Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21: 4:18 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: ./O2.save/ 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 55 32 9 1325 574 92 Max 56 33 10 1327 595 96 Sum 2005 1155 345 47737 21107 3383 bravais-lattice index = 14 lattice parameter (alat) = 9.0870 a.u. unit-cell volume = 485.6548 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 1 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.086990 celldm(2)= 1.000000 celldm(3)= 0.764875 celldm(4)= 0.360375 celldm(5)= 0.360375 celldm(6)= 0.332499 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.332499 0.943104 0.000000 ) a(3) = ( 0.275642 0.195091 0.686291 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.352558 -0.301419 ) b(2) = ( 0.000000 1.060329 -0.301419 ) b(3) = ( 0.000000 0.000000 1.457109 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 343 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 2) = ( 0.0111111 0.0078641 -0.0066982), wk = 0.0029155 k( 3) = ( 0.0222222 0.0157282 -0.0133964), wk = 0.0029155 k( 4) = ( 0.0333333 0.0235924 -0.0200946), wk = 0.0029155 k( 5) = ( 0.0444444 0.0314565 -0.0267928), wk = 0.0029155 k( 6) = ( 0.0555556 0.0393206 -0.0334910), wk = 0.0029155 k( 7) = ( 0.0666667 0.0471847 -0.0401892), wk = 0.0029155 k( 8) = ( 0.0777778 0.0550488 -0.0468874), wk = 0.0029155 k( 9) = ( 0.0888889 0.0629130 -0.0535856), wk = 0.0029155 k( 10) = ( 0.1000000 0.0707771 -0.0602838), wk = 0.0029155 k( 11) = ( 0.1111111 0.0786412 -0.0669820), wk = 0.0029155 k( 12) = ( 0.1222222 0.0865053 -0.0736802), wk = 0.0029155 k( 13) = ( 0.1333333 0.0943694 -0.0803784), wk = 0.0029155 k( 14) = ( 0.1444444 0.1022335 -0.0870766), wk = 0.0029155 k( 15) = ( 0.1555556 0.1100977 -0.0937748), wk = 0.0029155 k( 16) = ( 0.1666667 0.1179618 -0.1004730), wk = 0.0029155 k( 17) = ( 0.1777778 0.1258259 -0.1071712), wk = 0.0029155 k( 18) = ( 0.1888889 0.1336900 -0.1138694), wk = 0.0029155 k( 19) = ( 0.2000000 0.1415541 -0.1205676), wk = 0.0029155 k( 20) = ( 0.2111111 0.1494183 -0.1272658), wk = 0.0029155 k( 21) = ( 0.2222222 0.1572824 -0.1339640), wk = 0.0029155 k( 22) = ( 0.2333333 0.1651465 -0.1406622), wk = 0.0029155 k( 23) = ( 0.2444444 0.1730106 -0.1473604), wk = 0.0029155 k( 24) = ( 0.2555556 0.1808747 -0.1540586), wk = 0.0029155 k( 25) = ( 0.2666667 0.1887389 -0.1607568), wk = 0.0029155 k( 26) = ( 0.2777778 0.1966030 -0.1674550), wk = 0.0029155 k( 27) = ( 0.2888889 0.2044671 -0.1741532), wk = 0.0029155 k( 28) = ( 0.3000000 0.2123312 -0.1808514), wk = 0.0029155 k( 29) = ( 0.3111111 0.2201953 -0.1875496), wk = 0.0029155 k( 30) = ( 0.3222222 0.2280594 -0.1942478), wk = 0.0029155 k( 31) = ( 0.3333333 0.2359236 -0.2009460), wk = 0.0029155 k( 32) = ( 0.3444444 0.2437877 -0.2076441), wk = 0.0029155 k( 33) = ( 0.3555556 0.2516518 -0.2143424), wk = 0.0029155 k( 34) = ( 0.3666667 0.2595159 -0.2210406), wk = 0.0029155 k( 35) = ( 0.3777778 0.2673800 -0.2277387), wk = 0.0029155 k( 36) = ( 0.3888889 0.2752442 -0.2344369), wk = 0.0029155 k( 37) = ( 0.4000000 0.2831083 -0.2411351), wk = 0.0029155 k( 38) = ( 0.4111111 0.2909724 -0.2478333), wk = 0.0029155 k( 39) = ( 0.4222222 0.2988365 -0.2545315), wk = 0.0029155 k( 40) = ( 0.4333333 0.3067006 -0.2612297), wk = 0.0029155 k( 41) = ( 0.4444444 0.3145648 -0.2679279), wk = 0.0029155 k( 42) = ( 0.4555556 0.3224289 -0.2746261), wk = 0.0029155 k( 43) = ( 0.4666667 0.3302930 -0.2813243), wk = 0.0029155 k( 44) = ( 0.4777778 0.3381571 -0.2880225), wk = 0.0029155 k( 45) = ( 0.4888889 0.3460212 -0.2947207), wk = 0.0029155 k( 46) = ( 0.5000000 0.3538854 -0.3014189), wk = 0.0029155 k( 47) = ( 0.5000000 0.3538854 -0.3014189), wk = 0.0029155 k( 48) = ( 0.5053611 0.3576798 -0.2880709), wk = 0.0029155 k( 49) = ( 0.5107222 0.3614742 -0.2747230), wk = 0.0029155 k( 50) = ( 0.5160833 0.3652686 -0.2613750), wk = 0.0029155 k( 51) = ( 0.5214444 0.3690630 -0.2480270), wk = 0.0029155 k( 52) = ( 0.5268055 0.3728575 -0.2346790), wk = 0.0029155 k( 53) = ( 0.5321665 0.3766519 -0.2213310), wk = 0.0029155 k( 54) = ( 0.5375276 0.3804463 -0.2079830), wk = 0.0029155 k( 55) = ( 0.5428887 0.3842407 -0.1946351), wk = 0.0029155 k( 56) = ( 0.5482498 0.3880351 -0.1812871), wk = 0.0029155 k( 57) = ( 0.5536109 0.3918296 -0.1679391), wk = 0.0029155 k( 58) = ( 0.5589720 0.3956240 -0.1545911), wk = 0.0029155 k( 59) = ( 0.5643331 0.3994184 -0.1412431), wk = 0.0029155 k( 60) = ( 0.5696942 0.4032128 -0.1278951), wk = 0.0029155 k( 61) = ( 0.5750553 0.4070073 -0.1145472), wk = 0.0029155 k( 62) = ( 0.5804163 0.4108017 -0.1011992), wk = 0.0029155 k( 63) = ( 0.5857774 0.4145961 -0.0878512), wk = 0.0029155 k( 64) = ( 0.5911385 0.4183905 -0.0745032), wk = 0.0029155 k( 65) = ( 0.5964996 0.4221849 -0.0611552), wk = 0.0029155 k( 66) = ( 0.6018607 0.4259794 -0.0478072), wk = 0.0029155 k( 67) = ( 0.6072218 0.4297738 -0.0344593), wk = 0.0029155 k( 68) = ( 0.6125829 0.4335682 -0.0211113), wk = 0.0029155 k( 69) = ( 0.6179440 0.4373626 -0.0077633), wk = 0.0029155 k( 70) = ( 0.6233051 0.4411571 0.0055847), wk = 0.0029155 k( 71) = ( 0.6286662 0.4449515 0.0189327), wk = 0.0029155 k( 72) = ( 0.6340272 0.4487459 0.0322807), wk = 0.0029155 k( 73) = ( 0.6393883 0.4525403 0.0456287), wk = 0.0029155 k( 74) = ( 0.6447494 0.4563347 0.0589766), wk = 0.0029155 k( 75) = ( 0.6501105 0.4601292 0.0723246), wk = 0.0029155 k( 76) = ( 0.6554716 0.4639236 0.0856726), wk = 0.0029155 k( 77) = ( 0.6608327 0.4677180 0.0990206), wk = 0.0029155 k( 78) = ( 0.6661938 0.4715124 0.1123686), wk = 0.0029155 k( 79) = ( 0.6715549 0.4753069 0.1257166), wk = 0.0029155 k( 80) = ( 0.6715549 0.4753069 0.1257166), wk = 0.0029155 k( 81) = ( 0.6646927 0.4704500 0.1377733), wk = 0.0029155 k( 82) = ( 0.6578305 0.4655931 0.1498301), wk = 0.0029155 k( 83) = ( 0.6509683 0.4607363 0.1618868), wk = 0.0029155 k( 84) = ( 0.6441061 0.4558794 0.1739436), wk = 0.0029155 k( 85) = ( 0.6372439 0.4510226 0.1860003), wk = 0.0029155 k( 86) = ( 0.6303817 0.4461657 0.1980571), wk = 0.0029155 k( 87) = ( 0.6235195 0.4413088 0.2101139), wk = 0.0029155 k( 88) = ( 0.6166573 0.4364520 0.2221706), wk = 0.0029155 k( 89) = ( 0.6097951 0.4315951 0.2342274), wk = 0.0029155 k( 90) = ( 0.6029329 0.4267383 0.2462841), wk = 0.0029155 k( 91) = ( 0.5960707 0.4218814 0.2583409), wk = 0.0029155 k( 92) = ( 0.5892085 0.4170245 0.2703976), wk = 0.0029155 k( 93) = ( 0.5823463 0.4121677 0.2824544), wk = 0.0029155 k( 94) = ( 0.5754841 0.4073108 0.2945112), wk = 0.0029155 k( 95) = ( 0.5686219 0.4024539 0.3065679), wk = 0.0029155 k( 96) = ( 0.5617598 0.3975971 0.3186247), wk = 0.0029155 k( 97) = ( 0.5548976 0.3927402 0.3306814), wk = 0.0029155 k( 98) = ( 0.5480354 0.3878834 0.3427382), wk = 0.0029155 k( 99) = ( 0.5411732 0.3830265 0.3547949), wk = 0.0029155 k( 100) = ( 0.5343110 0.3781696 0.3668517), wk = 0.0029155 k( 101) = ( 0.5274488 0.3733128 0.3789085), wk = 0.0029155 k( 102) = ( 0.5205866 0.3684559 0.3909652), wk = 0.0029155 k( 103) = ( 0.5137244 0.3635991 0.4030220), wk = 0.0029155 k( 104) = ( 0.5068622 0.3587422 0.4150787), wk = 0.0029155 k( 105) = ( 0.5000000 0.3538854 0.4271355), wk = 0.0029155 k( 106) = ( 0.5000000 0.3538854 0.4271355), wk = 0.0029155 k( 107) = ( 0.5086081 0.3417231 0.4271355), wk = 0.0029155 k( 108) = ( 0.5172161 0.3295609 0.4271355), wk = 0.0029155 k( 109) = ( 0.5258242 0.3173986 0.4271355), wk = 0.0029155 k( 110) = ( 0.5344323 0.3052364 0.4271355), wk = 0.0029155 k( 111) = ( 0.5430404 0.2930742 0.4271355), wk = 0.0029155 k( 112) = ( 0.5516484 0.2809119 0.4271355), wk = 0.0029155 k( 113) = ( 0.5602565 0.2687497 0.4271355), wk = 0.0029155 k( 114) = ( 0.5688646 0.2565875 0.4271355), wk = 0.0029155 k( 115) = ( 0.5774727 0.2444252 0.4271355), wk = 0.0029155 k( 116) = ( 0.5860808 0.2322630 0.4271355), wk = 0.0029155 k( 117) = ( 0.5946888 0.2201007 0.4271355), wk = 0.0029155 k( 118) = ( 0.6032969 0.2079385 0.4271355), wk = 0.0029155 k( 119) = ( 0.6119050 0.1957763 0.4271355), wk = 0.0029155 k( 120) = ( 0.6205131 0.1836140 0.4271355), wk = 0.0029155 k( 121) = ( 0.6291211 0.1714518 0.4271355), wk = 0.0029155 k( 122) = ( 0.6377292 0.1592896 0.4271355), wk = 0.0029155 k( 123) = ( 0.6463373 0.1471273 0.4271355), wk = 0.0029155 k( 124) = ( 0.6549453 0.1349651 0.4271355), wk = 0.0029155 k( 125) = ( 0.6635534 0.1228028 0.4271355), wk = 0.0029155 k( 126) = ( 0.6721615 0.1106406 0.4271355), wk = 0.0029155 k( 127) = ( 0.6807696 0.0984784 0.4271355), wk = 0.0029155 k( 128) = ( 0.6893776 0.0863161 0.4271355), wk = 0.0029155 k( 129) = ( 0.6979857 0.0741539 0.4271355), wk = 0.0029155 k( 130) = ( 0.7065938 0.0619916 0.4271355), wk = 0.0029155 k( 131) = ( 0.7152019 0.0498294 0.4271355), wk = 0.0029155 k( 132) = ( 0.7238100 0.0376672 0.4271355), wk = 0.0029155 k( 133) = ( 0.7324180 0.0255049 0.4271355), wk = 0.0029155 k( 134) = ( 0.7410261 0.0133427 0.4271355), wk = 0.0029155 k( 135) = ( 0.2589739 -0.3659008 0.7285544), wk = 0.0029155 k( 136) = ( 0.2503414 -0.3537041 0.7285544), wk = 0.0029155 k( 137) = ( 0.2417090 -0.3415075 0.7285544), wk = 0.0029155 k( 138) = ( 0.2330765 -0.3293107 0.7285544), wk = 0.0029155 k( 139) = ( 0.2244440 -0.3171141 0.7285544), wk = 0.0029155 k( 140) = ( 0.2158116 -0.3049174 0.7285544), wk = 0.0029155 k( 141) = ( 0.2071791 -0.2927207 0.7285544), wk = 0.0029155 k( 142) = ( 0.1985466 -0.2805240 0.7285544), wk = 0.0029155 k( 143) = ( 0.1899142 -0.2683273 0.7285544), wk = 0.0029155 k( 144) = ( 0.1812817 -0.2561306 0.7285544), wk = 0.0029155 k( 145) = ( 0.1726493 -0.2439339 0.7285544), wk = 0.0029155 k( 146) = ( 0.1640168 -0.2317372 0.7285544), wk = 0.0029155 k( 147) = ( 0.1553843 -0.2195405 0.7285544), wk = 0.0029155 k( 148) = ( 0.1467519 -0.2073438 0.7285544), wk = 0.0029155 k( 149) = ( 0.1381194 -0.1951471 0.7285544), wk = 0.0029155 k( 150) = ( 0.1294869 -0.1829504 0.7285544), wk = 0.0029155 k( 151) = ( 0.1208545 -0.1707537 0.7285544), wk = 0.0029155 k( 152) = ( 0.1122220 -0.1585570 0.7285544), wk = 0.0029155 k( 153) = ( 0.1035896 -0.1463603 0.7285544), wk = 0.0029155 k( 154) = ( 0.0949571 -0.1341636 0.7285544), wk = 0.0029155 k( 155) = ( 0.0863246 -0.1219669 0.7285544), wk = 0.0029155 k( 156) = ( 0.0776922 -0.1097703 0.7285544), wk = 0.0029155 k( 157) = ( 0.0690597 -0.0975736 0.7285544), wk = 0.0029155 k( 158) = ( 0.0604272 -0.0853769 0.7285544), wk = 0.0029155 k( 159) = ( 0.0517948 -0.0731802 0.7285544), wk = 0.0029155 k( 160) = ( 0.0431623 -0.0609835 0.7285544), wk = 0.0029155 k( 161) = ( 0.0345299 -0.0487868 0.7285544), wk = 0.0029155 k( 162) = ( 0.0258974 -0.0365901 0.7285544), wk = 0.0029155 k( 163) = ( 0.0172649 -0.0243934 0.7285544), wk = 0.0029155 k( 164) = ( 0.0086325 -0.0121967 0.7285544), wk = 0.0029155 k( 165) = ( 0.0000000 0.0000000 0.7285544), wk = 0.0029155 k( 166) = ( 0.0000000 0.0000000 0.7285544), wk = 0.0029155 k( 167) = ( 0.0121646 0.0086098 0.7285544), wk = 0.0029155 k( 168) = ( 0.0243293 0.0172195 0.7285544), wk = 0.0029155 k( 169) = ( 0.0364939 0.0258293 0.7285544), wk = 0.0029155 k( 170) = ( 0.0486585 0.0344391 0.7285544), wk = 0.0029155 k( 171) = ( 0.0608232 0.0430489 0.7285544), wk = 0.0029155 k( 172) = ( 0.0729878 0.0516586 0.7285544), wk = 0.0029155 k( 173) = ( 0.0851524 0.0602684 0.7285544), wk = 0.0029155 k( 174) = ( 0.0973171 0.0688782 0.7285544), wk = 0.0029155 k( 175) = ( 0.1094817 0.0774879 0.7285544), wk = 0.0029155 k( 176) = ( 0.1216464 0.0860977 0.7285544), wk = 0.0029155 k( 177) = ( 0.1338110 0.0947075 0.7285544), wk = 0.0029155 k( 178) = ( 0.1459756 0.1033173 0.7285544), wk = 0.0029155 k( 179) = ( 0.1581403 0.1119270 0.7285544), wk = 0.0029155 k( 180) = ( 0.1703049 0.1205368 0.7285544), wk = 0.0029155 k( 181) = ( 0.1824695 0.1291466 0.7285544), wk = 0.0029155 k( 182) = ( 0.1946342 0.1377564 0.7285544), wk = 0.0029155 k( 183) = ( 0.2067988 0.1463661 0.7285544), wk = 0.0029155 k( 184) = ( 0.2189634 0.1549759 0.7285544), wk = 0.0029155 k( 185) = ( 0.2311281 0.1635857 0.7285544), wk = 0.0029155 k( 186) = ( 0.2432927 0.1721954 0.7285544), wk = 0.0029155 k( 187) = ( 0.2554573 0.1808052 0.7285544), wk = 0.0029155 k( 188) = ( 0.2676220 0.1894150 0.7285544), wk = 0.0029155 k( 189) = ( 0.2797866 0.1980248 0.7285544), wk = 0.0029155 k( 190) = ( 0.2919512 0.2066345 0.7285544), wk = 0.0029155 k( 191) = ( 0.3041159 0.2152443 0.7285544), wk = 0.0029155 k( 192) = ( 0.3162805 0.2238541 0.7285544), wk = 0.0029155 k( 193) = ( 0.3284451 0.2324638 0.7285544), wk = 0.0029155 k( 194) = ( 0.5000000 0.3538854 -0.3014189), wk = 0.0029155 k( 195) = ( 0.5085857 0.3417547 -0.3014189), wk = 0.0029155 k( 196) = ( 0.5171714 0.3296241 -0.3014189), wk = 0.0029155 k( 197) = ( 0.5257571 0.3174934 -0.3014189), wk = 0.0029155 k( 198) = ( 0.5343428 0.3053628 -0.3014189), wk = 0.0029155 k( 199) = ( 0.5429285 0.2932322 -0.3014189), wk = 0.0029155 k( 200) = ( 0.5515142 0.2811015 -0.3014189), wk = 0.0029155 k( 201) = ( 0.5601000 0.2689709 -0.3014189), wk = 0.0029155 k( 202) = ( 0.5686857 0.2568403 -0.3014189), wk = 0.0029155 k( 203) = ( 0.5772714 0.2447096 -0.3014189), wk = 0.0029155 k( 204) = ( 0.5858571 0.2325790 -0.3014189), wk = 0.0029155 k( 205) = ( 0.5944428 0.2204484 -0.3014189), wk = 0.0029155 k( 206) = ( 0.4055572 -0.5730065 -0.0000000), wk = 0.0029155 k( 207) = ( 0.3967407 -0.5605498 -0.0000000), wk = 0.0029155 k( 208) = ( 0.3879243 -0.5480932 -0.0000000), wk = 0.0029155 k( 209) = ( 0.3791078 -0.5356365 -0.0000000), wk = 0.0029155 k( 210) = ( 0.3702914 -0.5231798 -0.0000000), wk = 0.0029155 k( 211) = ( 0.3614749 -0.5107232 -0.0000000), wk = 0.0029155 k( 212) = ( 0.3526584 -0.4982665 -0.0000000), wk = 0.0029155 k( 213) = ( 0.3438420 -0.4858099 -0.0000000), wk = 0.0029155 k( 214) = ( 0.3350255 -0.4733532 -0.0000000), wk = 0.0029155 k( 215) = ( 0.3262091 -0.4608965 -0.0000000), wk = 0.0029155 k( 216) = ( 0.3173926 -0.4484399 -0.0000000), wk = 0.0029155 k( 217) = ( 0.3085761 -0.4359832 -0.0000000), wk = 0.0029155 k( 218) = ( 0.2997597 -0.4235265 -0.0000000), wk = 0.0029155 k( 219) = ( 0.2909432 -0.4110699 -0.0000000), wk = 0.0029155 k( 220) = ( 0.2821267 -0.3986132 -0.0000000), wk = 0.0029155 k( 221) = ( 0.2733103 -0.3861565 -0.0000000), wk = 0.0029155 k( 222) = ( 0.2644938 -0.3736999 -0.0000000), wk = 0.0029155 k( 223) = ( 0.2556774 -0.3612432 -0.0000000), wk = 0.0029155 k( 224) = ( 0.2468609 -0.3487866 -0.0000000), wk = 0.0029155 k( 225) = ( 0.2380444 -0.3363299 -0.0000000), wk = 0.0029155 k( 226) = ( 0.2292280 -0.3238732 -0.0000000), wk = 0.0029155 k( 227) = ( 0.2204115 -0.3114166 -0.0000000), wk = 0.0029155 k( 228) = ( 0.2115951 -0.2989599 -0.0000000), wk = 0.0029155 k( 229) = ( 0.2027786 -0.2865032 -0.0000000), wk = 0.0029155 k( 230) = ( 0.1939621 -0.2740466 -0.0000000), wk = 0.0029155 k( 231) = ( 0.1851457 -0.2615899 -0.0000000), wk = 0.0029155 k( 232) = ( 0.1763292 -0.2491333 -0.0000000), wk = 0.0029155 k( 233) = ( 0.1675128 -0.2366766 -0.0000000), wk = 0.0029155 k( 234) = ( 0.1586963 -0.2242199 -0.0000000), wk = 0.0029155 k( 235) = ( 0.1498798 -0.2117633 -0.0000000), wk = 0.0029155 k( 236) = ( 0.1410634 -0.1993066 -0.0000000), wk = 0.0029155 k( 237) = ( 0.1322469 -0.1868499 -0.0000000), wk = 0.0029155 k( 238) = ( 0.1234304 -0.1743933 -0.0000000), wk = 0.0029155 k( 239) = ( 0.1146140 -0.1619366 -0.0000000), wk = 0.0029155 k( 240) = ( 0.1057975 -0.1494800 -0.0000000), wk = 0.0029155 k( 241) = ( 0.0969811 -0.1370233 -0.0000000), wk = 0.0029155 k( 242) = ( 0.0881646 -0.1245666 -0.0000000), wk = 0.0029155 k( 243) = ( 0.0793482 -0.1121100 -0.0000000), wk = 0.0029155 k( 244) = ( 