 0.2904 0.6124 ( 3916 PWs) bands (ev): -27.8939 -27.8939 -24.5467 -24.5467 -24.5356 -24.5356 -24.5315 -24.5315 -23.0376 -23.0376 -23.0336 -23.0336 -12.0578 -12.0578 -8.7838 -8.7838 -8.7674 -8.7674 -8.7417 -8.7417 -5.8949 -5.8949 -5.8538 -5.8538 -5.8027 -5.8027 -4.8591 -4.8591 -4.8244 -4.8244 -3.5058 -3.5058 -3.4171 -3.4171 -3.3646 -3.3646 -3.2087 -3.2087 -3.1817 -3.1817 -3.1518 -3.1518 -2.1674 -2.1674 -2.1346 -2.1346 -2.1310 -2.1310 6.2712 6.2712 9.6892 9.6892 9.8189 9.8189 9.8624 9.8624 11.5293 11.5293 k = 0.1964 0.2778 0.6124 ( 3920 PWs) bands (ev): -27.8942 -27.8942 -24.5471 -24.5471 -24.5348 -24.5348 -24.5302 -24.5302 -23.0392 -23.0392 -23.0336 -23.0336 -12.0622 -12.0622 -8.7840 -8.7840 -8.7668 -8.7668 -8.7288 -8.7288 -5.9015 -5.9015 -5.8537 -5.8537 -5.7928 -5.7928 -4.8738 -4.8738 -4.8244 -4.8244 -3.5185 -3.5185 -3.4129 -3.4129 -3.3554 -3.3554 -3.2141 -3.2141 -3.1812 -3.1812 -3.1503 -3.1503 -2.1663 -2.1663 -2.1339 -2.1339 -2.1289 -2.1289 6.2589 6.2589 9.6758 9.6758 9.8383 9.8383 9.8795 9.8795 11.4869 11.4869 k = 0.1875 0.2652 0.6124 ( 3916 PWs) bands (ev): -27.8945 -27.8945 -24.5476 -24.5476 -24.5338 -24.5338 -24.5287 -24.5287 -23.0412 -23.0412 -23.0336 -23.0336 -12.0673 -12.0673 -8.7845 -8.7845 -8.7662 -8.7662 -8.7138 -8.7138 -5.9077 -5.9077 -5.8537 -5.8537 -5.7826 -5.7826 -4.8906 -4.8906 -4.8244 -4.8244 -3.5320 -3.5320 -3.4077 -3.4077 -3.3466 -3.3466 -3.2198 -3.2198 -3.1806 -3.1806 -3.1488 -3.1488 -2.1652 -2.1652 -2.1329 -2.1329 -2.1264 -2.1264 6.2448 6.2448 9.6624 9.6624 9.8595 9.8595 9.8984 9.8984 11.4460 11.4460 k = 0.1786 0.2525 0.6124 ( 3928 PWs) bands (ev): -27.8948 -27.8948 -24.5482 -24.5482 -24.5328 -24.5328 -24.5268 -24.5268 -23.0433 -23.0433 -23.0336 -23.0336 -12.0729 -12.0729 -8.7851 -8.7851 -8.7655 -8.7655 -8.6968 -8.6968 -5.9136 -5.9136 -5.8537 -5.8537 -5.7722 -5.7722 -4.9094 -4.9094 -4.8244 -4.8244 -3.5460 -3.5460 -3.4018 -3.4018 -3.3381 -3.3381 -3.2256 -3.2256 -3.1802 -3.1802 -3.1476 -3.1476 -2.1640 -2.1640 -2.1317 -2.1317 -2.1236 -2.1236 6.2293 6.2293 9.6490 9.6490 9.8806 9.8806 9.9201 9.9201 11.4067 11.4067 k = 0.1696 0.2399 0.6124 ( 3924 PWs) bands (ev): -27.8952 -27.8952 -24.5488 -24.5488 -24.5318 -24.5318 -24.5247 -24.5247 -23.0457 -23.0457 -23.0336 -23.0336 -12.0790 -12.0790 -8.7857 -8.7857 -8.7649 -8.7649 -8.6780 -8.6780 -5.9192 -5.9192 -5.8538 -5.8538 -5.7616 -5.7616 -4.9299 -4.9299 -4.8244 -4.8244 -3.5603 -3.5603 -3.3954 -3.3954 -3.3301 -3.3301 -3.2315 -3.2315 -3.1798 -3.1798 -3.1465 -3.1465 -2.1629 -2.1629 -2.1302 -2.1302 -2.1206 -2.1206 6.2125 6.2125 9.6360 9.6360 9.9000 9.9000 9.9459 9.9459 11.3690 11.3690 k = 0.1607 0.2273 0.6124 ( 3924 PWs) bands (ev): -27.8956 -27.8956 -24.5494 -24.5494 -24.5308 -24.5308 -24.5223 -24.5223 -23.0482 -23.0482 -23.0336 -23.0336 -12.0855 -12.0855 -8.7864 -8.7864 -8.7642 -8.7642 -8.6577 -8.6577 -5.9244 -5.9244 -5.8539 -5.8539 -5.7510 -5.7510 -4.9519 -4.9519 -4.8244 -4.8244 -3.5747 -3.5747 -3.3885 -3.3885 -3.3226 -3.3226 -3.2375 -3.2375 -3.1793 -3.1793 -3.1456 -3.1456 -2.1619 -2.1619 -2.1285 -2.1285 -2.1174 -2.1174 6.1949 6.1949 9.6232 9.6232 9.9172 9.9172 9.9757 9.9757 11.3330 11.3330 k = 0.1518 0.2147 0.6124 ( 3926 PWs) bands (ev): -27.8960 -27.8960 -24.5501 -24.5501 -24.5299 -24.5299 -24.5197 -24.5197 -23.0509 -23.0509 -23.0336 -23.0336 -12.0923 -12.0923 -8.7872 -8.7872 -8.7636 -8.7636 -8.6361 -8.6361 -5.9293 -5.9293 -5.8541 -5.8541 -5.7403 -5.7403 -4.9750 -4.9750 -4.8244 -4.8244 -3.5893 -3.5893 -3.3814 -3.3814 -3.3155 -3.3155 -3.2433 -3.2433 -3.1789 -3.1789 -3.1449 -3.1449 -2.1611 -2.1611 -2.1266 -2.1266 -2.1140 -2.1140 6.1765 6.1765 9.6109 9.6109 9.9327 9.9327 10.0084 10.0084 11.2987 11.2987 k = 0.1429 0.2020 0.6124 ( 3920 PWs) bands (ev): -27.8964 -27.8964 -24.5507 -24.5507 -24.5291 -24.5291 -24.5169 -24.5169 -23.0537 -23.0537 -23.0336 -23.0336 -12.0993 -12.0993 -8.7879 -8.7879 -8.7630 -8.7630 -8.6135 -8.6135 -5.9338 -5.9338 -5.8543 -5.8543 -5.7297 -5.7297 -4.9991 -4.9991 -4.8244 -4.8244 -3.6037 -3.6037 -3.3741 -3.3741 -3.3091 -3.3091 -3.2490 -3.2490 -3.1786 -3.1786 -3.1443 -3.1443 -2.1603 -2.1603 -2.1244 -2.1244 -2.1105 -2.1105 6.1577 6.1577 9.5991 9.5991 9.9470 9.9470 10.0430 10.0430 11.2660 11.2660 k = 0.1339 0.1894 0.6124 ( 3916 PWs) bands (ev): -27.8969 -27.8969 -24.5513 -24.5513 -24.5283 -24.5283 -24.5140 -24.5140 -23.0566 -23.0566 -23.0336 -23.0336 -12.1065 -12.1065 -8.7886 -8.7886 -8.7624 -8.7624 -8.5901 -8.5901 -5.9380 -5.9380 -5.8545 -5.8545 -5.7193 -5.7193 -5.0238 -5.0238 -4.8244 -4.8244 -3.6181 -3.6181 -3.3668 -3.3668 -3.3034 -3.3034 -3.2542 -3.2542 -3.1782 -3.1782 -3.1439 -3.1439 -2.1598 -2.1598 -2.1220 -2.1220 -2.1069 -2.1069 6.1387 6.1387 9.5878 9.5878 9.9603 9.9603 10.0789 10.0789 11.2351 11.2351 k = 0.1250 0.1768 0.6124 ( 3912 PWs) bands (ev): -27.8973 -27.8973 -24.5519 -24.5519 -24.5276 -24.5276 -24.5110 -24.5110 -23.0596 -23.0596 -23.0336 -23.0336 -12.1137 -12.1137 -8.7893 -8.7893 -8.7618 -8.7618 -8.5663 -8.5663 -5.9419 -5.9419 -5.8548 -5.8548 -5.7090 -5.7090 -5.0487 -5.0487 -4.8245 -4.8245 -3.6321 -3.6321 -3.3596 -3.3596 -3.2985 -3.2985 -3.2588 -3.2588 -3.1778 -3.1778 -3.1437 -3.1437 -2.1593 -2.1593 -2.1196 -2.1196 -2.1033 -2.1033 6.1197 6.1197 9.5770 9.5770 9.9727 9.9727 10.1154 10.1154 11.2060 11.2060 k = 0.1161 0.1641 0.6124 ( 3908 PWs) bands (ev): -27.8978 -27.8978 -24.5525 -24.5525 -24.5269 -24.5269 -24.5079 -24.5079 -23.0625 -23.0625 -23.0336 -23.0336 -12.1208 -12.1208 -8.7900 -8.7900 -8.7613 -8.7613 -8.5422 -8.5422 -5.9454 -5.9454 -5.8552 -5.8552 -5.6990 -5.6990 -5.0737 -5.0737 -4.8245 -4.8245 -3.6458 -3.6458 -3.3527 -3.3527 -3.2949 -3.2949 -3.2624 -3.2624 -3.1774 -3.1774 -3.1435 -3.1435 -2.1590 -2.1590 -2.1170 -2.1170 -2.0997 -2.0997 6.1011 6.1011 9.5669 9.5669 9.9844 9.9844 10.1518 10.1518 11.1787 11.1787 k = 0.1071 0.1515 0.6124 ( 3912 PWs) bands (ev): -27.8982 -27.8982 -24.5531 -24.5531 -24.5263 -24.5263 -24.5049 -24.5049 -23.0655 -23.0655 -23.0336 -23.0336 -12.1278 -12.1278 -8.7907 -8.7907 -8.7608 -8.7608 -8.5183 -8.5183 -5.9487 -5.9487 -5.8556 -5.8556 -5.6894 -5.6894 -5.0985 -5.0985 -4.8245 -4.8245 -3.6590 -3.6590 -3.3460 -3.3460 -3.2930 -3.2930 -3.2644 -3.2644 -3.1771 -3.1771 -3.1435 -3.1435 -2.1588 -2.1588 -2.1144 -2.1144 -2.0961 -2.0961 6.0830 6.0830 9.5573 9.5573 9.9953 9.9953 10.1877 10.1877 11.1531 11.1531 k = 0.0982 0.1389 0.6124 ( 3918 PWs) bands (ev): -27.8987 -27.8987 -24.5536 -24.5536 -24.5257 -24.5257 -24.5019 -24.5019 -23.0684 -23.0684 -23.0336 -23.0336 -12.1345 -12.1345 -8.7913 -8.7913 -8.7603 -8.7603 -8.4948 -8.4948 -5.9516 -5.9516 -5.8560 -5.8560 -5.6802 -5.6802 -5.1226 -5.1226 -4.8245 -4.8245 -3.6716 -3.6716 -3.3397 -3.3397 -3.2931 -3.2931 -3.2646 -3.2646 -3.1768 -3.1768 -3.1435 -3.1435 -2.1587 -2.1587 -2.1119 -2.1119 -2.0927 -2.0927 6.0656 6.0656 9.5484 9.5484 10.0055 10.0055 10.2227 10.2227 11.1293 11.1293 k = 0.0893 0.1263 0.6124 ( 3912 PWs) bands (ev): -27.8991 -27.8991 -24.5541 -24.5541 -24.5252 -24.5252 -24.4990 -24.4990 -23.0711 -23.0711 -23.0336 -23.0336 -12.1410 -12.1410 -8.7919 -8.7919 -8.7599 -8.7599 -8.4720 -8.4720 -5.9543 -5.9543 -5.8565 -5.8565 -5.6715 -5.6715 -5.1459 -5.1459 -4.8245 -4.8245 -3.6836 -3.6836 -3.3338 -3.3338 -3.2947 -3.2947 -3.2632 -3.2632 -3.1765 -3.1765 -3.1436 -3.1436 -2.1587 -2.1587 -2.1095 -2.1095 -2.0893 -2.0893 6.0491 6.0491 9.5402 9.5402 10.0148 10.0148 10.2563 10.2563 11.1074 11.1074 k = 0.0804 0.1136 0.6124 ( 3912 PWs) bands (ev): -27.8995 -27.8995 -24.5545 -24.5545 -24.5247 -24.5247 -24.4963 -24.4963 -23.0738 -23.0738 -23.0336 -23.0336 -12.1470 -12.1470 -8.7925 -8.7925 -8.7595 -8.7595 -8.4502 -8.4502 -5.9566 -5.9566 -5.8571 -5.8571 -5.6633 -5.6633 -5.1679 -5.1679 -4.8245 -4.8245 -3.6948 -3.6948 -3.3285 -3.3285 -3.2971 -3.2971 -3.2610 -3.2610 -3.1762 -3.1762 -3.1437 -3.1437 -2.1587 -2.1587 -2.1071 -2.1071 -2.0861 -2.0861 6.0337 6.0337 9.5327 9.5327 10.0233 10.0233 10.2881 10.2881 11.0874 11.0874 k = 0.0714 0.1010 0.6124 ( 3912 PWs) bands (ev): -27.8999 -27.8999 -24.5549 -24.5549 -24.5242 -24.5242 -24.4937 -24.4937 -23.0762 -23.0762 -23.0336 -23.0336 -12.1526 -12.1526 -8.7930 -8.7930 -8.7591 -8.7591 -8.4297 -8.4297 -5.9587 -5.9587 -5.8576 -5.8576 -5.6558 -5.6558 -5.1885 -5.1885 -4.8245 -4.8245 -3.7051 -3.7051 -3.3240 -3.3240 -3.2996 -3.2996 -3.2585 -3.2585 -3.1760 -3.1760 -3.1438 -3.1438 -2.1587 -2.1587 -2.1050 -2.1050 -2.0832 -2.0832 6.0195 6.0195 9.5260 9.5260 10.0310 10.0310 10.3178 10.3178 11.0692 11.0692 k = 0.0625 0.0884 0.6124 ( 3914 PWs) bands (ev): -27.9002 -27.9002 -24.5553 -24.5553 -24.5238 -24.5238 -24.4914 -24.4914 -23.0785 -23.0785 -23.0336 -23.0336 -12.1577 -12.1577 -8.7934 -8.7934 -8.7588 -8.7588 -8.4109 -8.4109 -5.9605 -5.9605 -5.8582 -5.8582 -5.6490 -5.6490 -5.2074 -5.2074 -4.8245 -4.8245 -3.7145 -3.7145 -3.3204 -3.3204 -3.3018 -3.3018 -3.2559 -3.2559 -3.1758 -3.1758 -3.1440 -3.1440 -2.1588 -2.1588 -2.1030 -2.1030 -2.0805 -2.0805 6.0067 6.0067 9.5200 9.5200 10.0379 10.0379 10.3449 10.3449 11.0530 11.0530 k = 0.0536 0.0758 0.6124 ( 3918 PWs) bands (ev): -27.9005 -27.9005 -24.5556 -24.5556 -24.5235 -24.5235 -24.4892 -24.4892 -23.0805 -23.0805 -23.0336 -23.0336 -12.1623 -12.1623 -8.7938 -8.7938 -8.7585 -8.7585 -8.3939 -8.3939 -5.9621 -5.9621 -5.8587 -5.8587 -5.6429 -5.6429 -5.2243 -5.2243 -4.8245 -4.8245 -3.7228 -3.7228 -3.3181 -3.3181 -3.3030 -3.3030 -3.2536 -3.2536 -3.1756 -3.1756 -3.1441 -3.1441 -2.1589 -2.1589 -2.1012 -2.1012 -2.0781 -2.0781 5.9953 5.9953 9.5147 9.5147 10.0438 10.0438 10.3692 10.3692 11.0387 11.0387 k = 0.0446 