0.0705317 -0.0996533 -0.0000000), wk = 0.0029155 k( 245) = ( 0.0617152 -0.0871966 -0.0000000), wk = 0.0029155 k( 246) = ( 0.0528988 -0.0747400 -0.0000000), wk = 0.0029155 k( 247) = ( 0.0440823 -0.0622833 -0.0000000), wk = 0.0029155 k( 248) = ( 0.0352658 -0.0498266 -0.0000000), wk = 0.0029155 k( 249) = ( 0.0264494 -0.0373700 -0.0000000), wk = 0.0029155 k( 250) = ( 0.0176329 -0.0249133 -0.0000000), wk = 0.0029155 k( 251) = ( 0.0088165 -0.0124567 -0.0000000), wk = 0.0029155 k( 252) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 253) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 254) = ( 0.0135135 -0.0047643 -0.0040732), wk = 0.0029155 k( 255) = ( 0.0270270 -0.0095286 -0.0081465), wk = 0.0029155 k( 256) = ( 0.0405405 -0.0142929 -0.0122197), wk = 0.0029155 k( 257) = ( 0.0540540 -0.0190572 -0.0162929), wk = 0.0029155 k( 258) = ( 0.0675676 -0.0238215 -0.0203661), wk = 0.0029155 k( 259) = ( 0.0810811 -0.0285858 -0.0244394), wk = 0.0029155 k( 260) = ( 0.0945946 -0.0333501 -0.0285126), wk = 0.0029155 k( 261) = ( 0.1081081 -0.0381144 -0.0325858), wk = 0.0029155 k( 262) = ( 0.1216216 -0.0428787 -0.0366591), wk = 0.0029155 k( 263) = ( 0.1351351 -0.0476430 -0.0407323), wk = 0.0029155 k( 264) = ( 0.1486486 -0.0524073 -0.0448055), wk = 0.0029155 k( 265) = ( 0.1621622 -0.0571716 -0.0488787), wk = 0.0029155 k( 266) = ( 0.1756757 -0.0619359 -0.0529520), wk = 0.0029155 k( 267) = ( 0.1891892 -0.0667002 -0.0570252), wk = 0.0029155 k( 268) = ( 0.2027027 -0.0714645 -0.0610984), wk = 0.0029155 k( 269) = ( 0.2162162 -0.0762288 -0.0651717), wk = 0.0029155 k( 270) = ( 0.2297297 -0.0809931 -0.0692449), wk = 0.0029155 k( 271) = ( 0.2432432 -0.0857574 -0.0733181), wk = 0.0029155 k( 272) = ( 0.2567568 -0.0905217 -0.0773913), wk = 0.0029155 k( 273) = ( 0.2702703 -0.0952860 -0.0814646), wk = 0.0029155 k( 274) = ( 0.2837838 -0.1000503 -0.0855378), wk = 0.0029155 k( 275) = ( 0.2972973 -0.1048146 -0.0896110), wk = 0.0029155 k( 276) = ( 0.3108108 -0.1095789 -0.0936843), wk = 0.0029155 k( 277) = ( 0.3243243 -0.1143432 -0.0977575), wk = 0.0029155 k( 278) = ( 0.3378378 -0.1191075 -0.1018307), wk = 0.0029155 k( 279) = ( 0.3513514 -0.1238718 -0.1059039), wk = 0.0029155 k( 280) = ( 0.3648649 -0.1286361 -0.1099772), wk = 0.0029155 k( 281) = ( 0.3783784 -0.1334004 -0.1140504), wk = 0.0029155 k( 282) = ( 0.3918919 -0.1381647 -0.1181236), wk = 0.0029155 k( 283) = ( 0.4054054 -0.1429290 -0.1221969), wk = 0.0029155 k( 284) = ( 0.4189189 -0.1476933 -0.1262701), wk = 0.0029155 k( 285) = ( 0.4324324 -0.1524576 -0.1303433), wk = 0.0029155 k( 286) = ( 0.4459459 -0.1572219 -0.1344166), wk = 0.0029155 k( 287) = ( 0.4594595 -0.1619862 -0.1384898), wk = 0.0029155 k( 288) = ( 0.4729730 -0.1667505 -0.1425630), wk = 0.0029155 k( 289) = ( 0.4864865 -0.1715148 -0.1466362), wk = 0.0029155 k( 290) = ( 0.5000000 -0.1762791 -0.1507095), wk = 0.0029155 k( 291) = ( 0.5000000 -0.1762791 0.5778450), wk = 0.0029155 k( 292) = ( 0.4903846 -0.1728891 0.5667326), wk = 0.0029155 k( 293) = ( 0.4807692 -0.1694991 0.5556201), wk = 0.0029155 k( 294) = ( 0.4711538 -0.1661091 0.5445077), wk = 0.0029155 k( 295) = ( 0.4615385 -0.1627191 0.5333953), wk = 0.0029155 k( 296) = ( 0.4519231 -0.1593292 0.5222829), wk = 0.0029155 k( 297) = ( 0.4423077 -0.1559392 0.5111705), wk = 0.0029155 k( 298) = ( 0.4326923 -0.1525492 0.5000581), wk = 0.0029155 k( 299) = ( 0.4230769 -0.1491592 0.4889457), wk = 0.0029155 k( 300) = ( 0.4134615 -0.1457692 0.4778333), wk = 0.0029155 k( 301) = ( 0.4038462 -0.1423792 0.4667209), wk = 0.0029155 k( 302) = ( 0.3942308 -0.1389893 0.4556085), wk = 0.0029155 k( 303) = ( 0.3846154 -0.1355993 0.4444961), wk = 0.0029155 k( 304) = ( 0.3750000 -0.1322093 0.4333837), wk = 0.0029155 k( 305) = ( 0.3653846 -0.1288193 0.4222713), wk = 0.0029155 k( 306) = ( 0.3557692 -0.1254293 0.4111589), wk = 0.0029155 k( 307) = ( 0.3461538 -0.1220394 0.4000465), wk = 0.0029155 k( 308) = ( 0.3365385 -0.1186494 0.3889341), wk = 0.0029155 k( 309) = ( 0.3269231 -0.1152594 0.3778217), wk = 0.0029155 k( 310) = ( 0.3173077 -0.1118694 0.3667093), wk = 0.0029155 k( 311) = ( 0.3076923 -0.1084794 0.3555969), wk = 0.0029155 k( 312) = ( 0.2980769 -0.1050894 0.3444845), wk = 0.0029155 k( 313) = ( 0.2884615 -0.1016995 0.3333721), wk = 0.0029155 k( 314) = ( 0.2788462 -0.0983095 0.3222597), wk = 0.0029155 k( 315) = ( 0.2692308 -0.0949195 0.3111473), wk = 0.0029155 k( 316) = ( 0.2596154 -0.0915295 0.3000349), wk = 0.0029155 k( 317) = ( 0.2500000 -0.0881395 0.2889225), wk = 0.0029155 k( 318) = ( 0.2403846 -0.0847496 0.2778101), wk = 0.0029155 k( 319) = ( 0.2307692 -0.0813596 0.2666977), wk = 0.0029155 k( 320) = ( 0.2211539 -0.0779696 0.2555853), wk = 0.0029155 k( 321) = ( 0.2115385 -0.0745796 0.2444729), wk = 0.0029155 k( 322) = ( 0.2019231 -0.0711896 0.2333605), wk = 0.0029155 k( 323) = ( 0.1923077 -0.0677996 0.2222481), wk = 0.0029155 k( 324) = ( 0.1826923 -0.0644097 0.2111357), wk = 0.0029155 k( 325) = ( 0.1730769 -0.0610197 0.2000232), wk = 0.0029155 k( 326) = ( 0.1634615 -0.0576297 0.1889109), wk = 0.0029155 k( 327) = ( 0.1538461 -0.0542397 0.1777984), wk = 0.0029155 k( 328) = ( 0.1442308 -0.0508497 0.1666860), wk = 0.0029155 k( 329) = ( 0.1346154 -0.0474597 0.1555736), wk = 0.0029155 k( 330) = ( 0.1250000 -0.0440698 0.1444612), wk = 0.0029155 k( 331) = ( 0.1153846 -0.0406798 0.1333488), wk = 0.0029155 k( 332) = ( 0.1057692 -0.0372898 0.1222364), wk = 0.0029155 k( 333) = ( 0.0961538 -0.0338998 0.1111240), wk = 0.0029155 k( 334) = ( 0.0865385 -0.0305098 0.1000116), wk = 0.0029155 k( 335) = ( 0.0769231 -0.0271199 0.0888992), wk = 0.0029155 k( 336) = ( 0.0673077 -0.0237299 0.0777868), wk = 0.0029155 k( 337) = ( 0.0576923 -0.0203399 0.0666744), wk = 0.0029155 k( 338) = ( 0.0480769 -0.0169499 0.0555620), wk = 0.0029155 k( 339) = ( 0.0384615 -0.0135599 0.0444496), wk = 0.0029155 k( 340) = ( 0.0288462 -0.0101699 0.0333372), wk = 0.0029155 k( 341) = ( 0.0192308 -0.0067800 0.0222248), wk = 0.0029155 k( 342) = ( 0.0096154 -0.0033900 0.0111124), wk = 0.0029155 k( 343) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 2) = ( 0.0111111 0.0111111 0.0000000), wk = 0.0029155 k( 3) = ( 0.0222222 0.0222222 0.0000000), wk = 0.0029155 k( 4) = ( 0.0333333 0.0333333 0.0000000), wk = 0.0029155 k( 5) = ( 0.0444444 0.0444444 0.0000000), wk = 0.0029155 k( 6) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0029155 k( 7) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0029155 k( 8) = ( 0.0777778 0.0777778 0.0000000), wk = 0.0029155 k( 9) = ( 0.0888889 0.0888889 0.0000000), wk = 0.0029155 k( 10) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0029155 k( 11) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0029155 k( 12) = ( 0.1222222 0.1222222 -0.0000000), wk = 0.0029155 k( 13) = ( 0.1333333 0.1333333 0.0000000), wk = 0.0029155 k( 14) = ( 0.1444444 0.1444444 0.0000000), wk = 0.0029155 k( 15) = ( 0.1555556 0.1555556 0.0000000), wk = 0.0029155 k( 16) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0029155 k( 17) = ( 0.1777778 0.1777778 0.0000000), wk = 0.0029155 k( 18) = ( 0.1888889 0.1888889 0.0000000), wk = 0.0029155 k( 19) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0029155 k( 20) = ( 0.2111111 0.2111111 -0.0000000), wk = 0.0029155 k( 21) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0029155 k( 22) = ( 0.2333333 0.2333333 0.0000000), wk = 0.0029155 k( 23) = ( 0.2444444 0.2444444 -0.0000000), wk = 0.0029155 k( 24) = ( 0.2555556 0.2555556 0.0000000), wk = 0.0029155 k( 25) = ( 0.2666667 0.2666667 0.0000000), wk = 0.0029155 k( 26) = ( 0.2777778 0.2777778 0.0000000), wk = 0.0029155 k( 27) = ( 0.2888889 0.2888889 0.0000000), wk = 0.0029155 k( 28) = ( 0.3000000 0.3000000 0.0000000), wk = 0.0029155 k( 29) = ( 0.3111111 0.3111111 0.0000000), wk = 0.0029155 k( 30) = ( 0.3222222 0.3222222 0.0000000), wk = 0.0029155 k( 31) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0029155 k( 32) = ( 0.3444444 0.3444444 0.0000000), wk = 0.0029155 k( 33) = ( 0.3555556 0.3555556 0.0000000), wk = 0.0029155 k( 34) = ( 0.3666667 0.3666667 0.0000000), wk = 0.0029155 k( 35) = ( 0.3777778 0.3777778 0.0000000), wk = 0.0029155 k( 36) = ( 0.3888889 0.3888889 0.0000000), wk = 0.0029155 k( 37) = ( 0.4000000 0.4000000 0.0000000), wk = 0.0029155 k( 38) = ( 0.4111111 0.4111111 0.0000000), wk = 0.0029155 k( 39) = ( 0.4222222 0.4222222 -0.0000000), wk = 0.0029155 k( 40) = ( 0.4333333 0.4333333 0.0000000), wk = 0.0029155 k( 41) = ( 0.4444444 0.4444444 0.0000000), wk = 0.0029155 k( 42) = ( 0.4555556 0.4555556 0.0000000), wk = 0.0029155 k( 43) = ( 0.4666667 0.4666667 0.0000000), wk = 0.0029155 k( 44) = ( 0.4777778 0.4777778 0.0000000), wk = 0.0029155 k( 45) = ( 0.4888889 0.4888889 0.0000000), wk = 0.0029155 k( 46) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029155 k( 47) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029155 k( 48) = ( 0.5053611 0.5053611 0.0113786), wk = 0.0029155 k( 49) = ( 0.5107222 0.5107222 0.0227572), wk = 0.0029155 k( 50) = ( 0.5160833 0.5160833 0.0341358), wk = 0.0029155 k( 51) = ( 0.5214444 0.5214444 0.0455144), wk = 0.0029155 k( 52) = ( 0.5268055 0.5268055 0.0568930), wk = 0.0029155 k( 53) = ( 0.5321665 0.5321665 0.0682716), wk = 0.0029155 k( 54) = ( 0.5375276 0.5375276 0.0796502), wk = 0.0029155 k( 55) = ( 0.5428887 0.5428887 0.0910288), wk = 0.0029155 k( 56) = ( 0.5482498 0.5482498 0.1024074), wk = 0.0029155 k( 57) = ( 0.5536109 0.5536109 0.1137860), wk = 0.0029155 k( 58) = ( 0.5589720 0.5589720 0.1251646), wk = 0.0029155 k( 59) = ( 0.5643331 0.5643331 0.1365431), wk = 0.0029155 k( 60) = ( 0.5696942 0.5696942 0.1479217), wk = 0.0029155 k( 61) = ( 0.5750553 0.5750553 0.1593003), wk = 0.0029155 k( 62) = ( 0.5804163 0.5804163 0.1706789), wk = 0.0029155 k( 63) = ( 0.5857774 0.5857774 0.1820575), wk = 0.0029155 k( 64) = ( 0.5911385 0.5911385 0.1934361), wk = 0.0029155 k( 65) = ( 0.5964996 0.5964996 0.2048147), wk = 0.0029155 k( 66) = ( 0.6018607 0.6018607 0.2161933), wk = 0.0029155 k( 67) = ( 0.6072218 0.6072218 0.2275719), wk = 0.0029155 k( 68) = ( 0.6125829 0.6125829 0.2389505), wk = 0.0029155 k( 69) = ( 0.6179440 0.6179440 0.2503291), wk = 0.0029155 k( 70) = ( 0.6233051 0.6233051 0.2617077), wk = 0.0029155 k( 71) = ( 0.6286662 0.6286662 0.2730863), wk = 0.0029155 k( 72) = ( 0.6340272 0.6340272 0.2844649), wk = 0.0029155 k( 73) = ( 0.6393883 0.6393883 0.2958435), wk = 0.0029155 k( 74) = ( 0.6447494 0.6447494 0.3072221), wk = 0.0029155 k( 75) = ( 0.6501105 0.6501105 0.3186007), wk = 0.0029155 k( 76) = ( 0.6554716 0.6554716 0.3299793), wk = 0.0029155 k( 77) = ( 0.6608327 0.6608327 0.3413579), wk = 0.0029155 k( 78) = ( 0.6661938 0.6661938 0.3527365), wk = 0.0029155 k( 79) = ( 0.6715549 0.6715549 0.3641151), wk = 0.0029155 k( 80) = ( 0.6715549 0.6715549 0.3641151), wk = 0.0029155 k( 81) = ( 0.6646927 0.6646927 0.3695505), wk = 0.0029155 k( 82) = ( 0.6578305 0.6578305 0.3749858), wk = 0.0029155 k( 83) = ( 0.6509683 0.6509683 0.3804212), wk = 0.0029155 k( 84) = ( 0.6441061 0.6441061 0.3858566), wk = 0.0029155 k( 85) = ( 0.6372439 0.6372439 0.3912920), wk = 0.0029155 k( 86) = ( 0.6303817 0.6303817 0.3967274), wk = 0.0029155 k( 87) = ( 0.6235195 0.6235195 0.4021628), wk = 0.0029155 k( 88) = ( 0.6166573 0.6166573 0.4075982), wk = 0.0029155 k( 89) = ( 0.6097951 0.6097951 0.4130336), wk = 0.0029155 k( 90) = ( 0.6029329 0.6029329 0.4184690), wk = 0.0029155 k( 91) = ( 0.5960707 0.5960707 0.4239044), wk = 0.0029155 k( 92) = ( 0.5892085 0.5892085 0.4293398), wk = 0.0029155 k( 93) = ( 0.5823463 0.5823463 0.4347752), wk = 0.0029155 k( 94) = ( 0.5754841 0.5754841 0.4402106), wk = 0.0029155 k( 95) = ( 0.5686219 0.5686219 0.4456460), wk = 0.0029155 k( 96) = ( 0.5617598 0.5617598 0.4510814), wk = 0.0029155 k( 97) = ( 0.5548976 0.5548976 0.4565168), wk = 0.0029155 k( 98) = ( 0.5480354 0.5480354 0.4619522), wk = 0.0029155 k( 99) = ( 0.5411732 0.5411732 0.4673876), wk = 0.0029155 k( 100) = ( 0.5343110 0.5343110 0.4728230), wk = 0.0029155 k( 101) = ( 0.5274488 0.5274488 0.4782584), wk = 0.0029155 k( 102) = ( 0.5205866 0.5205866 0.4836938), wk = 0.0029155 k( 103) = ( 0.5137244 0.5137244 0.4891292), wk = 0.0029155 k( 104) = ( 0.5068622 0.5068622 0.4945646), wk = 0.0029155 k( 105) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029155 k( 106) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029155 k( 107) = ( 0.5086081 0.4913919 0.5000000), wk = 0.0029155 k( 108) = ( 0.5172161 0.4827839 0.5000000), wk = 0.0029155 k( 109) = ( 0.5258242 0.4741758 0.5000000), wk = 0.0029155 k( 110) = ( 0.5344323 0.4655677 0.5000000), wk = 0.0029155 k( 111) = ( 0.5430404 0.4569596 0.5000000), wk = 0.0029155 k( 112) = ( 0.5516484 0.4483516 0.5000000), wk = 0.0029155 k( 113) = ( 0.5602565 0.4397435 0.5000000), wk = 0.0029155 k( 114) = ( 0.5688646 0.4311354 0.5000000), wk = 0.0029155 k( 115) = ( 0.5774727 0.4225273 0.5000000), wk = 0.0029155 k( 116) = ( 0.5860808 0.4139193 0.5000000), wk = 0.0029155 k( 117) = ( 0.5946888 0.4053112 0.5000000), wk = 0.0029155 k( 118) = ( 0.6032969 0.3967031 0.5000000), wk = 0.0029155 k( 119) = ( 0.6119050 0.3880950 0.5000000), wk = 0.0029155 k( 120) = ( 0.6205131 0.3794870 0.5000000), wk = 0.0029155 k( 121) = ( 0.6291211 0.3708789 0.5000000), wk = 0.0029155 k( 122) = ( 0.6377292 0.3622708 0.5000000), wk = 0.0029155 k( 123) = ( 0.6463373 0.3536627 0.5000000), wk = 0.0029155 k( 124) = ( 0.6549453 0.3450547 0.5000000), wk = 0.0029155 k( 125) = ( 0.6635534 0.3364466 0.5000000), wk = 0.0029155 k( 126) = ( 0.6721615 0.3278385 0.5000000), wk = 0.0029155 k( 127) = ( 0.6807696 0.3192304 0.5000000), wk = 0.0029155 k( 128) = ( 0.6893776 0.3106224 0.5000000), wk = 0.0029155 k( 129) = ( 0.6979857 0.3020143 0.5000000), wk = 0.0029155 k( 130) = ( 0.7065938 0.2934062 0.5000000), wk = 0.0029155 k( 131) = ( 0.7152019 0.2847981 0.5000000), wk = 0.0029155 k( 132) = ( 0.7238100 0.2761900 0.5000000), wk = 0.0029155 k( 133) = ( 0.7324180 0.2675820 0.5000000), wk = 0.0029155 k( 134) = ( 0.7410261 0.2589739 0.5000000), wk = 0.0029155 k( 135) = ( 0.2589739 -0.2589739 0.5000000), wk = 0.0029155 k( 136) = ( 0.2503414 -0.2503414 0.5000000), wk = 0.0029155 k( 137) = ( 0.2417090 -0.2417090 0.5000000), wk = 0.0029155 k( 138) = ( 0.2330765 -0.2330765 0.5000000), wk = 0.0029155 k( 139) = ( 0.2244440 -0.2244440 0.5000000), wk = 0.0029155 k( 140) = ( 0.2158116 -0.2158116 0.5000000), wk = 0.0029155 k( 141) = ( 0.2071791 -0.2071791 0.5000000), wk = 0.0029155 k( 142) = ( 0.1985466 -0.1985467 0.5000000), wk = 0.0029155 k( 143) = ( 0.1899142 -0.1899142 0.5000000), wk = 0.0029155 k( 144) = ( 0.1812817 -0.1812817 0.5000000), wk = 0.0029155 k( 145) = ( 0.1726493 -0.1726493 0.5000000), wk = 0.0029155 k( 146) = ( 0.1640168 -0.1640168 0.5000000), wk = 0.0029155 k( 147) = ( 0.1553843 -0.1553843 0.5000000), wk = 0.0029155 k( 148) = ( 0.1467519 -0.1467519 0.5000000), wk = 0.0029155 k( 149) = ( 0.1381194 -0.1381194 0.5000000), wk = 0.0029155 k( 150) = ( 0.1294869 -0.1294869 0.5000000), wk = 0.0029155 k( 151) = ( 0.1208545 -0.1208545 0.5000000), wk = 0.0029155 k( 152) = ( 0.1122220 -0.1122220 0.5000000), wk = 0.0029155 k( 153) = ( 0.1035896 -0.1035896 0.5000000), wk = 0.0029155 k( 154) = ( 0.0949571 -0.0949571 0.5000000), wk = 0.0029155 k( 155) = ( 0.0863246 -0.0863246 0.5000000), wk = 0.0029155 k( 156) = ( 0.0776922 -0.0776922 0.5000000), wk = 0.0029155 k( 157) = ( 0.0690597 -0.0690597 0.5000000), wk = 0.0029155 k( 158) = ( 0.0604272 -0.0604272 0.5000000), wk = 0.0029155 k( 159) = ( 0.0517948 -0.0517948 0.5000000), wk = 0.0029155 k( 160) = ( 0.0431623 -0.0431623 0.5000000), wk = 0.0029155 k( 161) = ( 0.0345299 -0.0345298 0.5000000), wk = 0.0029155 k( 162) = ( 0.0258974 -0.0258974 0.5000000), wk = 0.0029155 k( 163) = ( 0.0172649 -0.0172649 0.5000000), wk = 0.0029155 k( 164) = ( 0.0086325 -0.0086325 0.5000000), wk = 0.0029155 k( 165) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029155 k( 166) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029155 k( 167) = ( 0.0121646 0.0121646 0.5050328), wk = 0.0029155 k( 168) = ( 0.0243293 0.0243293 0.5100655), wk = 0.0029155 k( 169) = ( 0.0364939 0.0364939 0.5150983), wk = 0.0029155 k( 170) = ( 0.0486585 0.0486585 0.5201311), wk = 0.0029155 k( 171) = ( 0.0608232 0.0608232 0.5251639), wk = 0.0029155 k( 172) = ( 0.0729878 0.0729878 0.5301967), wk = 0.0029155 k( 173) = ( 0.0851524 0.0851524 0.5352294), wk = 0.0029155 k( 174) = ( 0.0973171 0.0973171 0.5402622), wk = 0.0029155 k( 175) = ( 0.1094817 0.1094817 0.5452950), wk = 0.0029155 k( 176) = ( 0.1216464 0.1216464 0.5503278), wk = 0.0029155 k( 177) = ( 0.1338110 0.1338110 0.5553605), wk = 0.0029155 k( 178) = ( 0.1459756 0.1459756 0.5603933), wk = 0.0029155 k( 179) = ( 0.1581403 0.1581403 0.5654261), wk = 0.0029155 k( 180) = ( 0.1703049 0.1703049 0.5704589), wk = 0.0029155 k( 181) = ( 0.1824695 0.1824695 0.5754916), wk = 0.0029155 k( 182) = ( 0.1946342 0.1946342 0.5805244), wk = 0.0029155 k( 183) = ( 0.2067988 0.2067988 0.5855572), wk = 0.0029155 k( 184) = ( 0.2189634 0.2189634 0.5905900), wk = 0.0029155 k( 185) = ( 0.2311281 0.2311281 0.5956227), wk = 0.0029155 k( 186) = ( 0.2432927 0.2432927 0.6006555), wk = 0.0029155 k( 187) = ( 0.2554573 0.2554573 0.6056883), wk = 0.0029155 k( 188) = ( 0.2676220 0.2676220 0.6107211), wk = 0.0029155 k( 189) = ( 0.2797866 0.2797866 0.6157539), wk = 0.0029155 k( 190) = ( 0.2919512 0.2919512 0.6207866), wk = 0.0029155 k( 191) = ( 0.3041159 0.3041159 0.6258194), wk = 0.0029155 k( 192) = ( 0.3162805 0.3162805 0.6308522), wk = 0.0029155 k( 193) = ( 0.3284451 0.3284451 0.6358850), wk = 0.0029155 k( 194) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029155 k( 195) = ( 0.5085857 0.4914143 0.0000000), wk = 0.0029155 k( 196) = ( 0.5171714 0.4828286 0.0000000), wk = 0.0029155 k( 197) = ( 0.5257571 0.4742429 0.0000000), wk = 0.0029155 k( 198) = ( 0.5343428 0.4656572 -0.0000000), wk = 0.0029155 k( 199) = ( 0.5429285 0.4570715 0.0000000), wk = 0.0029155 k( 200) = ( 0.5515142 0.4484858 0.0000000), wk = 0.0029155 k( 201) = ( 0.5601000 0.4399000 0.0000000), wk = 0.0029155 k( 202) = ( 0.5686857 0.4313143 0.0000000), wk = 0.0029155 k( 203) = ( 0.5772714 0.4227286 0.0000000), wk = 0.0029155 k( 204) = ( 0.5858571 0.4141429 0.0000000), wk = 0.0029155 k( 205) = ( 0.5944428 0.4055572 0.0000000), wk = 0.0029155 k( 206) = ( 0.4055572 -0.4055572 0.0000000), wk = 0.0029155 k( 207) = ( 0.3967407 -0.3967407 0.0000000), wk = 0.0029155 k( 208) = ( 0.3879243 -0.3879243 0.0000000), wk = 0.0029155 k( 209) = ( 0.3791078 -0.3791078 -0.0000000), wk = 0.0029155 k( 210) = ( 0.3702914 -0.3702914 0.0000000), wk = 0.0029155 k( 211) = ( 0.3614749 -0.3614749 -0.0000000), wk = 0.0029155 k( 212) = ( 0.3526584 -0.3526584 0.0000000), wk = 0.0029155 k( 213) = ( 0.3438420 -0.3438420 -0.0000000), wk = 0.0029155 k( 214) = ( 0.3350255 -0.3350255 0.0000000), wk = 0.0029155 k( 215) = ( 0.3262091 -0.3262091 -0.0000000), wk = 0.0029155 k( 216) = ( 0.3173926 -0.3173926 0.0000000), wk = 0.0029155 k( 217) = ( 0.3085761 -0.3085761 -0.0000000), wk = 0.0029155 k( 218) = ( 0.2997597 -0.2997597 -0.0000000), wk = 0.0029155 k( 219) = ( 0.2909432 -0.2909432 -0.0000000), wk = 0.0029155 k( 220) = ( 0.2821267 -0.2821267 -0.0000000), wk = 0.0029155 k( 221) = ( 0.2733103 -0.2733103 0.0000000), wk = 0.0029155 k( 222) = ( 0.2644938 -0.2644938 0.0000000), wk = 0.0029155 k( 223) = ( 0.2556774 -0.2556774 0.0000000), wk = 0.0029155 k( 224) = ( 0.2468609 -0.2468609 -0.0000000), wk = 0.0029155 k( 225) = ( 0.2380444 -0.2380444 -0.0000000), wk = 0.0029155 k( 226) = ( 0.2292280 -0.2292280 0.0000000), wk = 0.0029155 k( 227) = ( 0.2204115 -0.2204115 -0.0000000), wk = 0.0029155 k( 228) = ( 0.2115951 -0.2115951 0.0000000), wk = 0.0029155 k( 229) = ( 0.2027786 -0.2027786 -0.0000000), wk = 0.0029155 k( 230) = ( 0.1939621 -0.1939621 0.0000000), wk = 0.0029155 k( 231) = ( 0.1851457 -0.1851457 0.0000000), wk = 0.0029155 k( 232) = ( 0.1763292 -0.1763292 0.0000000), wk = 0.0029155 k( 233) = ( 0.1675128 -0.1675128 0.0000000), wk = 0.0029155 k( 234) = ( 0.1586963 -0.1586963 0.0000000), wk = 0.0029155 k( 235) = ( 0.1498798 -0.1498798 0.0000000), wk = 0.0029155 k( 236) = ( 0.1410634 -0.1410634 0.0000000), wk = 0.0029155 k( 237) = ( 0.1322469 -0.1322469 -0.0000000), wk = 0.0029155 k( 238) = ( 0.1234304 -0.1234304 0.0000000), wk = 0.0029155 k( 239) = ( 0.1146140 -0.1146140 -0.0000000), wk = 0.0029155 k( 240) = ( 0.1057975 -0.1057975 0.0000000), wk = 0.0029155 k( 241) = ( 0.0969811 -0.0969811 0.0000000), wk = 0.0029155 k( 242) = ( 0.0881646 -0.0881646 0.0000000), wk = 0.0029155 k( 243) = ( 0.0793482 -0.0793482 0.0000000), wk = 0.0029155 k( 244) = ( 0.0705317 -0.0705317 0.0000000), wk = 0.0029155 k( 245) = ( 0.0617152 -0.0617152 -0.0000000), wk = 0.0029155 k( 246) = ( 0.0528988 -0.0528988 0.0000000), wk = 0.0029155 k( 247) = ( 0.0440823 -0.0440823 0.0000000), wk = 0.0029155 k( 248) = ( 0.0352658 -0.0352658 -0.0000000), wk = 0.0029155 k( 249) = ( 0.0264494 -0.0264494 0.0000000), wk = 0.0029155 k( 250) = ( 0.0176329 -0.0176329 -0.0000000), wk = 0.0029155 k( 251) = ( 0.0088165 -0.0088165 -0.0000000), wk = 0.0029155 k( 252) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 253) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 254) = ( 0.0135135 -0.0000000 0.0000000), wk = 0.0029155 k( 255) = ( 0.0270270 0.0000000 0.0000000), wk = 0.0029155 k( 256) = ( 0.0405405 0.0000000 0.0000000), wk = 0.0029155 k( 257) = ( 0.0540540 0.0000000 0.0000000), wk = 0.0029155 k( 258) = ( 0.0675676 0.0000000 0.0000000), wk = 0.0029155 k( 259) = ( 0.0810811 0.0000000 0.0000000), wk = 0.0029155 k( 260) = ( 0.0945946 0.0000000 0.0000000), wk = 0.0029155 k( 261) = ( 0.1081081 0.0000000 0.0000000), wk = 0.0029155 k( 262) = ( 0.1216216 0.0000000 0.0000000), wk = 0.0029155 k( 263) = ( 0.1351351 0.0000000 0.0000000), wk = 0.0029155 k( 264) = ( 0.1486486 -0.0000000 0.0000000), wk = 0.0029155 k( 265) = ( 0.1621622 0.0000000 0.0000000), wk = 0.0029155 k( 266) = ( 0.1756757 0.0000000 0.0000000), wk = 0.0029155 k( 267) = ( 0.1891892 0.0000000 0.0000000), wk = 0.0029155 k( 268) = ( 0.2027027 0.0000000 0.0000000), wk = 0.0029155 k( 269) = ( 0.2162162 0.0000000 0.0000000), wk = 0.0029155 k( 270) = ( 0.2297297 0.0000000 0.0000000), wk = 0.0029155 k( 271) = ( 0.2432432 0.0000000 0.0000000), wk = 0.0029155 k( 272) = ( 0.2567568 0.0000000 0.0000000), wk = 0.0029155 k( 273) = ( 0.2702703 -0.0000000 0.0000000), wk = 0.0029155 k( 274) = ( 0.2837838 0.0000000 0.0000000), wk = 0.0029155 k( 275) = ( 0.2972973 -0.0000000 0.0000000), wk = 0.0029155 k( 276) = ( 0.3108108 0.0000000 0.0000000), wk = 0.0029155 k( 277) = ( 0.3243243 0.0000000 0.0000000), wk = 0.0029155 k( 278) = ( 0.3378378 0.0000000 0.0000000), wk = 0.0029155 k( 279) = ( 0.3513514 0.0000000 0.0000000), wk = 0.0029155 k( 280) = ( 0.3648649 0.0000000 0.0000000), wk = 0.0029155 k( 281) = ( 0.3783784 0.0000000 0.0000000), wk = 0.0029155 k( 282) = ( 0.3918919 -0.0000000 0.0000000), wk = 0.0029155 k( 283) = ( 0.4054054 0.0000000 0.0000000), wk = 0.0029155 k( 284) = ( 0.4189189 0.0000000 0.0000000), wk = 0.0029155 k( 285) = ( 0.4324324 -0.0000000 0.0000000), wk = 0.0029155 k( 286) = ( 0.4459459 0.0000000 0.0000000), wk = 0.0029155 k( 287) = ( 0.4594595 0.0000000 0.0000000), wk = 0.0029155 k( 288) = ( 0.4729730 -0.0000000 0.0000000), wk = 0.0029155 k( 289) = ( 0.4864865 -0.0000000 0.0000000), wk = 0.0029155 k( 290) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0029155 k( 291) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0029155 k( 292) = ( 0.4903846 0.0000000 0.4903846), wk = 0.0029155 k( 293) = ( 0.4807692 -0.0000000 0.4807692), wk = 0.0029155 k( 294) = ( 0.4711538 -0.0000000 0.4711538), wk = 0.0029155 k( 295) = ( 0.4615385 0.0000000 0.4615385), wk = 0.0029155 k( 296) = ( 0.4519231 -0.0000000 0.4519231), wk = 0.0029155 k( 297) = ( 0.4423077 -0.0000000 0.4423077), wk = 0.0029155 k( 298) = ( 0.4326923 -0.0000000 0.4326923), wk = 0.0029155 k( 299) = ( 0.4230769 -0.0000000 0.4230769), wk = 0.0029155 k( 300) = ( 0.4134615 -0.0000000 0.4134615), wk = 0.0029155 k( 301) = ( 0.4038462 0.0000000 0.4038462), wk = 0.0029155 k( 302) = ( 0.3942308 -0.0000000 0.3942308), wk = 0.0029155 k( 303) = ( 0.3846154 -0.0000000 0.3846154), wk = 0.0029155 k( 304) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0029155 k( 305) = ( 0.3653846 -0.0000000 0.3653846), wk = 0.0029155 k( 306) = ( 0.3557692 0.0000000 0.3557692), wk = 0.0029155 k( 307) = ( 0.3461538 -0.0000000 0.3461538), wk = 0.0029155 k( 308) = ( 0.3365385 0.0000000 0.3365385), wk = 0.0029155 k( 309) = ( 0.3269231 -0.0000000 0.3269231), wk = 0.0029155 k( 310) = ( 0.3173077 0.0000000 0.3173077), wk = 0.0029155 k( 311) = ( 0.3076923 -0.0000000 0.3076923), wk = 0.0029155 k( 312) = ( 0.2980769 0.0000000 0.2980769), wk = 0.0029155 k( 313) = ( 0.2884615 -0.0000000 0.2884615), wk = 0.0029155 k( 314) = ( 0.2788462 0.0000000 0.2788462), wk = 0.0029155 k( 315) = ( 0.2692308 -0.0000000 0.2692308), wk = 0.0029155 k( 316) = ( 0.2596154 0.0000000 0.2596154), wk = 0.0029155 k( 317) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0029155 k( 318) = ( 0.2403846 0.0000000 0.2403846), wk = 0.0029155 k( 319) = ( 0.2307692 0.0000000 0.2307692), wk = 0.0029155 k( 320) = ( 0.2211539 0.0000000 0.2211539), wk = 0.0029155 k( 321) = ( 0.2115385 -0.0000000 0.2115385), wk = 0.0029155 k( 322) = ( 0.2019231 0.0000000 0.2019231), wk = 0.0029155 k( 323) = ( 0.1923077 -0.0000000 0.1923077), wk = 0.0029155 k( 324) = ( 0.1826923 -0.0000000 0.1826923), wk = 0.0029155 k( 325) = ( 0.1730769 0.0000000 0.1730769), wk = 0.0029155 k( 326) = ( 0.1634615 -0.0000000 0.1634615), wk = 0.0029155 k( 327) = ( 0.1538461 0.0000000 0.1538461), wk = 0.0029155 k( 328) = ( 0.1442308 -0.0000000 0.1442308), wk = 0.0029155 k( 329) = ( 0.1346154 0.0000000 0.1346154), wk = 0.0029155 k( 330) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0029155 k( 331) = ( 0.1153846 0.0000000 0.1153846), wk = 0.0029155 k( 332) = ( 0.1057692 -0.0000000 0.1057692), wk = 0.0029155 k( 333) = ( 0.0961538 -0.0000000 0.0961538), wk = 0.0029155 k( 334) = ( 0.0865385 0.0000000 0.0865385), wk = 0.0029155 k( 335) = ( 0.0769231 0.0000000 0.0769231), wk = 0.0029155 k( 336) = ( 0.0673077 0.0000000 0.0673077), wk = 0.0029155 k( 337) = ( 0.0576923 0.0000000 0.0576923), wk = 0.0029155 k( 338) = ( 0.0480769 0.0000000 0.0480769), wk = 0.0029155 k( 339) = ( 0.0384615 0.0000000 0.0384615), wk = 0.0029155 k( 340) = ( 0.0288462 0.0000000 0.0288462), wk = 0.0029155 k( 341) = ( 0.0192308 0.0000000 0.0192308), wk = 0.0029155 k( 342) = ( 0.0096154 0.0000000 0.0096154), wk = 0.0029155 k( 343) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 Dense grid: 47737 G-vectors FFT dimensions: ( 54, 54, 40) Smooth grid: 21107 G-vectors FFT dimensions: ( 40, 40, 32) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.15 Mb ( 168, 58) NL pseudopotentials 0.14 Mb ( 84, 112) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.01 Mb ( 1327) G-vector shells 0.01 Mb ( 1282) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.59 Mb ( 168, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.20 Mb ( 112, 2, 58) Check: negative/imaginary core charge= -0.000007 0.000000 The potential is recalculated from file : ./O2.save/charge-density.dat Starting wfc are 64 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2.3 secs Computing kpt #: 2 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3.6 secs Computing kpt #: 3 total cpu time spent up to now is 4.8 secs Computing kpt #: 4 total cpu time spent up to now is 6.1 secs Computing kpt #: 5 total cpu time spent up to now is 7.4 secs Computing kpt #: 6 total cpu time spent up to now is 8.5 secs Computing kpt #: 7 total cpu time spent up to now is 9.7 secs Computing kpt #: 8 total cpu time spent up to now is 10.8 secs Computing kpt #: 9 total cpu time spent up to now is 11.9 secs Computing kpt #: 10 total cpu time spent up to now is 12.8 secs Computing kpt #: 11 total cpu time spent up to now is 13.8 secs Computing kpt #: 12 total cpu time spent up to now is 14.7 secs Computing kpt #: 13 total cpu time spent up to now is 15.6 secs Computing kpt #: 14 total cpu time spent up to now is 16.4 secs Computing kpt #: 15 total cpu time spent up to now is 17.1 secs Computing kpt #: 16 total cpu time spent up to now is 17.9 secs Computing kpt #: 17 total cpu time spent up to now is 18.6 secs Computing kpt #: 18 total cpu time spent up to now is 19.3 secs Computing kpt #: 19 total cpu time spent up to now is 20.0 secs Computing kpt #: 20 total cpu time spent up to now is 20.8 secs Computing kpt #: 21 total cpu time spent up to now is 21.4 secs Computing kpt #: 22 total cpu time spent up to now is 22.1 secs Computing kpt #: 23 total cpu time spent up to now is 22.8 secs Computing kpt #: 24 total cpu time spent up to now is 23.4 secs Computing kpt #: 25 total cpu time spent up to now is 24.1 secs Computing kpt #: 26 total cpu time spent up to now is 24.8 secs Computing kpt #: 27 total cpu time spent up to now is 25.5 secs Computing kpt #: 28 total cpu time spent up to now is 26.1 secs Computing kpt #: 29 total cpu time spent up to now is 26.8 secs Computing kpt #: 30 total cpu time spent up to now is 27.5 secs Computing kpt #: 31 total cpu time spent up to now is 28.1 secs Computing kpt #: 32 total cpu time spent up to now is 28.8 secs Computing kpt #: 33 total cpu time spent up to now is 29.5 secs Computing kpt #: 34 total cpu time spent up to now is 30.2 secs Computing kpt #: 35 total cpu time spent up to now is 30.9 secs Computing kpt #: 36 total cpu time spent up to now is 31.6 secs Computing kpt #: 37 total cpu time spent up to now is 32.3 secs Computing kpt #: 38 total cpu time spent up to now is 33.0 secs Computing kpt #: 39 total cpu time spent up to now is 34.0 secs Computing kpt #: 40 total cpu time spent up to now is 34.9 secs Computing kpt #: 41 total cpu time spent up to now is 35.8 secs Computing kpt #: 42 total cpu time spent up to now is 36.8 secs Computing kpt #: 43 total cpu time spent up to now is 37.8 secs Computing kpt #: 44 total cpu time spent up to now is 38.8 secs Computing kpt #: 45 total cpu time spent up to now is 39.8 secs Computing kpt #: 46 total cpu time spent up to now is 40.7 secs Computing kpt #: 47 total cpu time spent up to now is 41.7 secs Computing kpt #: 48 total cpu time spent up to now is 42.8 secs Computing kpt #: 49 total cpu time spent up to now is 43.7 secs Computing kpt #: 50 total cpu time spent up to now is 44.6 secs Computing kpt #: 51 total cpu time spent up to now is 45.2 secs Computing kpt #: 52 total cpu time spent up to now is 45.9 secs Computing kpt #: 53 total cpu time spent up to now is 46.6 secs Computing kpt #: 54 total cpu time spent up to now is 47.2 secs Computing kpt #: 55 total cpu time spent up to now is 47.7 secs Computing kpt #: 56 total cpu time spent up to now is 48.2 secs Computing kpt #: 57 total cpu time spent up to