0.0631 0.6124 ( 3910 PWs) bands (ev): -27.9008 -27.9008 -24.5559 -24.5559 -24.5232 -24.5232 -24.4874 -24.4874 -23.0823 -23.0823 -23.0336 -23.0336 -12.1662 -12.1662 -8.7942 -8.7942 -8.7583 -8.7583 -8.3790 -8.3790 -5.9633 -5.9633 -5.8592 -5.8592 -5.6377 -5.6377 -5.2391 -5.2391 -4.8245 -4.8245 -3.7299 -3.7299 -3.3172 -3.3172 -3.3030 -3.3030 -3.2515 -3.2515 -3.1754 -3.1754 -3.1443 -3.1443 -2.1590 -2.1590 -2.0997 -2.0997 -2.0760 -2.0760 5.9856 5.9856 9.5103 9.5103 10.0489 10.0489 10.3903 10.3903 11.0265 11.0265 k = 0.0357 0.0505 0.6124 ( 3906 PWs) bands (ev): -27.9010 -27.9010 -24.5561 -24.5561 -24.5230 -24.5230 -24.4858 -24.4858 -23.0838 -23.0838 -23.0336 -23.0336 -12.1694 -12.1694 -8.7945 -8.7945 -8.7581 -8.7581 -8.3665 -8.3665 -5.9644 -5.9644 -5.8597 -5.8597 -5.6333 -5.6333 -5.2514 -5.2514 -4.8245 -4.8245 -3.7358 -3.7358 -3.3174 -3.3174 -3.3020 -3.3020 -3.2497 -3.2497 -3.1753 -3.1753 -3.1444 -3.1444 -2.1590 -2.1590 -2.0984 -2.0984 -2.0742 -2.0742 5.9774 5.9774 9.5066 9.5066 10.0531 10.0531 10.4080 10.4080 11.0164 11.0164 k = 0.0268 0.0379 0.6124 ( 3914 PWs) bands (ev): -27.9012 -27.9012 -24.5563 -24.5563 -24.5228 -24.5228 -24.4846 -24.4846 -23.0850 -23.0850 -23.0336 -23.0336 -12.1720 -12.1720 -8.7947 -8.7947 -8.7579 -8.7579 -8.3566 -8.3566 -5.9652 -5.9652 -5.8601 -5.8601 -5.6299 -5.6299 -5.2612 -5.2612 -4.8245 -4.8245 -3.7405 -3.7405 -3.3181 -3.3181 -3.3008 -3.3008 -3.2483 -3.2483 -3.1752 -3.1752 -3.1445 -3.1445 -2.1591 -2.1591 -2.0974 -2.0974 -2.0728 -2.0728 5.9711 5.9711 9.5037 9.5037 10.0564 10.0564 10.4220 10.4220 11.0084 11.0084 k = 0.0179 0.0253 0.6124 ( 3910 PWs) bands (ev): -27.9013 -27.9013 -24.5564 -24.5564 -24.5227 -24.5227 -24.4837 -24.4837 -23.0858 -23.0858 -23.0336 -23.0336 -12.1739 -12.1739 -8.7948 -8.7948 -8.7578 -8.7578 -8.3494 -8.3494 -5.9658 -5.9658 -5.8604 -5.8604 -5.6274 -5.6274 -5.2682 -5.2682 -4.8245 -4.8245 -3.7439 -3.7439 -3.3189 -3.3189 -3.2998 -3.2998 -3.2473 -3.2473 -3.1751 -3.1751 -3.1446 -3.1446 -2.1591 -2.1591 -2.0967 -2.0967 -2.0718 -2.0718 5.9665 5.9665 9.5017 9.5017 10.0587 10.0587 10.4322 10.4322 11.0027 11.0027 k = 0.0089 0.0126 0.6124 ( 3914 PWs) bands (ev): -27.9013 -27.9013 -24.5565 -24.5565 -24.5226 -24.5226 -24.4832 -24.4832 -23.0863 -23.0863 -23.0336 -23.0336 -12.1750 -12.1750 -8.7950 -8.7950 -8.7578 -8.7578 -8.3450 -8.3450 -5.9662 -5.9662 -5.8606 -5.8606 -5.6259 -5.6259 -5.2725 -5.2725 -4.8245 -4.8245 -3.7460 -3.7460 -3.3194 -3.3194 -3.2991 -3.2991 -3.2466 -3.2466 -3.1751 -3.1751 -3.1447 -3.1447 -2.1592 -2.1592 -2.0963 -2.0963 -2.0712 -2.0712 5.9637 5.9637 9.5004 9.5004 10.0601 10.0601 10.4383 10.4383 10.9992 10.9992 k = 0.0000 0.0000 0.6124 ( 3918 PWs) bands (ev): -27.9014 -27.9014 -24.5565 -24.5565 -24.5226 -24.5226 -24.4830 -24.4830 -23.0865 -23.0865 -23.0336 -23.0336 -12.1753 -12.1753 -8.7950 -8.7950 -8.7578 -8.7578 -8.3436 -8.3436 -5.9663 -5.9663 -5.8606 -5.8606 -5.6254 -5.6254 -5.2740 -5.2740 -4.8245 -4.8245 -3.7467 -3.7467 -3.3196 -3.3196 -3.2989 -3.2989 -3.2464 -3.2464 -3.1751 -3.1751 -3.1447 -3.1447 -2.1592 -2.1592 -2.0961 -2.0961 -2.0710 -2.0710 5.9628 5.9628 9.5000 9.5000 10.0606 10.0606 10.4404 10.4404 10.9981 10.9981 Writing output data file SF6.save init_run : 0.20s CPU 0.45s WALL ( 1 calls) electrons : 113.62s CPU 115.63s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.07s WALL ( 1 calls) potinit : 0.02s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 113.62s CPU 115.62s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.02s CPU 0.05s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.04s WALL ( 261 calls) cegterg : 104.48s CPU 105.86s WALL ( 325 calls) Called by sum_band: Called by *egterg: h_psi : 66.15s CPU 67.43s WALL ( 5128 calls) s_psi : 2.32s CPU 2.24s WALL ( 5128 calls) g_psi : 0.12s CPU 0.15s WALL ( 4542 calls) cdiaghg : 33.03s CPU 33.24s WALL ( 4803 calls) cegterg:over : 3.70s CPU 3.90s WALL ( 4542 calls) cegterg:upda : 3.06s CPU 3.01s WALL ( 4542 calls) cegterg:last : 2.07s CPU 2.17s WALL ( 847 calls) cdiaghg:chol : 1.82s CPU 1.85s WALL ( 4803 calls) cdiaghg:inve : 1.08s CPU 1.23s WALL ( 4803 calls) cdiaghg:para : 2.02s CPU 2.03s WALL ( 9606 calls) Called by h_psi: h_psi:vloc : 60.02s CPU 61.42s WALL ( 5128 calls) h_psi:vnl : 5.96s CPU 5.84s WALL ( 5128 calls) add_vuspsi : 2.60s CPU 2.61s WALL ( 5128 calls) General routines calbec : 3.34s CPU 3.22s WALL ( 5128 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 56.65s CPU 57.94s WALL ( 565500 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.12s CPU 0.17s WALL ( 522 calls) Parallel routines fft_scatter : 18.64s CPU 18.93s WALL ( 565523 calls) PWSCF : 2m 7.05s CPU 2m23.13s WALL This run was terminated on: 18: 7:44 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=