now is 48.8 secs Computing kpt #: 58 total cpu time spent up to now is 49.2 secs Computing kpt #: 59 total cpu time spent up to now is 49.8 secs Computing kpt #: 60 total cpu time spent up to now is 50.3 secs Computing kpt #: 61 total cpu time spent up to now is 50.7 secs Computing kpt #: 62 total cpu time spent up to now is 51.2 secs Computing kpt #: 63 total cpu time spent up to now is 51.7 secs Computing kpt #: 64 total cpu time spent up to now is 52.1 secs Computing kpt #: 65 total cpu time spent up to now is 52.6 secs Computing kpt #: 66 total cpu time spent up to now is 53.0 secs Computing kpt #: 67 total cpu time spent up to now is 53.5 secs Computing kpt #: 68 total cpu time spent up to now is 54.2 secs Computing kpt #: 69 total cpu time spent up to now is 54.7 secs Computing kpt #: 70 total cpu time spent up to now is 55.1 secs Computing kpt #: 71 total cpu time spent up to now is 55.6 secs Computing kpt #: 72 total cpu time spent up to now is 56.0 secs Computing kpt #: 73 total cpu time spent up to now is 56.5 secs Computing kpt #: 74 total cpu time spent up to now is 56.9 secs Computing kpt #: 75 total cpu time spent up to now is 57.4 secs Computing kpt #: 76 total cpu time spent up to now is 57.8 secs Computing kpt #: 77 total cpu time spent up to now is 58.2 secs Computing kpt #: 78 total cpu time spent up to now is 58.7 secs Computing kpt #: 79 total cpu time spent up to now is 59.1 secs Computing kpt #: 80 total cpu time spent up to now is 59.6 secs Computing kpt #: 81 total cpu time spent up to now is 60.0 secs Computing kpt #: 82 total cpu time spent up to now is 60.5 secs Computing kpt #: 83 total cpu time spent up to now is 61.0 secs Computing kpt #: 84 total cpu time spent up to now is 61.6 secs Computing kpt #: 85 total cpu time spent up to now is 62.1 secs Computing kpt #: 86 total cpu time spent up to now is 62.5 secs Computing kpt #: 87 total cpu time spent up to now is 63.0 secs Computing kpt #: 88 total cpu time spent up to now is 63.5 secs Computing kpt #: 89 total cpu time spent up to now is 64.0 secs Computing kpt #: 90 total cpu time spent up to now is 64.5 secs Computing kpt #: 91 total cpu time spent up to now is 65.1 secs Computing kpt #: 92 total cpu time spent up to now is 65.6 secs Computing kpt #: 93 total cpu time spent up to now is 66.1 secs Computing kpt #: 94 total cpu time spent up to now is 66.6 secs Computing kpt #: 95 total cpu time spent up to now is 67.3 secs Computing kpt #: 96 total cpu time spent up to now is 67.9 secs Computing kpt #: 97 total cpu time spent up to now is 68.6 secs Computing kpt #: 98 total cpu time spent up to now is 69.2 secs Computing kpt #: 99 total cpu time spent up to now is 69.9 secs Computing kpt #: 100 total cpu time spent up to now is 70.6 secs Computing kpt #: 101 total cpu time spent up to now is 71.3 secs Computing kpt #: 102 total cpu time spent up to now is 72.0 secs Computing kpt #: 103 total cpu time spent up to now is 72.6 secs Computing kpt #: 104 total cpu time spent up to now is 73.3 secs Computing kpt #: 105 total cpu time spent up to now is 74.0 secs Computing kpt #: 106 total cpu time spent up to now is 74.6 secs Computing kpt #: 107 total cpu time spent up to now is 75.2 secs Computing kpt #: 108 total cpu time spent up to now is 75.9 secs Computing kpt #: 109 total cpu time spent up to now is 76.6 secs Computing kpt #: 110 total cpu time spent up to now is 77.3 secs Computing kpt #: 111 total cpu time spent up to now is 77.9 secs Computing kpt #: 112 total cpu time spent up to now is 78.6 secs Computing kpt #: 113 total cpu time spent up to now is 79.3 secs Computing kpt #: 114 total cpu time spent up to now is 80.0 secs Computing kpt #: 115 total cpu time spent up to now is 80.7 secs Computing kpt #: 116 total cpu time spent up to now is 81.4 secs Computing kpt #: 117 total cpu time spent up to now is 82.0 secs Computing kpt #: 118 total cpu time spent up to now is 82.6 secs Computing kpt #: 119 total cpu time spent up to now is 83.1 secs Computing kpt #: 120 total cpu time spent up to now is 83.7 secs Computing kpt #: 121 total cpu time spent up to now is 84.2 secs Computing kpt #: 122 total cpu time spent up to now is 84.7 secs Computing kpt #: 123 total cpu time spent up to now is 85.2 secs Computing kpt #: 124 total cpu time spent up to now is 85.7 secs Computing kpt #: 125 total cpu time spent up to now is 86.2 secs Computing kpt #: 126 total cpu time spent up to now is 86.7 secs Computing kpt #: 127 total cpu time spent up to now is 87.2 secs Computing kpt #: 128 total cpu time spent up to now is 87.7 secs Computing kpt #: 129 total cpu time spent up to now is 88.2 secs Computing kpt #: 130 total cpu time spent up to now is 88.7 secs Computing kpt #: 131 total cpu time spent up to now is 89.2 secs Computing kpt #: 132 total cpu time spent up to now is 89.7 secs Computing kpt #: 133 total cpu time spent up to now is 90.1 secs Computing kpt #: 134 total cpu time spent up to now is 90.6 secs Computing kpt #: 135 total cpu time spent up to now is 91.1 secs Computing kpt #: 136 total cpu time spent up to now is 91.5 secs Computing kpt #: 137 total cpu time spent up to now is 92.0 secs Computing kpt #: 138 total cpu time spent up to now is 92.4 secs Computing kpt #: 139 total cpu time spent up to now is 92.8 secs Computing kpt #: 140 total cpu time spent up to now is 93.2 secs Computing kpt #: 141 total cpu time spent up to now is 93.7 secs Computing kpt #: 142 total cpu time spent up to now is 94.1 secs Computing kpt #: 143 total cpu time spent up to now is 94.5 secs Computing kpt #: 144 total cpu time spent up to now is 95.0 secs Computing kpt #: 145 total cpu time spent up to now is 95.4 secs Computing kpt #: 146 total cpu time spent up to now is 95.8 secs Computing kpt #: 147 total cpu time spent up to now is 96.2 secs Computing kpt #: 148 total cpu time spent up to now is 96.6 secs Computing kpt #: 149 total cpu time spent up to now is 97.0 secs Computing kpt #: 150 total cpu time spent up to now is 97.4 secs Computing kpt #: 151 total cpu time spent up to now is 97.9 secs Computing kpt #: 152 total cpu time spent up to now is 98.3 secs Computing kpt #: 153 total cpu time spent up to now is 98.7 secs Computing kpt #: 154 total cpu time spent up to now is 99.1 secs Computing kpt #: 155 total cpu time spent up to now is 99.5 secs Computing kpt #: 156 total cpu time spent up to now is 99.9 secs Computing kpt #: 157 total cpu time spent up to now is 100.3 secs Computing kpt #: 158 total cpu time spent up to now is 100.7 secs Computing kpt #: 159 total cpu time spent up to now is 101.1 secs Computing kpt #: 160 total cpu time spent up to now is 101.5 secs Computing kpt #: 161 total cpu time spent up to now is 101.9 secs Computing kpt #: 162 total cpu time spent up to now is 102.3 secs Computing kpt #: 163 total cpu time spent up to now is 102.7 secs Computing kpt #: 164 total cpu time spent up to now is 103.1 secs Computing kpt #: 165 total cpu time spent up to now is 103.5 secs Computing kpt #: 166 total cpu time spent up to now is 103.9 secs Computing kpt #: 167 total cpu time spent up to now is 104.3 secs Computing kpt #: 168 total cpu time spent up to now is 104.7 secs Computing kpt #: 169 total cpu time spent up to now is 105.1 secs Computing kpt #: 170 total cpu time spent up to now is 105.5 secs Computing kpt #: 171 total cpu time spent up to now is 105.9 secs Computing kpt #: 172 total cpu time spent up to now is 106.3 secs Computing kpt #: 173 total cpu time spent up to now is 106.7 secs Computing kpt #: 174 total cpu time spent up to now is 107.1 secs Computing kpt #: 175 total cpu time spent up to now is 107.5 secs Computing kpt #: 176 total cpu time spent up to now is 107.9 secs Computing kpt #: 177 total cpu time spent up to now is 108.3 secs Computing kpt #: 178 total cpu time spent up 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115.0 secs Computing kpt #: 194 total cpu time spent up to now is 115.9 secs Computing kpt #: 195 total cpu time spent up to now is 117.0 secs Computing kpt #: 196 total cpu time spent up to now is 117.9 secs Computing kpt #: 197 total cpu time spent up to now is 119.1 secs Computing kpt #: 198 total cpu time spent up to now is 120.0 secs Computing kpt #: 199 total cpu time spent up to now is 120.8 secs Computing kpt #: 200 total cpu time spent up to now is 121.8 secs Computing kpt #: 201 total cpu time spent up to now is 122.7 secs Computing kpt #: 202 total cpu time spent up to now is 123.7 secs Computing kpt #: 203 total cpu time spent up to now is 124.6 secs Computing kpt #: 204 total cpu time spent up to now is 125.5 secs Computing kpt #: 205 total cpu time spent up to now is 126.5 secs Computing kpt #: 206 total cpu time spent up to now is 127.5 secs Computing kpt #: 207 total cpu time spent up to now is 128.2 secs Computing kpt #: 208 total cpu time spent up to now is 129.0 secs Computing kpt #: 209 total cpu time spent up to now is 129.9 secs Computing kpt #: 210 total cpu time spent up to now is 130.9 secs Computing kpt #: 211 total cpu time spent up to now is 131.9 secs Computing kpt #: 212 total cpu time spent up to now is 132.8 secs Computing kpt #: 213 total cpu time spent up to now is 133.5 secs Computing kpt #: 214 total cpu time spent up to now is 134.7 secs Computing kpt #: 215 total cpu time spent up to now is 135.5 secs Computing kpt #: 216 total cpu time spent up to now is 136.4 secs Computing kpt #: 217 total cpu time spent up to now is 137.3 secs Computing kpt #: 218 total cpu time spent up to now is 138.4 secs Computing kpt #: 219 total cpu time spent up to now is 139.3 secs Computing kpt #: 220 total cpu time spent up to now is 140.2 secs Computing kpt #: 221 total cpu time spent up to now is 141.2 secs Computing kpt #: 222 total cpu time spent up to now is 142.1 secs Computing kpt #: 223 total cpu time spent up to now is 143.1 secs Computing kpt #: 224 total cpu time spent up to now is 144.1 secs Computing kpt #: 225 total cpu time spent up to now is 145.1 secs Computing kpt #: 226 total cpu time spent up to now is 146.1 secs Computing kpt #: 227 total cpu time spent up to now is 146.9 secs Computing kpt #: 228 total cpu time spent up to now is 147.6 secs Computing kpt #: 229 total cpu time spent up to now is 148.7 secs Computing kpt #: 230 total cpu time spent up to now is 149.7 secs Computing kpt #: 231 total cpu time spent up to now is 150.8 secs Computing kpt #: 232 total cpu time spent up to now is 151.8 secs Computing kpt #: 233 total cpu time spent up to now is 152.8 secs Computing kpt #: 234 total cpu time spent up to now is 154.0 secs Computing kpt #: 235 total cpu time spent up to now is 155.1 secs Computing kpt #: 236 total cpu time spent up to now is 156.3 secs Computing kpt #: 237 total cpu time spent up to now is 157.4 secs Computing kpt #: 238 total cpu time spent up to now is 158.6 secs Computing kpt #: 239 total cpu time spent up to now is 159.9 secs Computing kpt #: 240 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 161.2 secs Computing kpt #: 241 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 162.5 secs Computing kpt #: 242 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 163.7 secs Computing kpt #: 243 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 165.0 secs Computing kpt #: 244 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 166.3 secs Computing kpt #: 245 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 167.5 secs Computing kpt #: 246 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 168.8 secs Computing kpt #: 247 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 170.1 secs Computing kpt #: 248 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 171.4 secs Computing kpt #: 249 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 172.6 secs Computing kpt #: 250 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 173.9 secs Computing kpt #: 251 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 175.2 secs Computing kpt #: 252 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 176.4 secs Computing kpt #: 253 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 177.7 secs Computing kpt #: 254 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 179.0 secs Computing kpt #: 255 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 180.3 secs Computing kpt #: 256 total cpu time spent up to now is 181.6 secs Computing kpt #: 257 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 182.9 secs Computing kpt #: 258 total cpu time spent up to now is 184.1 secs Computing kpt #: 259 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 185.4 secs Computing kpt #: 260 total cpu time spent up to now is 186.6 secs Computing kpt #: 261 total cpu time spent up to now is 187.9 secs Computing kpt #: 262 total cpu time spent up to now is 189.1 secs Computing kpt #: 263 total cpu time spent up to now is 190.2 secs Computing kpt #: 264 total cpu time spent up to now is 191.3 secs Computing kpt #: 265 total cpu time spent up to now is 192.2 secs Computing kpt #: 266 total cpu time spent up to now is 193.2 secs Computing kpt #: 267 total cpu time spent up to now is 194.1 secs Computing kpt #: 268 total cpu time spent up to now is 195.0 secs Computing kpt #: 269 total cpu time spent up to now is 195.9 secs Computing kpt #: 270 total cpu time spent up to now is 196.8 secs Computing kpt #: 271 total cpu time spent up to now is 197.7 secs Computing kpt #: 272 total cpu time spent up to now is 198.5 secs Computing kpt #: 273 total cpu time spent up to now is 199.2 secs Computing kpt #: 274 total cpu time spent up to now is 199.9 secs Computing kpt #: 275 total cpu time spent up to now is 200.7 secs Computing kpt #: 276 total cpu time spent up to now is 201.4 secs Computing kpt #: 277 total cpu time spent up to now is 202.1 secs Computing kpt #: 278 total cpu time spent up to now is 202.8 secs Computing kpt #: 279 total cpu time spent up to now is 203.5 secs Computing kpt #: 280 total cpu time spent up to now is 204.2 secs Computing kpt #: 281 total cpu time spent up to now is 204.9 secs Computing kpt #: 282 total cpu time spent up to now is 205.6 secs Computing kpt #: 283 total cpu time spent up to now is 206.2 secs Computing kpt #: 284 total cpu time spent up to now is 207.0 secs Computing kpt #: 285 total cpu time spent up to now is 207.6 secs Computing kpt #: 286 total cpu time spent up to now is 208.2 secs Computing kpt #: 287 total cpu time spent up to now is 208.8 secs Computing kpt #: 288 total cpu time spent up to now is 209.4 secs Computing kpt #: 289 total cpu time spent up to now is 210.1 secs Computing kpt #: 290 total cpu time spent up to now is 210.6 secs Computing kpt #: 291 total cpu time spent up to now is 211.3 secs Computing kpt #: 292 total cpu time spent up to now is 211.9 secs Computing kpt #: 293 total cpu time spent up to now is 212.5 secs Computing kpt #: 294 total cpu time spent up to now is 213.2 secs Computing kpt #: 295 total cpu time spent up to now is 214.0 secs Computing kpt #: 296 total cpu time spent up to now is 214.7 secs Computing kpt #: 297 total cpu time spent up to now is 215.3 secs Computing kpt #: 298 total cpu time spent up to now is 216.1 secs Computing kpt #: 299 total cpu time spent up to now is 216.8 secs Computing kpt #: 300 total cpu time spent up to now is 217.6 secs Computing kpt #: 301 total cpu time spent up to now is 218.4 secs Computing kpt #: 302 total cpu time spent up to now is 219.3 secs Computing kpt #: 303 total cpu time spent up to now is 220.2 secs Computing kpt #: 304 total cpu time spent up to now is 221.1 secs Computing kpt #: 305 total cpu time spent up to now is 222.1 secs Computing kpt #: 306 total cpu time spent up to now is 223.0 secs Computing kpt #: 307 total cpu time spent up to now is 223.8 secs Computing kpt #: 308 total cpu time spent up to now is 224.7 secs Computing kpt #: 309 total cpu time spent up to now is 225.5 secs Computing kpt #: 310 total cpu time spent up to now is 226.4 secs Computing kpt #: 311 total cpu time spent up to now is 227.0 secs Computing kpt #: 312 total cpu time spent up to now is 227.8 secs Computing kpt #: 313 total cpu time spent up to now is 228.7 secs Computing kpt #: 314 total cpu time spent up to now is 229.4 secs Computing kpt #: 315 total cpu time spent up to now is 230.1 secs Computing kpt #: 316 total cpu time spent up to now is 230.8 secs Computing kpt #: 317 total cpu time spent up to now is 231.5 secs Computing kpt #: 318 total cpu time spent up to now is 232.2 secs Computing kpt #: 319 total cpu time spent up to now is 232.9 secs Computing kpt #: 320 total cpu time spent up to now is 233.6 secs Computing kpt #: 321 total cpu time spent up to now is 234.2 secs Computing kpt #: 322 total cpu time spent up to now is 234.9 secs Computing kpt #: 323 total cpu time spent up to now is 235.6 secs Computing kpt #: 324 total cpu time spent up to now is 236.3 secs Computing kpt #: 325 total cpu time spent up to now is 236.9 secs Computing kpt #: 326 total cpu time spent up to now is 237.7 secs Computing kpt #: 327 total cpu time spent up to now is 238.4 secs Computing kpt #: 328 total cpu time spent up to now is 239.1 secs Computing kpt #: 329 total cpu time spent up to now is 239.9 secs Computing kpt #: 330 total cpu time spent up to now is 240.8 secs Computing kpt #: 331 total cpu time spent up to now is 241.7 secs Computing kpt #: 332 total cpu time spent up to now is 242.8 secs Computing kpt #: 333 total cpu time spent up to now is 243.9 secs Computing kpt #: 334 total cpu time spent up to now is 244.9 secs Computing kpt #: 335 total cpu time spent up to now is 246.2 secs Computing kpt #: 336 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 247.5 secs Computing kpt #: 337 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 248.8 secs Computing kpt #: 338 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 250.1 secs Computing kpt #: 339 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 251.3 secs Computing kpt #: 340 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 252.6 secs Computing kpt #: 341 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 253.9 secs Computing kpt #: 342 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 255.2 secs Computing kpt #: 343 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 256.4 secs ethr = 2.08E-08, avg # of iterations = 60.5 total cpu time spent up to now is 256.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2619 PWs) bands (ev): -22.7892 -22.7892 -21.9109 -21.9109 -21.4408 -21.4408 -21.0227 -21.0227 -9.5709 -9.5709 -9.1277 -9.1277 -8.9744 -8.9744 -8.7215 -8.7215 -4.8929 -4.8929 -4.5744 -4.5744 -4.4501 -4.4501 -3.7911 -3.7911 -3.0583 -3.0583 -2.5576 -2.5576 -2.2618 -2.2618 -1.2989 -1.2989 -0.0394 -0.0394 0.0148 0.0148 0.0686 0.0686 0.2107 0.2107 2.6185 2.6185 2.9805 2.9805 3.1348 3.1348 4.9091 4.9091 5.9953 5.9953 6.0409 6.0409 6.1538 6.1538 6.2766 6.2766 14.2908 14.2908 k = 0.0111 0.0079-0.0067 ( 2621 PWs) bands (ev): -22.7888 -22.7888 -21.9110 -21.9110 -21.4409 -21.4409 -21.0231 -21.0231 -9.5713 -9.5713 -9.1281 -9.1281 -8.9742 -8.9742 -8.7210 -8.7210 -4.8920 -4.8920 -4.5738 -4.5738 -4.4497 -4.4497 -3.7904 -3.7904 -3.0581 -3.0581 -2.5574 -2.5574 -2.2613 -2.2613 -1.2994 -1.2994 -0.0407 -0.0407 0.0134 0.0134 0.0684 0.0684 0.2098 0.2098 2.6196 2.6196 2.9811 2.9811 3.1350 3.1350 4.9088 4.9088 5.9948 5.9948 6.0393 6.0393 6.1534 6.1534 6.2763 6.2763 14.2902 14.2903 k = 0.0222 0.0157-0.0134 ( 2621 PWs) bands (ev): -22.7878 -22.7878 -21.9111 -21.9111 -21.4413 -21.4413 -21.0241 -21.0241 -9.5725 -9.5725 -9.1294 -9.1294 -8.9736 -8.9736 -8.7197 -8.7197 -4.8894 -4.8894 -4.5721 -4.5721 -4.4486 -4.4486 -3.7883 -3.7883 -3.0572 -3.0572 -2.5570 -2.5570 -2.2600 -2.2600 -1.3010 -1.3010 -0.0444 -0.0444 0.0095 0.0095 0.0678 0.0678 0.2072 0.2072 2.6230 2.6230 2.9826 2.9826 3.1357 3.1357 4.9077 4.9077 5.9934 5.9934 6.0345 6.0345 6.1524 6.1524 6.2754 6.2754 14.2887 14.2887 k = 0.0333 0.0236-0.0201 ( 2629 PWs) bands (ev): -22.7860 -22.7860 -21.9113 -21.9113 -21.4419 -21.4419 -21.0258 -21.0258 -9.5745 -9.5745 -9.1316 -9.1316 -8.9726 -8.9726 -8.7175 -8.7175 -4.8850 -4.8850 -4.5691 -4.5691 -4.4467 -4.4467 -3.7849 -3.7849 -3.0559 -3.0559 -2.5564 -2.5564 -2.2578 -2.2578 -1.3037 -1.3037 -0.0506 -0.0506 0.0031 0.0031 0.0666 0.0666 0.2029 0.2029 2.6285 2.6285 2.9852 2.9852 3.1367 3.1367 4.9060 4.9060 5.9911 5.9911 6.0267 6.0267 6.1506 6.1506 6.2738 6.2738 14.2861 14.2861 k = 0.0444 0.0315-0.0268 ( 2627 PWs) bands (ev): -22.7836 -22.7836 -21.9115 -21.9115 -21.4427 -21.4427 -21.0282 -21.0282 -9.5773 -9.5773 -9.1346 -9.1346 -8.9711 -8.9711 -8.7144 -8.7144 -4.8790 -4.8790 -4.5650 -4.5650 -4.4442 -4.4442 -3.7801 -3.7801 -3.0539 -3.0539 -2.5554 -2.5554 -2.2548 -2.2548 -1.3074 -1.3074 -0.0592 -0.0592 -0.0055 -0.0055 0.0646 0.0646 0.1968 0.1968 2.6361 2.6361 2.9889 2.9889 3.1382 3.1382 4.9036 4.9036 5.9878 5.9878 6.0159 6.0159 6.1482 6.1482 6.2714 6.2714 14.2827 14.2827 k = 0.0556 0.0393-0.0335 ( 2633 PWs) bands (ev): -22.7805 -22.7805 -21.9119 -21.9119 -21.4437 -21.4437 -21.0313 -21.0313 -9.5808 -9.5808 -9.1384 -9.1384 -8.9693 -8.9693 -8.7104 -8.7104 -4.8713 -4.8713 -4.5596 -4.5596 -4.4408 -4.4408 -3.7739 -3.7739 -3.0515 -3.0515 -2.5542 -2.5542 -2.2508 -2.2508 -1.3121 -1.3121 -0.0703 -0.0703 -0.0162 -0.0162 0.0616 0.0616 0.1891 0.1891 2.6459 2.6459 2.9938 2.9938 3.1402 3.1402 4.9004 4.9004 5.9833 5.9833 6.0026 6.0026 6.1452 6.1452 6.2682 6.2682 14.2785 14.2785 k = 0.0667 0.0472-0.0402 ( 2632 PWs) bands (ev): -22.7767 -22.7767 -21.9123 -21.9123 -21.4450 -21.4450 -21.0350 -21.0350 -9.5850 -9.5850 -9.1430 -9.1430 -8.9670 -8.9670 -8.7057 -8.7057 -4.8621 -4.8621 -4.5529 -4.5529 -4.4368 -4.4368 -3.7664 -3.7664 -3.0484 -3.0484 -2.5527 -2.5527 -2.2460 -2.2460 -1.3179 -1.3179 -0.0837 -0.0837 -0.0287 -0.0287 0.0576 0.0576 0.1796 0.1796 2.6576 2.6576 2.9999 2.9999 3.1426 3.1426 4.8965 4.8965 5.9766 5.9766 5.9879 5.9879 6.1416 6.1416 6.2640 6.2640 14.2738 14.2738 k = 0.0778 0.0550-0.0469 ( 2634 PWs) bands (ev): -22.7722 -22.7722 -21.9128 -21.9128 -21.4465 -21.4465 -21.0394 -21.0394 -9.5899 -9.5899 -9.1484 -9.1484 -8.9644 -8.9644 -8.7002 -8.7002 -4.8514 -4.8514 -4.5450 -4.5450 -4.4321 -4.4321 -3.7577 -3.7577 -3.0449 -3.0449 -2.5509 -2.5509 -2.2404 -2.2404 -1.3247 -1.3247 -0.0993 -0.0993 -0.0430 -0.0430 0.0525 0.0525 0.1684 0.1684 2.6711 2.6711 3.0073 3.0073 3.1455 3.1455 4.8919 4.8919 5.9631 5.9631 5.9765 5.9765 6.1375 6.1375 6.2587 6.2587 14.2686 14.2686 k = 0.0889 0.0629-0.0536 ( 2637 PWs) bands (ev): -22.7670 -22.7670 -21.9133 -21.9133 -21.4482 -21.4482 -21.0444 -21.0444 -9.5954 -9.5954 -9.1545 -9.1545 -8.9614 -8.9614 -8.6940 -8.6940 -4.8394 -4.8394 -4.5357 -4.5357 -4.4267 -4.4267 -3.7476 -3.7476 -3.0408 -3.0408 -2.5487 -2.5487 -2.2339 -2.2339 -1.3325 -1.3325 -0.1172 -0.1172 -0.0589 -0.0589 0.0461 0.0461 0.1555 0.1555 2.6863 2.6863 3.0161 3.0161 3.1489 3.1489 4.8864 4.8864 5.9428 5.9428 5.9686 5.9686 6.1329 6.1329 6.2522 6.2522 14.2631 14.2631 k = 0.1000 0.0708-0.0603 ( 2640 PWs) bands (ev): -22.7612 -22.7612 -21.9139 -21.9139 -21.4502 -21.4502 -21.0500 -21.0500 -9.6015 -9.6015 -9.1614 -9.1614 -8.9580 -8.9580 -8.6871 -8.6871 -4.8262 -4.8262 -4.5250 -4.5250 -4.4207 -4.4207 -3.7363 -3.7363 -3.0361 -3.0361 -2.5462 -2.5462 -2.2267 -2.2267 -1.3413 -1.3413 -0.1372 -0.1372 -0.0763 -0.0763 0.0386 0.0386 0.1410 0.1410 2.7031 2.7031 3.0265 3.0265 3.1529 3.1529 4.8801 4.8801 5.9195 5.9195 5.9606 5.9606 6.1280 6.1280 6.2444 6.2444 14.2574 14.2574 k = 0.1111 0.0786-0.0670 ( 2643 PWs) bands (ev): -22.7547 -22.7547 -21.9146 -21.9146 -21.4524 -21.4524 -21.0561 -21.0561 -9.6081 -9.6081 -9.1688 -9.1688 -8.9543 -8.9543 -8.6796 -8.6796 -4.8119 -4.8119 -4.5128 -4.5128 -4.4141 -4.4141 -3.7238 -3.7238 -3.0309 -3.0309 -2.5433 -2.5433 -2.2186 -2.2186 -1.3511 -1.3511 -0.1592 -0.1592 -0.0953 -0.0953 0.0298 0.0298 0.1249 0.1249 2.7212 2.7212 3.0385 3.0385 3.1575 3.1575 4.8730 4.8730 5.8938 5.8938 5.9521 5.9521 6.1227 6.1227 6.2353 6.2353 14.2516 14.2516 k = 0.1222 0.0865-0.0737 ( 2643 PWs) bands (ev): -22.7476 -22.7476 -21.9154 -21.9154 -21.4549 -21.4549 -21.0628 -21.0628 -9.6152 -9.6152 -9.1769 -9.1769 -8.9503 -8.9503 -8.6715 -8.6715 -4.7967 -4.7967 -4.4990 -4.4990 -4.4069 -4.4069 -3.7102 -3.7102 -3.0252 -3.0252 -2.5400 -2.5400 -2.2097 -2.2097 -1.3619 -1.3619 -0.1832 -0.1832 -0.1157 -0.1157 0.0199 0.0199 0.1071 0.1071 2.7405 2.7405 3.0524 3.0524 3.1626 3.1626 4.8649 4.8649 5.8661 5.8661 5.9428 5.9428 6.1172 6.1172 6.2248 6.2248 14.2459 14.2459 k = 0.1333 0.0944-0.0804 ( 2645 PWs) bands (ev): -22.7399 -22.7399 -21.9162 -21.9162 -21.4577 -21.4577 -21.0700 -21.0700 -9.6227 -9.6227 -9.1856 -9.1856 -8.9460 -8.9460 -8.6630 -8.6630 -4.7809 -4.7809 -4.4836 -4.4836 -4.3991 -4.3991 -3.6954 -3.6954 -3.0189 -3.0189 -2.5364 -2.5364 -2.2000 -2.2000 -1.3736 -1.3736 -0.2091 -0.2091 -0.1374 -0.1374 0.0087 0.0087 0.0878 0.0878 2.7606 2.7606 3.0683 3.0683 3.1684 3.1684 4.8559 4.8559 5.8364 5.8364 5.9327 5.9327 6.1115 6.1115 6.2128 6.2128 14.2402 14.2402 k = 0.1444 0.1022-0.0871 ( 2645 PWs) bands (ev): -22.7316 -22.7316 -21.9170 -21.9170 -21.4607 -21.4607 -21.0777 -21.0777 -9.6306 -9.6306 -9.1948 -9.1948 -8.9414 -8.9414 -8.6539 -8.6539 -4.7644 -4.7644 -4.4665 -4.4665 -4.3909 -4.3909 -3.6797 -3.6797 -3.0121 -3.0121 -2.5322 -2.5322 -2.1897 -2.1897 -1.3862 -1.3862 -0.2366 -0.2366 -0.1603 -0.1603 -0.0036 -0.0036 0.0669 0.0669 2.7813 2.7813 3.0864 3.0864 3.1748 3.1748 4.8459 4.8459 5.8051 5.8051 5.9220 5.9220 6.1056 6.1056 6.1993 6.1993 14.2349 14.2349 k = 0.1556 0.1101-0.0938 ( 2643 PWs) bands (ev): -22.7227 -22.7227 -21.9179 -21.9179 -21.4640 -21.4640 -21.0858 -21.0858 -9.6388 -9.6388 -9.2045 -9.2045 -8.9365 -8.9365 -8.6445 -8.6445 -4.7476 -4.7476 -4.4476 -4.4476 -4.3821 -4.3821 -3.6629 -3.6629 -3.0047 -3.0047 -2.5276 -2.5276 -2.1785 -2.1785 -1.3997 -1.3997 -0.2659 -0.2659 -0.1844 -0.1844 -0.0170 -0.0170 0.0446 0.0446 2.8025 2.8025 3.1069 3.1069 3.1820 3.1820 4.8348 4.8348 5.7721 5.7721 5.9107 5.9107 6.0995 6.0995 6.1844 6.1844 14.2298 14.2298 k = 0.1667 0.1180-0.1005 ( 2643 PWs) bands (ev): -22.7132 -22.7132 -21.9188 -21.9188 -21.4676 -21.4676 -21.0943 -21.0943 -9.6472 -9.6472 -9.2146 -9.2146 -8.9313 -8.9313 -8.6347 -8.6347 -4.7307 -4.7307 -4.4268 -4.4268 -4.3730 -4.3730 -3.6453 -3.6453 -2.9968 -2.9968 -2.5225 -2.5225 -2.1668 -2.1668 -1.4141 -1.4141 -0.2966 -0.2966 -0.2097 -0.2097 -0.0316 -0.0316 0.0209 0.0209 2.8238 2.8238 3.1298 3.1298 3.1899 3.1899 4.8226 4.8226 5.7376 5.7376 5.8989 5.8989 6.0933 6.0933 6.1681 6.1681 14.2251 14.2251 k = 0.1778 0.1258-0.1072 ( 2647 PWs) bands (ev): -22.7032 -22.7032 -21.9198 -21.9198 -21.4715 -21.4715 -21.1032 -21.1032 -9.6559 -9.6559 -9.2251 -9.2251 -8.9260 -8.9260 -8.6246 -8.6246 -4.7137 -4.7137 -4.4042 -4.4042 -4.3634 -4.3634 -3.6268 -3.6268 -2.9884 -2.9884 -2.5168 -2.5168 -2.1543 -2.1543 -1.4293 -1.4293 -0.3288 -0.3288 -0.2359 -0.2359 -0.0472 -0.0472 -0.0041 -0.0041 2.8451 2.8451 3.1553 3.1553 3.1985 3.1985 4.8093 4.8093 5.7018 5.7018 5.8866 5.8866 6.0870 6.0870 6.1502 6.1502 14.2208 14.2208 k = 0.1889 0.1337-0.1139 ( 2648 PWs) bands (ev): -22.6927 -22.6927 -21.9208 -21.9208 -21.4757 -21.4757 -21.1123 -21.1123 -9.6647 -9.6647 -9.2359 -9.2359 -8.9205 -8.9205 -8.6143 -8.6143 -4.6969 -4.6969 -4.3796 -4.3796 -4.3535 -4.3535 -3.6076 -3.6076 -2.9795 -2.9795 -2.5106 -2.5106 -2.1412 -2.1412 -1.4454 -1.4454 -0.3623 -0.3623 -0.2630 -0.2630 -0.0639 -0.0639 -0.0302 -0.0302 2.8663 2.8663 3.1835 3.1835 3.2080 3.2080 4.7947 4.7947 5.6647 5.6647 5.8740 5.8740 6.0806 6.0806 6.1311 6.1311 14.2170 14.2170 k = 0.2000 0.1416-0.1206 ( 2644 PWs) bands (ev): -22.6817 -22.6817 -21.9218 -21.9218 -21.4802 -21.4802 -21.1217 -21.1217 -9.6735 -9.6735 -9.2470 -9.2470 -8.9148 -8.9148 -8.6037 -8.6037 -4.6804 -4.6804 -4.3531 -4.3531 -4.3433 -4.3433 -3.5877 -3.5877 -2.9701 -2.9701 -2.5038 -2.5038 -2.1276 -2.1276 -1.4621 -1.4621 -0.3970 -0.3970 -0.2910 -0.2910 -0.0819 -0.0819 -0.0571 -0.0571 2.8872 2.8872 3.2142 3.2142 3.2184 3.2184 4.7790 4.7790 5.6266 5.6266 5.8612 5.8612 6.0739 6.0739 6.1106 6.1106 14.2138 14.2138 k = 0.2111 0.1494-0.1273 ( 2642 PWs) bands (ev): -22.6702 -22.6702 -21.9229 -21.9229 -21.4851 -21.4851 -21.1313 -21.1313 -9.6824 -9.6824 -9.2583 -9.2583 -8.9089 -8.9089 -8.5931 -8.5931 -4.6642 -4.6642 -4.3329 -4.3329 -4.3246 -4.3246 -3.5673 -3.5673 -2.9602 -2.9602 -2.4964 -2.4964 -2.1134 -2.1134 -1.4796 -1.4796 -0.4327 -0.4327 -0.3197 -0.3197 -0.1018 -0.1018 -0.0842 -0.0842 2.9079 2.9079 3.2295 3.2295 3.2475 3.2475 4.7620 4.7620 5.5874 5.5874 5.8483 5.8483 6.0666 6.0666 6.0895 6.0895 14.2113 14.2113 k = 0.2222 0.1573-0.1340 ( 2648 PWs) bands (ev): -22.6584 -22.6584 -21.9240 -21.9240 -21.4903 -21.4903 -21.1410 -21.1410 -9.6913 -9.6913 -9.2697 -9.2697 -8.9030 -8.9030 -8.5823 -8.5823 -4.6485 -4.6485 -4.3223 -4.3223 -4.2944 -4.2944 -3.5464 -3.5464 -2.9498 -2.9498 -2.4883 -2.4883 -2.0987 -2.0987 -1.4978 -1.4978 -0.4694 -0.4694 -0.3491 -0.3491 -0.1251 -0.1251 -0.1097 -0.1097 2.9284 2.9284 3.2416 3.2416 3.2831 3.2831 4.7437 4.7437 5.5473 5.5473 5.8353 5.8353 6.0558 6.0558 6.0704 6.0704 14.2094 14.2094 k = 0.2333 0.1651-0.1407 ( 2648 PWs) bands (ev): -22.6461 -22.6461 -21.9251 -21.9251 -21.4958 -21.4958 -21.1508 -21.1508 -9.7002 -9.7002 -9.2813 -9.2813 -8.8970 -8.8970 -8.5715 -8.5715 -4.6333 -4.6333 -4.3116 -4.3116 -4.2625 -4.2625 -3.5253 -3.5253 -2.9390 -2.9390 -2.4795 -2.4795 -2.0836 -2.0836 -1.5166 -1.5166 -0.5068 -0.5068 -0.3789 -0.3789 -0.1529 -0.1529 -0.1323 -0.1323 2.9487 2.9487 3.2546 3.2546 3.3209 3.3209 4.7241 4.7241 5.5066 5.5066 5.8225 5.8225 6.0356 6.0356 6.0593 6.0593 14.2082 14.2082 k = 0.2444 0.1730-0.1474 ( 2650 PWs) bands (ev): -22.6335 -22.6335 -21.9262 -21.9262 -21.5018 -21.5018 -21.1606 -21.1606 -9.7089 -9.7089 -9.2929 -9.2929 -8.8909 -8.8909 -8.5607 -8.5607 -4.6186 -4.6186 -4.3007 -4.3007 -4.2289 -4.2289 -3.5039 -3.5039 -2.9277 -2.9277 -2.4700 -2.4700 -2.0680 -2.0680 -1.5359 -1.5359 -0.5449 -0.5449 -0.4092 -0.4092 -0.1834 -0.1834 -0.1537 -0.1537 2.9688 2.9688 3.2686 3.2686 3.3606 3.3606 4.7031 4.7031 5.4652 5.4652 5.8098 5.8098 6.0105 6.0105 6.0519 6.0519 14.2078 14.2078 k = 0.2556 0.1809-0.1541 ( 2650 PWs) bands (ev): -22.6206 -22.6206 -21.9273 -21.9273 -21.5081 -21.5081 -21.1703 -21.1703 -9.7175 -9.7175 -9.3046 -9.3046 -8.8848 -8.8848 -8.5499 -8.5499 -4.6045 -4.6045 -4.2899 -4.2899 -4.1939 -4.1939 -3.4826 -3.4826 -2.9160 -2.9160 -2.4597 -2.4597 -2.0522 -2.0522 -1.5557 -1.5557 -0.5834 -0.5834 -0.4397 -0.4397 -0.2152 -0.2152 -0.1750 -0.1750 2.9889 2.9889 3.2835 3.2835 3.4021 3.4021 4.6808 4.6808 5.4234 5.4234 5.7975 5.7975 5.9834 5.9834 6.0453 6.0453 14.2081 14.2081 k = 0.2667 0.1887-0.1608 ( 2650 PWs) bands (ev): -22.6074 -22.6074 -21.9284 -21.9284 -21.5147 -21.5147 -21.1799 -21.1799 -9.7260 -9.7260 -9.3162 -9.3162 -8.8787 -8.8787 -8.5392 -8.5392 -4.5909 -4.5909 -4.2791 -4.2791 -4.1576 -4.1576 -3.4613 -3.4613 -2.9040 -2.9040 -2.4487 -2.4487 -2.0360 -2.0360 -1.5761 -1.5761 -0.6223 -0.6223 -0.4703 -0.4703 -0.2480 -0.2480 -0.1964 -0.1964 3.0090 3.0090 3.2995 3.2995 3.4450 3.4450 4.6572 4.6572 5.3814 5.3814 5.7855 5.7855 5.9550 5.9550 6.0391 6.0391 14.2093 14.2093 k = 0.2778 0.1966-0.1675 ( 2654 PWs) bands (ev): -22.5940 -22.5940 -21.9294 -21.9294 -21.5218 -21.5218 -21.1893 -21.1893 -9.7342 -9.7342 -9.3277 -9.3277 -8.8726 -8.8726 -8.5287 -8.5287 -4.5779 -4.5779 -4.2684 -4.2684 -4.1200 -4.1200 -3.4404 -3.4404 -2.8916 -2.8916 -2.4369 -2.4369 -2.0197 -2.0197 -1.5968 -1.5968 -0.6613 -0.6613 -0.5010 -0.5010 -0.2814 -0.2814 -0.2181 -0.2181 3.0292 3.0292 3.3164 3.3164 3.4892 3.4892 4.6324 4.6324 5.3392 5.3392 5.7739 5.7739 5.9252 5.9252 6.0329 6.0329 14.2114 14.2114 k = 0.2889 0.2045-0.1742 ( 2651 PWs) bands (ev): -22.5804 -22.5804 -21.9305 -21.9305 -21.5291 -21.5291 -21.1985 -21.1985 -9.7422 -9.7422 -9.3390 -9.3390 -8.8666 -8.8666 -8.5183 -8.5183 -4.5654 -4.5654 -4.2578 -4.2578 -4.0815 -4.0815 -3.4199 -3.4199 -2.8789 -2.8789 -2.4243 -2.4243 -2.0033 -2.0033 -1.6178 -1.6178 -0.7003 -0.7003 -0.5315 -0.5315 -0.3152 -0.3152 -0.2400 -0.2400 3.0494 3.0494 3.3344 3.3344 3.5343 3.5343 4.6062 4.6062 5.2972 5.2972 5.7629 5.7629 5.8945 5.8945 6.0269 6.0269 14.2144 14.2144 k = 0.3000 0.2123-0.1809 ( 2649 PWs) bands (ev): -22.5668 -22.5668 -21.9316 -21.9316 -21.5369 -21.5369 -21.2074 -21.2074 -9.7499 -9.7499 -9.3501 -9.3501 -8.8607 -8.8607 -8.5082 -8.5082 -4.5536 -4.5536 -4.2474 -4.2474 -4.0421 -4.0421 -3.4000 -3.4000 -2.8659 -2.8659 -2.4109 -2.4109 -1.9868 -1.9868 -1.6390 -1.6390 -0.7392 -0.7392 -0.5617 -0.5617 -0.3492 -0.3492 -0.2621 -0.2621 3.0698 3.0698 3.3534 3.3534 3.5802 3.5802 4.5789 4.5789 5.2554 5.2554 5.7523 5.7523 5.8628 5.8628 6.0211 6.0211 14.2183 14.2183 k = 0.3111 0.2202-0.1875 ( 2647 PWs) bands (ev): -22.5531 -22.5531 -21.9326 -21.9326 -21.5449 -21.5449 -21.2160 -21.2160 -9.7574 -9.7574 -9.3610 -9.3610 -8.8549 -8.8549 -8.4983 -8.4983 -4.5423 -4.5423 -4.2373 -4.2373 -4.0020 -4.0020 -3.3810 -3.3810 -2.8528 -2.8528 -2.3966 -2.3966 -1.9704 -1.9704 -1.6605 -1.6605 -0.7777 -0.7777 -0.5915 -0.5915 -0.3833 -0.3833 -0.2841 -0.2841 3.0903 3.0903 3.3733 3.3733 3.6264 3.6264 4.5504 4.5504 5.2141 5.2141 5.7423 5.7423 5.8303 5.8303 6.0154 6.0154 14.2231 14.2231 k = 0.3222 0.2281-0.1942 ( 2651 PWs) bands (ev): -22.5394 -22.5394 -21.9336 -21.9336 -21.5532 -21.5532 -21.2242 -21.2242 -9.7645 -9.7645 -9.3715 -9.3715 -8.8493 -8.8493 -8.4888 -8.4888 -4.5317 -4.5317 -4.2275 -4.2275 -3.9614 -3.9614 -3.3631 -3.3631 -2.8395 -2.8395 -2.3816 -2.3816 -1.9541 -1.9541 -1.6820 -1.6820 -0.8156 -0.8156 -0.6207 -0.6207 -0.4173 -0.4173 -0.3061 -0.3061 3.1109 3.1109 3.3943 3.3943 3.6728 3.6728 4.5209 4.5209 5.1735 5.1735 5.7329 5.7329 5.7971 5.7971 6.0099 6.0099 14.2289 14.2289 k = 0.3333 0.2359-0.2009 ( 2656 PWs) bands (ev): -22.5258 -22.5258 -21.9346 -21.9346 -21.5618 -21.5618 -21.2320 -21.2320 -9.7712 -9.7712 -9.3817 -9.3817 -8.8438 -8.8438 -8.4796 -8.4796 -4.5216 -4.5216 -4.2180 -4.2180 -3.9205 -3.9205 -3.3464 -3.3464 -2.8263 -2.8263 -2.3658 -2.3658 -1.9381 -1.9381 -1.7036 -1.7036 -0.8528 -0.8528 -0.6491 -0.6491 -0.4510 -0.4510 -0.3279 -0.3279 3.1316 3.1316 3.4162 3.4162 3.7190 3.7190 4.4904 4.4904 5.1338 5.1338 5.7238 5.7238 5.7637 5.7637 6.0045 6.0045 14.2355 14.2355 k = 0.3444 0.2438-0.2076 ( 2658 PWs) bands (ev): -22.5124 -22.5124 -21.9355 -21.9355 -21.5705 -21.5705 -21.2393 -21.2393 -9.7776 -9.7776 -9.3915 -9.3915 -8.8386 -8.8386 -8.4709 -8.4709 -4.5121 -4.5121 -4.2089 -4.2089 -3.8794 -3.8794 -3.3312 -3.3312 -2.8130 -2.8130 -2.3492 -2.3492 -1.9224 -1.9224 -1.7252 -1.7252 -0.8890 -0.8890 -0.6766 -0.6766 -0.4843 -0.4843 -0.3494 -0.3494 3.1522 3.1522 3.4390 3.4390 3.7648 3.7648 4.4590 4.4590 5.0954 5.0954 5.7135 5.7135 5.7316 5.7316 5.9994 5.9994 14.2432 14.2432 k = 0.3556 0.2517-0.2143 ( 2658 PWs) bands (ev): -22.4992 -22.4992 -21.9364 -21.9364 -21.5793 -21.5793 -21.2462 -21.2462 -9.7836 -9.7836 -9.4009 -9.4009 -8.8336 -8.8336 -8.4625 -8.4625 -4.5032 -4.5032 -4.2003 -4.2003 -3.8382 -3.8382 -3.3177 -3.3177 -2.7999 -2.7999 -2.3319 -2.3319 -1.9072 -1.9072 -1.7467 -1.7467 -0.9241 -0.9241 -0.7031 -0.7031 -0.5168 -0.5168 -0.3704 -0.3704 3.1727 3.1727 3.4627 3.4627 3.8099 3.8099 4.4270 4.4270 5.0584 5.0584 5.6904 5.6904 5.7127 5.7127 5.9945 5.9945 14.2517 14.2517 k = 0.3667 0.2595-0.2210 ( 2662 PWs) bands (ev): -22.4864 -22.4864 -21.9372 -21.9372 -21.5882 -21.5882 -21.2525 -21.2525 -9.7892 -9.7892 -9.4097 -9.4097 -8.8288 -8.8288 -8.4546 -8.4546 -4.4949 -4.4949 -4.1921 -4.1921 -3.7973 -3.7973 -3.3061 -3.3061 -2.7871 -2.7871 -2.3139 -2.3139 -1.8926 -1.8926 -1.7680 -1.7680 -0.9577 -0.9577 -0.7283 -0.7283 -0.5484 -0.5484 -0.3908 -0.3908 3.1930 3.1930 3.4872 3.4872 3.8537 3.8537 4.3944 4.3944 5.0232 5.0232 5.6572 5.6572 5.7045 5.7045 5.9898 5.9898 14.2611 14.2611 k = 0.3778 0.2674-0.2277 ( 2662 PWs) bands (ev): -22.4741 -22.4741 -21.9380 -21.9380 -21.5969 -21.5969 -21.2583 -21.2583 -9.7944 -9.7944 -9.4180 -9.4180 -8.8244 -8.8244 -8.4472 -8.4472 -4.4873 -4.4873 -4.1844 -4.1844 -3.7567 -3.7567 -3.2966 -3.2966 -2.7746 -2.7746 -2.2953 -2.2953 -1.8786 -1.8786 -1.7890 -1.7890 -0.9897 -0.9897 -0.7521 -0.7521 -0.5789 -0.5789 -0.4105 -0.4105 3.2129 3.2129 3.5124 3.5124 3.8961 3.8961 4.3614 4.3614 4.9901 4.9901 5.6230 5.6230 5.6981 5.6981 5.9854 5.9854 14.2713 14.2713 k = 0.3889 0.2752-0.2344 ( 2665 PWs) bands (ev): -22.4623 -22.4623 -21.9387 -21.9387 -21.6055 -21.6055 -21.2637 -21.2637 -9.7992 -9.7992 -9.4257 -9.4257 -8.8202 -8.8202 -8.4403 -8.4403 -4.4803 -4.4803 -4.1773 -4.1773 -3.7167 -3.7167 -3.2895 -3.2895 -2.7625 -2.7625 -2.2762 -2.2762 -1.8657 -1.8657 -1.8098 -1.8098 -1.0199 -1.0199 -0.7743 -0.7743 -0.6080 -0.6080 -0.4293 -0.4293 3.2322 3.2322 3.5382 3.5382 3.9365 3.9365 4.3282 4.3282 4.9595 4.9595 5.5890 5.5890 5.6925 5.6925 5.9813 5.9813 14.2822 14.2822 k = 0.4000 0.2831-0.2411 ( 2663 PWs) bands (ev): -22.4511 -22.4511 -21.9394 -21.9394 -21.6137 -21.6137 -21.2685 -21.2685 -9.8036 -9.8036 -9.4328 -9.4328 -8.8164 -8.8164 -8.4340 -8.4340 -4.4739 -4.4739 -4.1708 -4.1708 -3.6774 -3.6774 -3.2848 -3.2848 -2.7511 -2.7511 -2.2566 -2.2566 -1.8543 -1.8543 -1.8295 -1.8295 -1.0479 -1.0479 -0.7948 -0.7948 -0.6355 -0.6355 -0.4471 -0.4471 3.2507 3.2507 3.5644 3.5644 3.9745 3.9745 4.2951 4.2951 4.9316 4.9316 5.5558 5.5558 5.6876 5.6876 5.9775 5.9775 14.2939 14.2939 k = 0.4111 0.2910-0.2478 ( 2665 PWs) bands (ev): -22.4407 -22.4407 -21.9400 -21.9400 -21.6216 -21.6216 -21.2728 -21.2728 -9.8075 -9.8075 -9.4393 -9.4393 -8.8129 -8.8129 -8.4283 -8.4283 -4.4682 -4.4682 -4.1649 -4.1649 -3.6391 -3.6391 -3.2828 -3.2828 -2.7404 -2.7404 -2.2367 -2.2367 -1.8544 -1.8544 -1.8384 -1.8384 -1.0737 -1.0737 -0.8135 -0.8135 -0.6611 -0.6611 -0.4635 -0.4635 3.2683 3.2683 3.5909 3.5909 4.0097 4.0097 4.2623 4.2623 4.9067 4.9067 5.5236 5.5236 5.6833 5.6833 5.9741 5.9741 14.3060 14.3060 k = 0.4222 0.2988-0.2545 ( 2669 PWs) bands (ev): -22.4312 -22.4312 -21.9406 -21.9406 -21.6289 -21.6289 -21.2765 -21.2765 -9.8109 -9.8109 -9.4451 -9.4451 -8.8098 -8.8098 -8.4232 -8.4232 -4.4632 -4.4632 -4.1597 -4.1597 -3.6020 -3.6020 -3.2835 -3.2835 -2.7306 -2.7306 -2.2167 -2.2167 -1.8724 -1.8724 -1.8302 -1.8302 -1.0970 -1.0970 -0.8302 -0.8302 -0.6845 -0.6845 -0.4786 -0.4786 3.2847 3.2847 3.6173 3.6173 4.0415 4.0415 4.2302 4.2302 4.8851 4.8851 5.4931 5.4931 5.6797 5.6797 5.9710 5.9710 14.3185 14.3185 k = 0.4333 0.3067-0.2612 ( 2669 PWs) bands (ev): -22.4226 -22.4226 -21.9411 -21.9411 -21.6356 -21.6356 -21.2797 -21.2797 -9.8139 -9.8139 -9.4501 -9.4501 -8.8070 -8.8070 -8.4187 -8.4187 -4.4588 -4.4588 -4.1551 -4.1551 -3.5663 -3.5663 -3.2870 -3.2870 -2.7218 -2.7218 -2.1968 -2.1968 -1.8916 -1.8916 -1.8215 -1.8215 -1.1175 -1.1175 -0.8448 -0.8448 -0.7055 -0.7055 -0.4921 -0.4921 3.2996 3.2996 3.6433 3.6433 4.0695 4.0695 4.1995 4.1995 4.8669 4.8669 5.4647 5.4647 5.6765 5.6765 5.9683 5.9683 14.3311 14.3311 k = 0.4444 0.3146-0.2679 ( 2669 PWs) bands (ev): -22.4152 -22.4152 -21.9415 -21.9415 -21.6415 -21.6415 -21.2825 -21.2825 -9.8165 -9.8165 -9.4545 -9.4545 -8.8047 -8.8047 -8.4149 -8.4149 -4.4551 -4.4551 -4.1511 -4.1511 -3.5324 -3.5324 -3.2932 -3.2932 -2.7141 -2.7141 -2.1773 -2.1773 -1.9103 -1.9103 -1.8139 -1.8139 -1.1352 -1.1352 -0.8574 -0.8574 -0.7238 -0.7238 -0.5039 -0.5039 3.3128 3.3128 3.6683 3.6683 4.0930 4.0930 4.1709 4.1709 4.8522 4.8522 5.4390 5.4390 5.6739 5.6739 5.9659 5.9659 14.3435 14.3435 k = 0.4556 0.3224-0.2746 ( 2671 PWs) bands (ev): -22.4089 -22.4089 -21.9418 -21.9418 -21.6464 -21.6464 -21.2847 -21.2847 -9.8186 -9.8186 -9.4580 -9.4580 -8.8028 -8.8028 -8.4117 -8.4117 -4.4520 -4.4520 -4.1479 -4.1479 -3.5006 -3.5006 -3.3019 -3.3019 -2.7076 -2.7076 -2.1586 -2.1586 -1.9280 -1.9280 -1.8075 -1.8075 -1.1498 -1.1498 -0.8677 -0.8677 -0.7391 -0.7391 -0.5138 -0.5138 3.3241 3.3241 3.6915 3.6915 4.1100 4.1100 4.1471 4.1471 4.8409 4.8409 5.4167 5.4167 5.6718 5.6718 5.9640 5.9640 14.3552 14.3552 k = 0.4667 0.3303-0.2813 ( 2675 PWs) bands (ev): -22.4040 -22.4040 -21.9421 -21.9421 -21.6504 -21.6504 -21.2864 -21.2864 -9.8202 -9.8202 -9.4608 -9.4608 -8.8013 -8.8013 -8.4093 -8.4093 -4.4496 -4.4496 -4.1454 -4.1454 -3.4716 -3.4716 -3.3129 -3.3129 -2.7024 -2.7024 -2.1416 -2.1416 -1.9443 -1.9443 -1.8025 -1.8025 -1.1613 -1.1613 -0.8757 -0.8757 -0.7513 -0.7513 -0.5216 -0.5216 3.3331 3.3331 3.7120 3.7120 4.1100 4.1100 4.1394 4.1394 4.8326 4.8326 5.3983 5.3983 5.6702 5.6702 5.9625 5.9625 14.3656 14.3656 k = 0.4778 0.3382-0.2880 ( 2671 PWs) bands (ev): -22.4004 -22.4004 -21.9423 -21.9423 -21.6533 -21.6533 -21.2876 -21.2876 -9.8213 -9.8213 -9.4629 -9.4629 -8.8002 -8.8002 -8.4075 -8.4075 -4.4479 -4.4479 -4.1436 -4.1436 -3.4464 -3.4464 -3.3251 -3.3251 -2.6987 -2.6987 -2.1273 -2.1273 -1.9579 -1.9579 -1.7989 -1.7989 -1.1696 -1.1696 -0.8815 -0.8815 -0.7602 -0.7602 -0.5273 -0.5273 3.3397 3.3397 3.7283 3.7283 4.0959 4.0959 4.1462 4.1462 4.8272 4.8272 5.3847 5.3847 5.6690 5.6690 5.9614 5.9614 14.3740 14.3740 k = 0.4889 0.3460-0.2947 ( 2669 PWs) bands (ev): -22.3982 -22.3982 -21.9424 -21.9424 -21.6551 -21.6551 -21.2884 -21.2884 -9.8220 -9.8220 -9.4641 -9.4641 -8.7995 -8.7995 -8.4065 -8.4065 -4.4469 -4.4469 -4.1425 -4.1425 -3.4274 -3.4274 -3.3362 -3.3362 -2.6964 -2.6964 -2.1175 -2.1175 -1.9674 -1.9674 -1.7967 -1.7967 -1.1746 -1.1746 -0.8849 -0.8849 -0.7656 -0.7656 -0.5308 -0.5308 3.3437 3.3437 3.7390 3.7390 4.0850 4.0850 4.1519 4.1519 4.8241 4.8241 5.3763 5.3763 5.6684 5.6684 5.9607 5.9607 14.3795 14.3795 k = 0.5000 0.3539-0.3014 ( 2672 PWs) bands (ev): -22.3974 -22.3974 -21.9424 -21.9424 -21.6557 -21.6557 -21.2886 -21.2886 -9.8223 -9.8223 -9.4645 -9.4645 -8.7993 -8.7993 -8.4061 -8.4061 -4.4466 -4.4466 -4.1421 -4.1421 -3.4198 -3.4198 -3.3413 -3.3413 -2.6957 -2.6957 -2.1139 -2.1139 -1.9708 -1.9708 -1.7960 -1.7960 -1.1763 -1.1763 -0.8861 -0.8861 -0.7674 -0.7674 -0.5319 -0.5319 3.3450 3.3450 3.7428 3.7428 4.0810 4.0810 4.1539 4.1539 4.8231 4.8231 5.3734 5.3734 5.6681 5.6681 5.9605 5.9605 14.3815 14.3815 k = 0.5000 0.3539-0.3014 ( 2672 PWs) bands (ev): -22.3974 -22.3974 -21.9424 -21.9424 -21.6557 -21.6557 -21.2886 -21.2886 -9.8223 -9.8223 -9.4645 -9.4645 -8.7993 -8.7993 -8.4061 -8.4061 -4.4466 -4.4466 -4.1421 -4.1421 -3.4198 -3.4198 -3.3413 -3.3413 -2.6957 -2.6957 -2.1139 -2.1139 -1.9708 -1.9708 -1.7960 -1.7960 -1.1763 -1.1763 -0.8861 -0.8861 -0.7674 -0.7674 -0.5319 -0.5319 3.3450 3.3450 3.7428 3.7428 4.0810 4.0810 4.1539 4.1539 4.8231 4.8231 5.3734 5.3734 5.6681 5.6681 5.9605 5.9605 14.3815 14.3815 k = 0.5054 0.3577-0.2881 ( 2673 PWs) bands (ev): -22.3974 -22.3974 -21.9423 -21.9423 -21.6556 -21.6556 -21.2885 -21.2885 -9.8300 -9.8300 -9.4579 -9.4579 -8.8003 -8.8003 -8.4064 -8.4064 -4.4465 -4.4465 -4.1410 -4.1410 -3.4463 -3.4463 -3.3128 -3.3128 -2.6956 -2.6956 -2.1142 -2.1142 -1.9710 -1.9710 -1.7960 -1.7960 -1.1763 -1.1763 -0.8862 -0.8862 -0.7670 -0.7670 -0.5318 -0.5318 3.3445 3.3445 3.7407 3.7407 4.0829 4.0829 4.1546 4.1546 4.8242 4.8242 5.3739 5.3739 5.6674 5.6674 5.9618 5.9618 14.3632 14.3632 k = 0.5107 0.3615-0.2747 ( 2675 PWs) bands (ev): -22.3974 -22.3974 -21.9421 -21.9421 -21.6552 -21.6552 -21.2883 -21.2883 -9.8514 -9.8514 -9.4396 -9.4396 -8.8031 -8.8031 -8.4073 -8.4073 -4.4462 -4.4462 -4.1376 -4.1376 -3.4912 -3.4912 -3.2620 -3.2620 -2.6954 -2.6954 -2.1150 -2.1150 -1.9717 -1.9717 -1.7961 -1.7961 -1.1766 -1.1766 -0.8865 -0.8865 -0.7659 -0.7659 -0.5314 -0.5314 3.3429 3.3429 3.7347 3.7347 4.0882 4.0882 4.1567 4.1567 4.8274 4.8274 5.3753 5.3753 5.6652 5.6652 5.9658 5.9658 14.3192 14.3192 k = 0.5161 0.3653-0.2614 ( 2677 PWs) bands (ev): -22.3973 -22.3973 -21.9418 -21.9418 -21.6547 -21.6547 -21.2878 -21.2878 -9.8832 -9.8832 -9.4134 -9.4134 -8.8077 -8.8077 -8.4088 -8.4088 -4.4458 -4.4458 -4.1321 -4.1321 -3.5369 -3.5369 -3.2064 -3.2064 -2.6952 -2.6952 -2.1163 -2.1163 -1.9727 -1.9727 -1.7962 -1.7962 -1.1770 -1.1770 -0.8870 -0.8870 -0.7640 -0.7640 -0.5308 -0.5308 3.3403 3.3403 3.7251 3.7251 4.0966 4.0966 4.1603 4.1603 4.8329 4.8329 5.3776 5.3776 5.6618 5.6618 5.9722 5.9722 14.2630 14.2631 k = 0.5214 0.3691-0.2480 ( 2677 PWs) bands (ev): -22.3972 -22.3972 -21.9413 -21.9413 -21.6539 -21.6539 -21.2871 -21.2871 -9.9219 -9.9219 -9.3824 -9.3824 -8.8142 -8.8142 -8.4107 -8.4107 -4.4454 -4.4454 -4.1243 -4.1243 -3.5806 -3.5806 -3.1487 -3.1487 -2.6948 -2.6948 -2.1182 -2.1182 -1.9742 -1.9742 -1.7964 -1.7964 -1.1776 -1.1776 -0.8877 -0.8877 -0.7613 -0.7613 -0.5299 -0.5299 3.3369 3.3369 3.7128 3.7128 4.1074 4.1074 4.1650 4.1650 4.8404 4.8404 5.3808 5.3808 5.6576 5.6576 5.9807 5.9807 14.2014 14.2014 k = 0.5268 0.3729-0.2347 ( 2679 PWs) bands (ev): -22.3971 -22.3971 -21.9407 -21.9407 -21.6529 -21.6529 -21.2863 -21.2863 -9.9651 -9.9651 -9.3494 -9.3494 -8.8225 -8.8225 -8.4129 -8.4129 -4.4452 -4.4452 -4.1145 -4.1145 -3.6212 -3.6212 -3.0901 -3.0901 -2.6943 -2.6943 -2.1207 -2.1207 -1.9759 -1.9759 -1.7967 -1.7967 -1.1784 -1.1784 -0.8885 -0.8885 -0.7579 -0.7579 -0.5287 -0.5287 3.3327 3.3327 3.6983 3.6983 4.1197 4.1197 4.1710 4.1710 4.8500 4.8500 5.3849 5.3849 5.6528 5.6528 5.9910 5.9910 14.1369 14.1369 k = 0.5322 0.3767-0.2213 ( 2681 PWs) bands (ev): -22.3969 -22.3969 -21.9399 -21.9399 -21.6517 -21.6517 -21.2853 -21.2853 -10.0112 -10.0112 -9.3162 -9.3162 -8.8324 -8.8324 -8.4153 -8.4153 -4.4455 -4.4455 -4.1027 -4.1027 -3.6581 -3.6581 -3.0309 -3.0309 -2.6937 -2.6937 -2.1236 -2.1236 -1.9779 -1.9779 -1.7971 -1.7971 -1.1792 -1.1792 -0.8894 -0.8894 -0.7538 -0.7538 -0.5274 -0.5274 3.3278 3.3278 3.6824 3.6824 4.1328 4.1328 4.1780 4.1780 4.8617 4.8617 5.3899 5.3899 5.6479 5.6479 6.0027 6.0027 14.0708 14.0708 k = 0.5375 0.3804-0.2080 ( 2677 PWs) bands (ev): -22.3967 -22.3967 -21.9390 -21.9390 -21.6502 -21.6502 -21.2841 -21.2841 -10.0590 -10.0590 -9.2838 -9.2838 -8.8440 -8.8440 -8.4176 -8.4176 -4.4464 -4.4464 -4.0890 -4.0890 -3.6909 -3.6909 -2.9717 -2.9717 -2.6931 -2.6931 -2.1271 -2.1271 -1.9801 -1.9801 -1.7975 -1.7975 -1.1800 -1.1800 -0.8905 -0.8905 -0.7490 -0.7490 -0.5257 -0.5257 3.3226 3.3226 3.6655 3.6655 4.1463 4.1463 4.1859 4.1859 4.8754 4.8754 5.3957 5.3957 5.6433 5.6433 6.0155 6.0155 14.0040 14.0040 k = 0.5429 0.3842-0.1946 ( 2676 PWs) bands (ev): -22.3966 -22.3966 -21.9380 -21.9380 -21.6486 -21.6486 -21.2827 -21.2827 -10.1078 -10.1078 -9.2532 -9.2532 -8.8571 -8.8571 -8.4196 -8.4196 -4.4481 -4.4481 -4.0734 -4.0734 -3.7192 -3.7192 -2.9129 -2.9129 -2.6923 -2.6923 -2.1311 -2.1311 -1.9824 -1.9824 -1.7980 -1.7980 -1.1809 -1.1809 -0.8917 -0.8917 -0.7434 -0.7434 -0.5238 -0.5238 3.3170 3.3170 3.6481 3.6481 4.1595 4.1595 4.1946 4.1946 4.8910 4.8910 5.4025 5.4025 5.6391 5.6391 6.0291 6.0291 13.9368 13.9368 k = 0.5482 0.3880-0.1813 ( 2676 PWs) bands (ev): -22.3964 -22.3964 -21.9369 -21.9369 -21.6467 -21.6467 -21.2811 -21.2811 -10.1572 -10.1572 -9.2252 -9.2252 -8.8717 -8.8717 -8.4212 -8.4212 -4.4508 -4.4508 -4.0562 -4.0562 -3.7428 -3.7428 -2.8548 -2.8548 -2.6915 -2.6915 -2.1356 -2.1356 -1.9846 -1.9846 -1.7987 -1.7987 -1.1818 -1.1818 -0.8929 -0.8929 -0.7372 -0.7372 -0.5217 -0.5217 3.3114 3.3114 3.6305 3.6305 4.1722 4.1722 4.2038 4.2038 4.9085 4.9085 5.4100 5.4100 5.6358 5.6358 6.0432 6.0432 13.8697 13.8697 k = 0.5536 0.3918-0.1679 ( 2674 PWs) bands (ev): -22.3962 -22.3962 -21.9357 -21.9357 -21.6447 -21.6447 -21.2794 -21.2794 -10.2068 -10.2068 -9.2002 -9.2002 -8.8876 -8.8876 -8.4221 -8.4221 -4.4545 -4.4545 -4.0375 -4.0375 -3.7614 -3.7614 -2.7979 -2.7979 -2.6906 -2.6906 -2.1405 -2.1405 -1.9865 -1.9865 -1.7994 -1.7994 -1.1826 -1.1826 -0.8941 -0.8941 -0.7304 -0.7304 -0.5194 -0.5194 3.3058 3.3058 3.6132 3.6132 4.1840 4.1840 4.2133 4.2133 4.9276 4.9276 5.4184 5.4184 5.6335 5.6335 6.0577 6.0577 13.8029 13.8029 k = 0.5590 0.3956-0.1546 ( 2670 PWs) bands (ev): -22.3961 -22.3961 -21.9343 -21.9343 -21.6424 -21.6424 -21.2775 -21.2775 -10.2561 -10.2561 -9.1787 -9.1787 -8.9048 -8.9048 -8.4221 -8.4221 -4.4592 -4.4592 -4.0174 -4.0174 -3.7752 -3.7752 -2.7425 -2.7425 -2.6896 -2.6896 -2.1459 -2.1459 -1.9880 -1.9880 -1.8003 -1.8003 -1.1833 -1.1833 -0.8952 -0.8952 -0.7228 -0.7228 -0.5167 -0.5167 3.3003 3.3003 3.5962 3.5962 4.1949 4.1949 4.2228 4.2228 4.9485 4.9485 5.4276 5.4276 5.6324 5.6324 6.0723 6.0723 13.7368 13.7368 k = 0.5643 0.3994-0.1412 ( 2672 PWs) bands (ev): -22.3960 -22.3960 -21.9328 -21.9328 -21.6399 -21.6399 -21.2754 -21.2754 -10.3050 -10.3050 -9.1608 -9.1608 -8.9231 -8.9231 -8.4211 -8.4211 -4.4648 -4.4648 -3.9962 -3.9962 -3.7844 -3.7844 -2.6907 -2.6907 -2.6869 -2.6869 -2.1516 -2.1516 -1.9889 -1.9889 -1.8013 -1.8013 -1.1838 -1.1838 -0.8963 -0.8963 -0.7147 -0.7147 -0.5139 -0.5139 3.2952 3.2952 3.5798 3.5798 4.2048 4.2048 4.2321 4.2321 4.9708 4.9708 5.4375 5.4375 5.6327 5.6327 6.0869 6.0869 13.6714 13.6714 k = 0.5697 0.4032-0.1279 ( 2672 PWs) bands (ev): -22.3960 -22.3960 -21.9313 -21.9313 -21.6372 -21.6372 -21.2732 -21.2732 -10.3533 -10.3533 -9.1469 -9.1469 -8.9424 -8.9424 -8.4192 -8.4192 -4.4709 -4.4709 -3.9739 -3.9739 -3.7892 -3.7892 -2.6875 -2.6875 -2.6379 -2.6379 -2.1576 -2.1576 -1.9887 -1.9887 -1.8024 -1.8024 -1.1841 -1.1841 -0.8973 -0.8973 -0.7060 -0.7060 -0.5108 -0.5108 3.2906 3.2906 3.5640 3.5640 4.2138 4.2138 4.2410 4.2410 4.9946 4.9946 5.4482 5.4482 5.6344 5.6344 6.1013 6.1013 13.6069 13.6069 k = 0.5751 0.4070-0.1145 ( 2670 PWs) bands (ev): -22.3961 -22.3961 -21.9296 -21.9296 -21.6344 -21.6344 -21.2708 -21.2708 -10.4008 -10.4008 -9.1369 -9.1369 -8.9626 -8.9626 -8.4163 -8.4163 -4.4772 -4.4772 -3.9508 -3.9508 -3.7900 -3.7900 -2.6863 -2.6863 -2.5899 -2.5899 -2.1638 -2.1638 -1.9873 -1.9873 -1.8036 -1.8036 -1.1841 -1.1841 -0.8980 -0.8980 -0.6967 -0.6967 -0.5075 -0.5075 3.2864 3.2864 3.5490 3.5490 4.2217 4.2217 4.2492 4.2492 5.0197 5.0197 5.4596 5.4596 5.6377 5.6377 6.1154 6.1154 13.5437 13.5437 k = 0.5804 0.4108-0.1012 ( 2668 PWs) bands (ev): -22.3962 -22.3962 -21.9279 -21.9279 -21.6313 -21.6313 -21.2683 -21.2683 -10.4474 -10.4474 -9.1308 -9.1308 -8.9836 -8.9836 -8.4125 -8.4125 -4.4834 -4.4834 -3.9271 -3.9271 -3.7873 -3.7873 -2.6850 -2.6850 -2.5454 -2.5454 -2.1701 -2.1701 -1.9842 -1.9842 -1.8050 -1.8050 -1.1838 -1.1838 -0.8986 -0.8986 -0.6868 -0.6868 -0.5040 -0.5040 3.2827 3.2827 3.5348 3.5348 4.2285 4.2285 4.2568 4.2568 5.0459 5.0459 5.4717 5.4717 5.6425 5.6425 6.1292 6.1292 13.4818 13.4818 k = 0.5858 0.4146-0.0879 ( 2668 PWs) bands (ev): -22.3964 -22.3964 -21.9261 -21.9261 -21.6281 -21.6281 -21.2657 -21.2657 -10.4928 -10.4928 -9.1284 -9.1284 -9.0052 -9.0052 -8.4080 -8.4080 -4.4890 -4.4890 -3.9031 -3.9031 -3.7818 -3.7818 -2.6835 -2.6835 -2.5051 -2.5051 -2.1762 -2.1762 -1.9791 -1.9791 -1.8064 -1.8064 -1.1831 -1.1831 -0.8989 -0.8989 -0.6765 -0.6765 -0.5002 -0.5002 3.2797 3.2797 3.5215 3.5215 4.2341 4.2341 4.2638 4.2638 5.0732 5.0732 5.4845 5.4845 5.6487 5.6487 6.1425 6.1425 13.4215 13.4215 k = 0.5911 0.4184-0.0745 ( 2667 PWs) bands (ev): -22.3967 -22.3967 -21.9242 -21.9242 -21.6246 -21.6246 -21.2629 -21.2629 -10.5371 -10.5371 -9.1295 -9.1295 -9.0273 -9.0273 -8.4031 -8.4031 -4.4936 -4.4936 -3.8789 -3.8789 -3.7740 -3.7740 -2.6820 -2.6820 -2.4695 -2.4695 -2.1819 -2.1819 -1.9717 -1.9717 -1.8079 -1.8079 -1.1821 -1.1821 -0.8988 -0.8988 -0.6656 -0.6656 -0.4961 -0.4961 3.2772 3.2772 3.5090 3.5090 4.2385 4.2385 4.2703 4.2703 5.1014 5.1014 5.4980 5.4980 5.6564 5.6564 6.1552 6.1552 13.3628 13.3628 k = 0.5965 0.4222-0.0612 ( 2670 PWs) bands (ev): -22.3971 -22.3971 -21.9222 -21.9222 -21.6210 -21.6210 -21.2599 -21.2599 -10.5799 -10.5799 -9.1337 -9.1337 -9.0499 -9.0499 -8.3981 -8.3981 -4.4970 -4.4970 -3.8549 -3.8549 -3.7643 -3.7643 -2.6802 -2.6802 -2.4392 -2.4392 -2.1869 -2.1869 -1.9617 -1.9617 -1.8094 -1.8094 -1.1805 -1.1805 -0.8984 -0.8984 -0.6544 -0.6544 -0.4918 -0.4918 3.2754 3.2754 3.4973 3.4973 4.2416 4.2416 4.2761 4.2761 5.1305 5.1305 5.5121 5.5121 5.6655 5.6655 6.1674 6.1674 13.3059 13.3059 k = 0.6019 0.4260-0.0478 ( 2670 PWs) bands (ev): -22.3976 -22.3976 -21.9202 -21.9202 -21.6173 -21.6173 -21.2569 -21.2569 -10.6214 -10.6214 -9.1406 -9.1406 -9.0727 -9.0727 -8.3932 -8.3932 -4.4987 -4.4987 -3.8312 -3.8312 -3.7535 -3.7535 -2.6782 -2.6782 -2.4146 -2.4146 -2.1908 -2.1908 -1.9490 -1.9490 -1.8110 -1.8110 -1.1786 -1.1786 -0.8976 -0.8976 -0.6427 -0.6427 -0.4873 -0.4873 3.2741 3.2741 3.4864 3.4864 4.2436 4.2436 4.2815 4.2815 5.1602 5.1602 5.5268 5.5268 5.6758 5.6758 6.1789 6.1789 13.2511 13.2511 k = 0.6072 0.4298-0.0345 ( 2667 PWs) bands (ev): -22.3984 -22.3984 -21.9182 -21.9182 -21.6134 -21.6134 -21.2537 -21.2537 -10.6613 -10.6613 -9.1500 -9.1500 -9.0956 -9.0956 -8.3889 -8.3889 -4.4986 -4.4986 -3.8081 -3.8081 -3.7419 -3.7419 -2.6759 -2.6759 -2.3959 -2.3959 -2.1931 -2.1931 -1.9337 -1.9337 -1.8125 -1.8125 -1.1761 -1.1761 -0.8963 -0.8963 -0.6306 -0.6306 -0.4825 -0.4825 3.2733 3.2733 3.4763 3.4763 4.2444 4.2444 4.2862 4.2862 5.1906 5.1906 5.5421 5.5421 5.6874 5.6874 6.1897 6.1897 13.1984 13.1984 k = 0.6126 0.4336-0.0211 ( 2667 PWs) bands (ev): -22.3992 -22.3992 -21.9162 -21.9162 -21.6093 -21.6093 -21.2505 -21.2505 -10.6996 -10.6996 -9.1614 -9.1614 -9.1186 -9.1186 -8.3852 -8.3852 -4.4966 -4.4966 -3.7859 -3.7859 -3.7302 -3.7302 -2.6732 -2.6732 -2.3830 -2.3830 -2.1937 -2.1937 -1.9161 -1.9161 -1.8139 -1.8139 -1.1730 -1.1730 -0.8946 -0.8946 -0.6182 -0.6182 -0.4775 -0.4775 3.2729 3.2729 3.4667 3.4667 4.2443 4.2443 4.2903 4.2903 5.2215 5.2215 5.5580 5.5580 5.7000 5.7000 6.1998 6.1998 13.1480 13.1480 k = 0.6179 0.4374-0.0078 ( 2667 PWs) bands (ev): -22.4003 -22.4003 -21.9141 -21.9141 -21.6051 -21.6051 -21.2471 -21.2471 -10.7362 -10.7362 -9.1745 -9.1745 -9.1415 -9.1415 -8.3825 -8.3825 -4.4924 -4.4924 -3.7648 -3.7648 -3.7186 -3.7186 -2.6701 -2.6701 -2.3755 -2.3755 -2.1923 -2.1923 -1.8969 -1.8969 -1.8152 -1.8152 -1.1695 -1.1695 -0.8923 -0.8923 -0.6056 -0.6056 -0.4721 -0.4721 3.2730 3.2730 3.4578 3.4578 4.2434 4.2434 4.2937 4.2937 5.2529 5.2529 5.5744 5.5744 5.7135 5.7135 6.2092 6.2092 13.1002 13.1002 k = 0.6233 0.4412 0.0056 ( 2663 PWs) bands (ev): -22.4016 -22.4016 -21.9120 -21.9120 -21.6008 -21.6008 -21.2436 -21.2436 -10.7710 -10.7710 -9.1889 -9.1889 -9.1643 -9.1643 -8.3809 -8.3809 -4.4862 -4.4862 -3.7452 -3.7452 -3.7076 -3.7076 -2.6665 -2.6665 -2.3725 -2.3725 -2.1890 -2.1890 -1.8765 -1.8765 -1.8164 -1.8164 -1.1653 -1.1653 -0.8895 -0.8895 -0.5926 -0.5926 -0.4665 -0.4665 3.2732 3.2732 3.4493 3.4493 4.2419 4.2419 4.2962 4.2962 5.2845 5.2845 5.5913 5.5913 5.7278 5.7278 6.2178 6.2178 13.0549 13.0549 k = 0.6287 0.4450 0.0189 ( 2663 PWs) bands (ev): -22.4031 -22.4031 -21.9098 -21.9098 -21.5963 -21.5963 -21.2400 -21.2400 -10.8039 -10.8039 -9.2044 -9.2044 -9.1867 -9.1867 -8.3806 -8.3806 -4.4778 -4.4778 -3.7274 -3.7274 -3.6975 -3.6975 -2.6622 -2.6622 -2.3732 -2.3732 -2.1837 -2.1837 -1.8558 -1.8558 -1.8173 -1.8173 -1.1606 -1.1606 -0.8862 -0.8862 -0.5795 -0.5795 -0.4607 -0.4607 3.2737 3.2737 3.4412 3.4412 4.2400 4.2400 4.2978 4.2978 5.3165 5.3165 5.6087 5.6087 5.7428 5.7428 6.2256 6.2256 13.0124 13.0124 k = 0.6340 0.4487 0.0323 ( 2669 PWs) bands (ev): -22.4048 -22.4048 -21.9077 -21.9077 -21.5918 -21.5918 -21.2364 -21.2364 -10.8350 -10.8350 -9.2207 -9.2207 -9.2088 -9.2088 -8.3816 -8.3816 -4.4675 -4.4675 -3.7114 -3.7114 -3.6886 -3.6886 -2.6573 -2.6573 -2.3767 -2.3767 -2.1768 -2.1768 -1.8356 -1.8356 -1.8179 -1.8179 -1.1553 -1.1553 -0.8823 -0.8823 -0.5662 -0.5662 -0.4545 -0.4545 3.2741 3.2741 3.4333 3.4333 4.2378 4.2378 4.2984 4.2984 5.3486 5.3486 5.6265 5.6265 5.7583 5.7583 6.2326 6.2326 12.9728 12.9728 k = 0.6394 0.4525 0.0456 ( 2665 PWs) bands (ev): -22.4067 -22.4067 -21.9056 -21.9056 -21.5871 -21.5871 -21.2327 -21.2327 -10.8640 -10.8640 -9.2375 -9.2375 -9.2304 -9.2304 -8.3840 -8.3840 -4.4553 -4.4553 -3.6977 -3.6977 -3.6812 -3.6812 -2.6515 -2.6515 -2.3821 -2.3821 -2.1681 -2.1681 -1.8198 -1.8198 -1.8146 -1.8146 -1.1494 -1.1494 -0.8778 -0.8778 -0.5527 -0.5527 -0.4480 -0.4480 3.2746 3.2746 3.4256 3.4256 4.2355 4.2355 4.2980 4.2980 5.3808 5.3808 5.6448 5.6448 5.7742 5.7742 6.2389 6.2389 12.9363 12.9363 k = 0.6447 0.4563 0.0590 ( 2663 PWs) bands (ev): -22.4090 -22.4090 -21.9036 -21.9036 -21.5823 -21.5823 -21.2288 -21.2288 -10.8910 -10.8910 -9.2547 -9.2547 -9.2514 -9.2514 -8.3879 -8.3879 -4.4414 -4.4414 -3.6864 -3.6864 -3.6754 -3.6754 -2.6450 -2.6450 -2.3888 -2.3888 -2.1579 -2.1579 -1.8189 -1.8189 -1.7974 -1.7974 -1.1429 -1.1429 -0.8727 -0.8727 -0.5392 -0.5392 -0.4412 -0.4412 3.2748 3.2748 3.4179 3.4179 4.2333 4.2333 4.2965 4.2965 5.4131 5.4131 5.6635 5.6635 5.7905 5.7905 6.2443 6.2443 12.9030 12.9030 k = 0.6501 0.4601 0.0723 ( 2663 PWs) bands (ev): -22.4114 -22.4114 -21.9015 -21.9015 -21.5775 -21.5775 -21.2250 -21.2250 -10.9159 -10.9159 -9.2719 -9.2719 -9.2718 -9.2718 -8.3931 -8.3931 -4.4260 -4.4260 -3.6776 -3.6776 -3.6714 -3.6714 -2.6375 -2.6375 -2.3962 -2.3962 -2.1460 -2.1460 -1.8185 -1.8185 -1.7813 -1.7813 -1.1357 -1.1357 -0.8670 -0.8670 -0.5255 -0.5255 -0.4341 -0.4341 3.2747 3.2747 3.4101 3.4101 4.2312 4.2312 4.2938 4.2938 5.4452 5.4452 5.6825 5.6825 5.8070 5.8070 6.2490 6.2490 12.8729 12.8729 k = 0.6555 0.4639 0.0857 ( 2669 PWs) bands (ev): -22.4142 -22.4142 -21.8995 -21.8995 -21.5725 -21.5725 -21.2210 -21.2210 -10.9387 -10.9387 -9.2914 -9.2914 -9.2891 -9.2891 -8.3997 -8.3997 -4.4094 -4.4094 -3.6716 -3.6716 -3.6692 -3.6692 -2.6291 -2.6291 -2.4040 -2.4040 -2.1326 -2.1326 -1.8178 -1.8178 -1.7675 -1.7675 -1.1279 -1.1279 -0.8607 -0.8607 -0.5118 -0.5118 -0.4266 -0.4266 3.2742 3.2742 3.4021 3.4021 4.2294 4.2294 4.2899 4.2899 5.4772 5.4772 5.7019 5.7019 5.8235 5.8235 6.2529 6.2529 12.8463 12.8463 k = 0.6608 0.4677 0.0990 ( 2667 PWs) bands (ev): -22.4172 -22.4172 -21.8975 -21.8975 -21.5675 -21.5675 -21.2171 -21.2171 -10.9593 -10.9593 -9.3102 -9.3102 -9.3061 -9.3061 -8.4076 -8.4076 -4.3920 -4.3920 -3.6691 -3.6691 -3.6681 -3.6681 -2.6198 -2.6198 -2.4117 -2.4117 -2.1176 -2.1176 -1.8168 -1.8168 -1.7564 -1.7564 -1.1193 -1.1193 -0.8538 -0.8538 -0.4980 -0.4980 -0.4188 -0.4188 3.2731 3.2731 3.3939 3.3939 4.2280 4.2280 4.2848 4.2848 5.5090 5.5090 5.7215 5.7215 5.8402 5.8402 6.2560 6.2560 12.8232 12.8232 k = 0.6662 0.4715 0.1124 ( 2659 PWs) bands (ev): -22.4205 -22.4205 -21.8956 -21.8956 -21.5625 -21.5625 -21.2130 -21.2130 -10.9777 -10.9777 -9.3281 -9.3281 -9.3227 -9.3227 -8.4167 -8.4167 -4.3739 -4.3739 -3.6703 -3.6703 -3.6679 -3.6679 -2.6096 -2.6096 -2.4190 -2.4190 -2.1010 -2.1010 -1.8153 -1.8153 -1.7482 -1.7482 -1.1100 -1.1100 -0.8463 -0.8463 -0.4841 -0.4841 -0.4107 -0.4107 3.2714 3.2714 3.3853 3.3853 4.2271 4.2271 4.2784 4.2784 5.5404 5.5404 5.7414 5.7414 5.8567 5.8567 6.2584 6.2584 12.8038 12.8038 k = 0.6716 0.4753 0.1257 ( 2659 PWs) bands (ev): -22.4242 -22.4242 -21.8938 -21.8938 -21.5574 -21.5574 -21.2089 -21.2089 -10.9939 -10.9939 -9.3451 -9.3451 -9.3389 -9.3389 -8.4268 -8.4268 -4.3557 -4.3557 -3.6732 -3.6732 -3.6704 -3.6704 -2.5987 -2.5987 -2.4258 -2.4258 -2.0829 -2.0829 -1.8134 -1.8134 -1.7434 -1.7434 -1.0998 -1.0998 -0.8382 -0.8382 -0.4702 -0.4702 -0.4022 -0.4022 3.2689 3.2689 3.3762 3.3762 4.2264 4.2264 4.2709 4.2709 5.5713 5.5713 5.7616 5.7616 5.8731 5.8731 6.2601 6.2601 12.7882 12.7882 k = 0.6716 0.4753 0.1257 ( 2659 PWs) bands (ev): -22.4242 -22.4242 -21.8938 -21.8938 -21.5574 -21.5574 -21.2089 -21.2089 -10.9939 -10.9939 -9.3451 -9.3451 -9.3389 -9.3389 -8.4268 -8.4268 -4.3557 -4.3557 -3.6732 -3.6732 -3.6704 -3.6704 -2.5987 -2.5987 -2.4258 -2.4258 -2.0829 -2.0829 -1.8134 -1.8134 -1.7434 -1.7434 -1.0998 -1.0998 -0.8382 -0.8382 -0.4702 -0.4702 -0.4022 -0.4022 3.2689 3.2689 3.3762 3.3762 4.2264 4.2264 4.2709 4.2709 5.5713 5.5713 5.7616 5.7616 5.8731 5.8731 6.2601 6.2601 12.7882 12.7882 k = 0.6647 0.4704 0.1378 ( 2664 PWs) bands (ev): -22.4187 -22.4187 -21.8929 -21.8929 -21.5620 -21.5620 -21.2097 -21.2097 -10.9753 -10.9753 -9.3587 -9.3587 -9.3545 -9.3545 -8.4603 -8.4603 -4.3296 -4.3296 -3.6496 -3.6496 -3.6366 -3.6366 -2.5975 -2.5975 -2.4224 -2.4224 -2.0620 -2.0620 -1.8207 -1.8207 -1.7501 -1.7501 -1.1310 -1.1310 -0.8538 -0.8538 -0.4900 -0.4900 -0.4084 -0.4084 3.2998 3.2998 3.4087 3.4087 4.2345 4.2345 4.2947 4.2947 5.5539 5.5539 5.7330 5.7330 5.8570 5.8570 6.2445 6.2445 12.8078 12.8078 k = 0.6578 0.4656 0.1498 ( 2666 PWs) bands (ev): -22.4135 -22.4135 -21.8920 -21.8920 -21.5664 -21.5664 -21.2103 -21.2103 -10.9547 -10.9547 -9.3720 -9.3720 -9.3704 -9.3704 -8.4955 -8.4955 -4.3021 -4.3021 -3.6263 -3.6263 -3.6034 -3.6034 -2.5967 -2.5967 -2.4184 -2.4184 -2.0401 -2.0401 -1.8282 -1.8282 -1.7598 -1.7598 -1.1614 -1.1614 -0.8684 -0.8684 -0.5098 -0.5098 -0.4142 -0.4142 3.3300 3.3300 3.4410 3.4410 4.2426 4.2426 4.3185 4.3185 5.5364 5.5364 5.7043 5.7043 5.8405 5.8405 6.2283 6.2283 12.8307 12.8307 k = 0.6510 0.4607 0.1619 ( 2663 PWs) bands (ev): -22.4086 -22.4086 -21.8911 -21.8911 -21.5708 -21.5708 -21.2107 -21.2107 -10.9323 -10.9323 -9.3864 -9.3864 -9.3851 -9.3851 -8.5325 -8.5325 -4.2733 -4.2733 -3.6034 -3.6034 -3.5709 -3.5709 -2.5965 -2.5965 -2.4138 -2.4138 -2.0175 -2.0175 -1.8354 -1.8354 -1.7721 -1.7721 -1.1909 -1.1909 -0.8818 -0.8818 -0.5297 -0.5297 -0.4196 -0.4196 3.3597 3.3597 3.4730 3.4730 4.2511 4.2511 4.3420 4.3420 5.5191 5.5191 5.6757 5.6757 5.8238 5.8238 6.2115 6.2115 12.8567 12.8567 k = 0.6441 0.4559 0.1739 ( 2663 PWs) bands (ev): -22.4039 -22.4039 -21.8902 -21.8902 -21.5751 -21.5751 -21.2111 -21.2111 -10.9082 -10.9082 -9.4025 -9.4025 -9.3979 -9.3979 -8.5709 -8.5709 -4.2434 -4.2434 -3.5806 -3.5806 -3.5390 -3.5390 -2.5972 -2.5972 -2.4091 -2.4091 -1.9943 -1.9943 -1.8423 -1.8423 -1.7869 -1.7869 -1.2194 -1.2194 -0.8941 -0.8941 -0.5495 -0.5495 -0.4248 -0.4248 3.3886 3.3886 3.5046 3.5046 4.2602 4.2602 4.3651 4.3651 5.5020 5.5020 5.6472 5.6472 5.8070 5.8070 6.1940 6.1940 12.8856 12.8856 k = 0.6372 0.4510 0.1860 ( 2659 PWs) bands (ev): -22.3995 -22.3995 -21.8893 -21.8893 -21.5792 -21.5792 -21.2113 -21.2113 -10.8822 -10.8822 -9.4187 -9.4187 -9.4104 -9.4104 -8.6107 -8.6107 -4.2126 -4.2126 -3.5580 -3.5580 -3.5079 -3.5079 -2.5990 -2.5990 -2.4043 -2.4043 -1.9709 -1.9709 -1.8486 -1.8486 -1.8038 -1.8038 -1.2468 -1.2468 -0.9054 -0.9054 -0.5693 -0.5693 -0.4297 -0.4297 3.4167 3.4167 3.5357 3.5357 4.2696 4.2696 4.3876 4.3876 5.4851 5.4851 5.6188 5.6188 5.7900 5.7900 6.1761 6.1761 12.9174 12.9174 k = 0.6304 0.4462 0.1981 ( 2649 PWs) bands (ev): -22.3953 -22.3953 -21.8884 -21.8884 -21.5833 -21.5833 -21.2114 -21.2114 -10.8547 -10.8547 -9.4350 -9.4350 -9.4225 -9.4225 -8.6517 -8.6517 -4.1809 -4.1809 -3.5354 -3.5354 -3.4774 -3.4774 -2.6020 -2.6020 -2.3998 -2.3998 -1.9475 -1.9475 -1.8542 -1.8542 -1.8222 -1.8222 -1.2730 -1.2730 -0.9157 -0.9157 -0.5891 -0.5891 -0.4343 -0.4343 3.4439 3.4439 3.5663 3.5663 4.2796 4.2796 4.4096 4.4096 5.4686 5.4686 5.5907 5.5907 5.7732 5.7732 6.1578 6.1578 12.9519 12.9519 k = 0.6235 0.4413 0.2101 ( 2647 PWs) bands (ev): -22.3914 -22.3914 -21.8876 -21.8876 -21.5872 -21.5872 -21.2114 -21.2114 -10.8255 -10.8255 -9.4514 -9.4514 -9.4343 -9.4343 -8.6936 -8.6936 -4.1486 -4.1486 -3.5126 -3.5126 -3.4474 -3.4474 -2.6065 -2.6065 -2.3960 -2.3960 -1.9248 -1.9248 -1.8590 -1.8590 -1.8414 -1.8414 -1.2979 -1.2979 -0.9250 -0.9250 -0.6088 -0.6088 -0.4387 -0.4387 3.4702 3.4702 3.5962 3.5962 4.2899 4.2899 4.4310 4.4310 5.4525 5.4525 5.5628 5.5628 5.7564 5.7564 6.1391 6.1391 12.9888 12.9888 k = 0.6167 0.4365 0.2222 ( 2641 PWs) bands (ev): -22.3877 -22.3877 -21.8867 -21.8867 -21.5909 -21.5909 -21.2113 -21.2113 -10.7948 -10.7948 -9.4679 -9.4679 -9.4456 -9.4456 -8.7363 -8.7363 -4.1160 -4.1160 -3.4895 -3.4895 -3.4181 -3.4181 -2.6126 -2.6126 -2.3932 -2.3932 -1.9044 -1.9044 -1.8636 -1.8636 -1.8586 -1.8586 -1.3215 -1.3215 -0.9334 -0.9334 -0.6283 -0.6283 -0.4428 -0.4428 3.4955 3.4955 3.6254 3.6254 4.3004 4.3004 4.4518 4.4518 5.4369 5.4369 5.5353 5.5353 5.7399 5.7399 6.1202 6.1202 13.0279 13.0279 k = 0.6098 0.4316 0.2342 ( 2644 PWs) bands (ev): -22.3843 -22.3843 -21.8859 -21.8859 -21.5945 -21.5945 -21.2112 -21.2112 -10.7628 -10.7628 -9.4844 -9.4844 -9.4565 -9.4565 -8.7795 -8.7795 -4.0833 -4.0833 -3.4659 -3.4659 -3.3892 -3.3892 -2.6205 -2.6205 -2.3921 -2.3921 -1.8982 -1.8982 -1.8664 -1.8664 -1.8633 -1.8633 -1.3435 -1.3435 -0.9409 -0.9409 -0.6476 -0.6476 -0.4466 -0.4466 3.5197 3.5197 3.6536 3.6536 4.3112 4.3112 4.4719 4.4719 5.4218 5.4218 5.5082 5.5082 5.7237 5.7237 6.1011 6.1011 13.0692 13.0692 k = 0.6029 0.4267 0.2463 ( 2641 PWs) bands (ev): -22.3811 -22.3811 -21.8851 -21.8851 -21.5979 -21.5979 -21.2110 -21.2110 -10.7295 -10.7295 -9.5012 -9.5012 -9.4668 -9.4668 -8.8229 -8.8229 -4.0508 -4.0508 -3.4416 -3.4416 -3.3608 -3.3608 -2.6302 -2.6302 -2.3930 -2.3930 -1.9138 -1.9138 -1.8659 -1.8659 -1.8491 -1.8491 -1.3640 -1.3640 -0.9476 -0.9476 -0.6666 -0.6666 -0.4502 -0.4502 3.5428 3.5428 3.6809 3.6809 4.3221 4.3221 4.4914 4.4914 5.4073 5.4073 5.4816 5.4816 5.7080 5.7080 6.0819 6.0819 13.1123 13.1123 k = 0.5961 0.4219 0.2583 ( 2642 PWs) bands (ev): -22.3781 -22.3781 -21.8844 -21.8844 -21.6012 -21.6012 -21.2108 -21.2108 -10.6950 -10.6950 -9.5181 -9.5181 -9.4767 -9.4767 -8.8661 -8.8661 -4.0188 -4.0188 -3.4164 -3.4164 -3.3328 -3.3328 -2.6418 -2.6418 -2.3965 -2.3965 -1.9336 -1.9336 -1.8661 -1.8661 -1.8291 -1.8291 -1.3827 -1.3827 -0.9535 -0.9535 -0.6852 -0.6852 -0.4535 -0.4535 3.5647 3.5647 3.7072 3.7072 4.3329 4.3329 4.5102 4.5102 5.3934 5.3934 5.4557 5.4557 5.6928 5.6928 6.0628 6.0628 13.1570 13.1570 k = 0.5892 0.4170 0.2704 ( 2642 PWs) bands (ev): -22.3754 -22.3754 -21.8837 -21.8837 -21.6043 -21.6043 -21.2106 -21.2106 -10.6596 -10.6596 -9.5353 -9.5353 -9.4860 -9.4860 -8.9089 -8.9089 -3.9878 -3.9878 -3.3902 -3.3902 -3.3051 -3.3051 -2.6551 -2.6551 -2.4031 -2.4031 -1.9533 -1.9533 -1.8652 -1.8652 -1.8092 -1.8092 -1.3997 -1.3997 -0.9587 -0.9587 -0.7033 -0.7033 -0.4566 -0.4566 3.5854 3.5854 3.7322 3.7322 4.3437 4.3437 4.5283 4.5283 5.3802 5.3802 5.4305 5.4305 5.6783 5.6783 6.0439 6.0439 13.2031 13.2031 k = 0.5823 0.4122 0.2825 ( 2634 PWs) bands (ev): -22.3729 -22.3729 -21.8830 -21.8830 -21.6071 -21.6071 -21.2103 -21.2103 -10.6234 -10.6234 -9.5528 -9.5528 -9.4948 -9.4948 -8.9508 -8.9508 -3.9579 -3.9579 -3.3627 -3.3627 -3.2777 -3.2777 -2.6703 -2.6703 -2.4132 -2.4132 -1.9719 -1.9719 -1.8634 -1.8634 -1.7901 -1.7901 -1.4149 -1.4149 -0.9633 -0.9633 -0.7208 -0.7208 -0.4595 -0.4595 3.6048 3.6048 3.7560 3.7560 4.3543 4.3543 4.5457 4.5457 5.3676 5.3676 5.4064 5.4064 5.6646 5.6646 6.0253 6.0253 13.2503 13.2503 k = 0.5755 0.4073 0.2945 ( 2634 PWs) bands (ev): -22.3706 -22.3706 -21.8823 -21.8823 -21.6098 -21.6098 -21.2100 -21.2100 -10.5865 -10.5865 -9.5708 -9.5708 -9.5029 -9.5029 -8.9915 -8.9915 -3.9295 -3.9295 -3.3338 -3.3338 -3.2506 -3.2506 -2.6870 -2.6870 -2.4272 -2.4272 -1.9886 -1.9886 -1.8609 -1.8609 -1.7720 -1.7720 -1.4283 -1.4283 -0.9673 -0.9673 -0.7376 -0.7376 -0.4622 -0.4622 3.6228 3.6228 3.7784 3.7784 4.3645 4.3645 4.5623 4.5623 5.3555 5.3555 5.3835 5.3835 5.6518 5.6518 6.0073 6.0073 13.2982 13.2982 k = 0.5686 0.4025 0.3066 ( 2632 PWs) bands (ev): -22.3685 -22.3685 -21.8817 -21.8817 -21.6122 -21.6122 -21.2097 -21.2097 -10.5494 -10.5494 -9.5893 -9.5893 -9.5104 -9.5104 -9.0304 -9.0304 -3.9030 -3.9030 -3.3036 -3.3036 -3.2237 -3.2237 -2.7053 -2.7053 -2.4451 -2.4451 -2.0033 -2.0033 -1.8577 -1.8577 -1.7551 -1.7551 -1.4399 -1.4399 -0.9707 -0.9707 -0.7535 -0.7535 -0.4646 -0.4646 3.6395 3.6395 3.7993 3.7993 4.3744 4.3744 4.5781 4.5781 5.3433 5.3433 5.3627 5.3627 5.6399 5.6399 5.9898 5.9898 13.3463 13.3463 k = 0.5618 0.3976 0.3186 ( 2633 PWs) bands (ev): -22.3666 -22.3666 -21.8812 -21.8812 -21.6144 -21.6144 -21.2094 -21.2094 -10.5123 -10.5123 -9.6083 -9.6083 -9.5173 -9.5173 -9.0672 -9.0672 -3.8785 -3.8785 -3.2719 -3.2719 -3.1970 -3.1970 -2.7249 -2.7249 -2.4669 -2.4669 -2.0159 -2.0159 -1.8542 -1.8542 -1.7395 -1.7395 -1.4499 -1.4499 -0.9736 -0.9736 -0.7684 -0.7684 -0.4668 -0.4668 3.6548 3.6548 3.8186 3.8186 4.3837 4.3837 4.5928 4.5928 5.3295 5.3295 5.3456 5.3456 5.6291 5.6291 5.9732 5.9732 13.3944 13.3944 k = 0.5549 0.3927 0.3307 ( 2640 PWs) bands (ev): -22.3650 -22.3650 -21.8808 -21.8808 -21.6165 -21.6165 -21.2091 -21.2091 -10.4756 -10.4756 -9.6278 -9.6278 -9.5235 -9.5235 -9.1013 -9.1013 -3.8564 -3.8564 -3.2390 -3.2390 -3.1704 -3.1704 -2.7457 -2.7457 -2.4921 -2.4921 -2.0265 -2.0265 -1.8504 -1.8504 -1.7251 -1.7251 -1.4584 -1.4584 -0.9760 -0.9760 -0.7822 -0.7822 -0.4688 -0.4688 3.6686 3.6686 3.8362 3.8362 4.3923 4.3923 4.6066 4.6066 5.3133 5.3133 5.3334 5.3334 5.6193 5.6193 5.9576 5.9576 13.4416 13.4416 k = 0.5480 0.3879 0.3427 ( 2640 PWs) bands (ev): -22.3636 -22.3636 -21.8803 -21.8803 -21.6183 -21.6183 -21.2089 -21.2089 -10.4397 -10.4397 -9.6477 -9.6477 -9.5290 -9.5290 -9.1324 -9.1324 -3.8367 -3.8367 -3.2052 -3.2052 -3.1440 -3.1440 -2.7674 -2.7674 -2.5201 -2.5201 -2.0351 -2.0351 -1.8466 -1.8466 -1.7120 -1.7120 -1.4656 -1.4656 -0.9781 -0.9781 -0.7947 -0.7947 -0.4705 -0.4705 3.6809 3.6809 3.8520 3.8520 4.4002 4.4002 4.6192 4.6192 5.2965 5.2965 5.3243 5.3243 5.6107 5.6107 5.9433 5.9433 13.4875 13.4875 k = 0.5412 0.3830 0.3548 ( 2645 PWs) bands (ev): -22.3623 -22.3623 -21.8799 -21.8799 -21.6198 -21.6198 -21.2086 -21.2086 -10.4054 -10.4054 -9.6678 -9.6678 -9.5338 -9.5338 -9.1599 -9.1599 -3.8196 -3.8196 -3.1708 -3.1708 -3.1179 -3.1179 -2.7899 -2.7899 -2.5501 -2.5501 -2.0421 -2.0421 -1.8429 -1.8429 -1.7003 -1.7003 -1.4716 -1.4716 -0.9797 -0.9797 -0.8058 -0.8058 -0.4721 -0.4721 3.6916 3.6916 3.8659 3.8659 4.4072 4.4072 4.6306 4.6306 5.2808 5.2808 5.3169 5.3169 5.6033 5.6033 5.9303 5.9303 13.5310 13.5310 k = 0.5343 0.3782 0.3669 ( 2651 PWs) bands (ev): -22.3613 -22.3613 -21.8796 -21.8796 -21.6211 -21.6211 -21.2084 -21.2084 -10.3733 -10.3733 -9.6875 -9.6875 -9.5379 -9.5379 -9.1837 -9.1837 -3.8050 -3.8050 -3.1367 -3.1367 -3.0922 -3.0922 -2.8128 -2.8128 -2.5811 -2.5811 -2.0476 -2.0476 -1.8395 -1.8395 -1.6901 -1.6901 -1.4766 -1.4766 -0.9811 -0.9811 -0.8154 -0.8154 -0.4734 -0.4734 3.7008 3.7008 3.8779 3.8779 4.4133 4.4133 4.6405 4.6405 5.2668 5.2668 5.3109 5.3109 5.5970 5.5970 5.9189 5.9189 13.5711 13.5711 k = 0.5274 0.3733 0.3789 ( 2647 PWs) bands (ev): -22.3604 -22.3604 -21.8793 -21.8793 -21.6222 -21.6222 -21.2082 -21.2082 -10.3445 -10.3445 -9.7060 -9.7060 -9.5413 -9.5413 -9.2033 -9.2033 -3.7932 -3.7932 -3.1039 -3.1039 -3.0670 -3.0670 -2.8358 -2.8358 -2.6118 -2.6118 -2.0519 -2.0519 -1.8366 -1.8366 -1.6814 -1.6814 -1.4807 -1.4807 -0.9821 -0.9821 -0.8234 -0.8234 -0.4744 -0.4744 3.7083 3.7083 3.8878 3.8878 4.4184 4.4184 4.6490 4.6490 5.2549 5.2549 5.3060 5.3060 5.5919 5.5919 5.9093 5.9093 13.6067 13.6067 k = 0.5206 0.3685 0.3910 ( 2646 PWs) bands (ev): -22.3598 -22.3598 -21.8791 -21.8791 -21.6230 -21.6230 -21.2081 -21.2081 -10.3201 -10.3201 -9.7223 -9.7223 -9.5439 -9.5439 -9.2188 -9.2188 -3.7840 -3.7840 -3.0739 -3.0739 -3.0429 -3.0429 -2.8584 -2.8584 -2.6403 -2.6403 -2.0551 -2.0551 -1.8342 -1.8342 -1.6743 -1.6743 -1.4838 -1.4838 -0.9829 -0.9829 -0.8298 -0.8298 -0.4753 -0.4753 3.7142 3.7142 3.8955 3.8955 4.4225 4.4225 4.6557 4.6557 5.2454 5.2454 5.3022 5.3022 5.5880 5.5880 5.9016 5.9016 13.6362 13.6362 k = 0.5137 0.3636 0.4030 ( 2647 PWs) bands (ev): -22.3593 -22.3593 -21.8790 -21.8790 -21.6236 -21.6236 -21.2080 -21.2080 -10.3013 -10.3013 -9.7354 -9.7354 -9.5458 -9.5458 -9.2298 -9.2298 -3.7774 -3.7774 -3.0490 -3.0490 -3.0208 -3.0208 -2.8793 -2.8793 -2.6643 -2.6643 -2.0574 -2.0574 -1.8324 -1.8324 -1.6691 -1.6691 -1.4862 -1.4862 -0.9834 -0.9834 -0.8343 -0.8343 -0.4759 -0.4759 3.7184 3.7184 3.9011 3.9011 4.4254 4.4254 4.6606 4.6606 5.2384 5.2384 5.2995 5.2995 5.5852 5.5852 5.8960 5.8960 13.6584 13.6584 k = 0.5069 0.3587 0.4151 ( 2647 PWs) bands (ev): -22.3590 -22.3590 -21.8789 -21.8789 -21.6240 -21.6240 -21.2079 -21.2079 -10.2894 -10.2894 -9.7438 -9.7438 -9.5469 -9.5469 -9.2364 -9.2364 -3.7735 -3.7735 -3.0320 -3.0320 -3.0035 -3.0035 -2.8960 -2.8960 -2.6807 -2.6807 -2.0587 -2.0587 -1.8313 -1.8313 -1.6659 -1.6659 -1.4876 -1.4876 -0.9838 -0.9838 -0.8371 -0.8371 -0.4762 -0.4762 3.7209 3.7209 3.9045 3.9045 4.4271 4.4271 4.6636 4.6636 5.2342 5.2342 5.2979 5.2979 5.5836 5.5836 5.8926 5.8926 13.6722 13.6722 k = 0.5000 0.3539 0.4271 ( 2648 PWs) bands (ev): -22.3589 -22.3589 -21.8788 -21.8788 -21.6241 -21.6241 -21.2079 -21.2079 -10.2853 -10.2853 -9.7467 -9.7467 -9.5473 -9.5473 -9.2387 -9.2387 -3.7721 -3.7721 -3.0260 -3.0260 -2.9964 -2.9964 -2.9029 -2.9029 -2.6866 -2.6866 -2.0591 -2.0591 -1.8309 -1.8309 -1.6649 -1.6649 -1.4880 -1.4880 -0.9839 -0.9839 -0.8380 -0.8380 -0.4763 -0.4763 3.7218 3.7218 3.9056 3.9056 4.4277 4.4277 4.6646 4.6646 5.2327 5.2327 5.2974 5.2974 5.5830 5.5830 5.8915 5.8915 13.6769 13.6769 k = 0.5000 0.3539 0.4271 ( 2648 PWs) bands (ev): -22.3589 -22.3589 -21.8788 -21.8788 -21.6241 -21.6241 -21.2079 -21.2079 -10.2853 -10.2853 -9.7467 -9.7467 -9.5473 -9.5473 -9.2387 -9.2387 -3.7721 -3.7721 -3.0260 -3.0260 -2.9964 -2.9964 -2.9029 -2.9029 -2.6866 -2.6866 -2.0591 -2.0591 -1.8309 -1.8309 -1.6649 -1.6649 -1.4880 -1.4880 -0.9839 -0.9839 -0.8380 -0.8380 -0.4763 -0.4763 3.7218 3.7218 3.9056 3.9056 4.4277 4.4277 4.6646 4.6646 5.2327 5.2327 5.2974 5.2974 5.5830 5.5830 5.8915 5.8915 13.6769 13.6769 k = 0.5086 0.3417 0.4271 ( 2650 PWs) bands (ev): -22.3588 -22.3588 -21.8796 -21.8796 -21.6240 -21.6240 -21.2075 -21.2075 -10.2859 -10.2859 -9.7464 -9.7464 -9.5522 -9.5522 -9.2330 -9.2330 -3.7718 -3.7718 -3.0284 -3.0284 -2.9979 -2.9979 -2.9036 -2.9036 -2.6855 -2.6855 -2.0568 -2.0568 -1.8315 -1.8315 -1.6651 -1.6651 -1.4872 -1.4872 -0.9926 -0.9926 -0.8285 -0.8285 -0.4762 -0.4762 3.7174 3.7174 3.9106 3.9106 4.4244 4.4244 4.6641 4.6641 5.2272 5.2272 5.3001 5.3001 5.5885 5.5885 5.8921 5.8921 13.6753 13.6753 k = 0.5172 0.3296 0.4271 ( 2650 PWs) bands (ev): -22.3582 -22.3582 -21.8817 -21.8817 -21.6235 -21.6235 -21.2062 -21.2062 -10.2876 -10.2876 -9.7455 -9.7455 -9.5659 -9.5659 -9.2170 -9.2170 -3.7706 -3.7706 -3.0362 -3.0362 -3.0018 -3.0018 -2.9054 -2.9054 -2.6824 -2.6824 -2.0500 -2.0500 -1.8333 -1.8333 -1.6659 -1.6659 -1.4845 -1.4845 -1.0138 -1.0138 -0.8047 -0.8047 -0.4758 -0.4758 3.7057 3.7057 3.9242 3.9242 4.4145 4.4145 4.6624 4.6624 5.2117 5.2117 5.3082 5.3082 5.6037 5.6037 5.8939 5.8939 13.6703 13.6703 k = 0.5258 0.3174 0.4271 ( 2646 PWs) bands (ev): -22.3572 -22.3572 -21.8852 -21.8852 -21.6228 -21.6228 -21.2041 -21.2041 -10.2905 -10.2905 -9.7440 -9.7440 -9.5859 -9.5859 -9.1932 -9.1932 -3.7688 -3.7688 -3.0501 -3.0501 -3.0067 -3.0067 -2.9086 -2.9086 -2.6772 -2.6772 -2.0393 -2.0393 -1.8362 -1.8362 -1.6673 -1.6673 -1.4799 -1.4799 -1.0406 -1.0406 -0.7737 -0.7737 -0.4751 -0.4751 3.6892 3.6892 3.9437 3.9437 4.3986 4.3986 4.6594 4.6594 5.1888 5.1888 5.3212 5.3212 5.6267 5.6267 5.8971 5.8971 13.6622 13.6622 k = 0.5344 0.3052 0.4271 ( 2642 PWs) bands (ev): -22.3559 -22.3559 -21.8900 -21.8900 -21.6218 -21.6218 -21.2012 -21.2012 -10.2949 -10.2949 -9.7420 -9.7420 -9.6097 -9.6097 -9.1637 -9.1637 -3.7661 -3.7661 -3.0702 -3.0702 -3.0122 -3.0122 -2.9131 -2.9131 -2.6700 -2.6700 -2.0255 -2.0255 -1.8402 -1.8402 -1.6692 -1.6692 -1.4732 -1.4732 -1.0691 -1.0691 -0.7393 -0.7393 -0.4742 -0.4742 3.6702 3.6702 3.9667 3.9667 4.3774 4.3774 4.6548 4.6548 5.1610 5.1610 5.3387 5.3387 5.6548 5.6548 5.9014 5.9014 13.6508 13.6508 k = 0.5430 0.2931 0.4271 ( 2642 PWs) bands (ev): -22.3542 -22.3542 -21.8961 -21.8961 -21.6205 -21.6205 -21.1976 -21.1976 -10.3006 -10.3006 -9.7393 -9.7393 -9.6354 -9.6354 -9.1307 -9.1307 -3.7628 -3.7628 -3.0957 -3.0957 -3.0182 -3.0182 -2.9190 -2.9190 -2.6608 -2.6608 -2.0095 -2.0095 -1.8453 -1.8453 -1.6717 -1.6717 -1.4640 -1.4640 -1.0974 -1.0974 -0.7032 -0.7032 -0.4729 -0.4729 3.6501 3.6501 3.9913 3.9913 4.3517 4.3517 4.6484 4.6484 5.1306 5.1306 5.3600 5.3600 5.6862 5.6862 5.9068 5.9068 13.6363 13.6363 k = 0.5516 0.2809 0.4271 ( 2644 PWs) bands (ev): -22.3522 -22.3522 -21.9033 -21.9033 -21.6189 -21.6189 -21.1933 -21.1933 -10.3081 -10.3081 -9.7361 -9.7361 -9.6614 -9.6614 -9.0952 -9.0952 -3.7586 -3.7586 -3.1257 -3.1257 -3.0250 -3.0250 -2.9262 -2.9262 -2.6499 -2.6499 -1.9925 -1.9925 -1.8513 -1.8513 -1.6748 -1.6748 -1.4521 -1.4521 -1.1245 -1.1245 -0.6663 -0.6663 -0.4713 -0.4713 3.6298 3.6298 4.0164 4.0164 4.3223 4.3223 4.6401 4.6401 5.0991 5.0991 5.3848 5.3848 5.7197 5.7197 5.9133 5.9133 13.6189 13.6189 k = 0.5603 0.2687 0.4271 ( 2644 PWs) bands (ev): -22.3498 -22.3498 -21.9117 -21.9117 -21.6171 -21.6171 -21.1884 -21.1884 -10.3174 -10.3174 -9.7323 -9.7323 -9.6868 -9.6868 -9.0581 -9.0581 -3.7538 -3.7538 -3.1592 -3.1592 -3.0328 -3.0328 -2.9350 -2.9350 -2.6373 -2.6373 -1.9754 -1.9754 -1.8583 -1.8583 -1.6785 -1.6785 -1.4372 -1.4372 -1.1499 -1.1499 -0.6292 -0.6292 -0.4695 -0.4695 3.6101 3.6101 4.0408 4.0408 4.2897 4.2897 4.6299 4.6299 5.0680 5.0680 5.4124 5.4124 5.7542 5.7542 5.9209 5.9209 13.5988 13.5988 k = 0.5689 0.2566 0.4271 ( 2644 PWs) bands (ev): -22.3472 -22.3472 -21.9209 -21.9209 -21.6149 -21.6149 -21.1830 -21.1830 -10.3288 -10.3288 -9.7279 -9.7279 -9.7108 -9.7108 -9.0202 -9.0202 -3.7482 -3.7482 -3.1957 -3.1957 -3.0415 -3.0415 -2.9451 -2.9451 -2.6231 -2.6231 -1.9591 -1.9591 -1.8660 -1.8660 -1.6828 -1.6828 -1.4188 -1.4188 -1.1731 -1.1731 -0.5922 -0.5922 -0.4672 -0.4672 3.5911 3.5911 4.0636 4.0636 4.2546 4.2546 4.6178 4.6178 5.0386 5.0386 5.4424 5.4424 5.7891 5.7891 5.9294 5.9294 13.5760 13.5760 k = 0.5775 0.2444 0.4271 ( 2646 PWs) bands (ev): -22.3443 -22.3443 -21.9311 -21.9311 -21.6125 -21.6125 -21.1772 -21.1772 -10.3424 -10.3424 -9.7328 -9.7328 -9.7230 -9.7230 -8.9816 -8.9816 -3.7420 -3.7420 -3.2344 -3.2344 -3.0513 -3.0513 -2.9568 -2.9568 -2.6077 -2.6077 -1.9445 -1.9445 -1.8742 -1.8742 -1.6877 -1.6877 -1.3970 -1.3970 -1.1938 -1.1938 -0.5556 -0.5556 -0.4647 -0.4647 3.5732 3.5732 4.0838 4.0838 4.2174 4.2174 4.6038 4.6038 5.0120 5.0120 5.4742 5.4742 5.8241 5.8241 5.9388 5.9388 13.5509 13.5509 k = 0.5861 0.2323 0.4271 ( 2646 PWs) bands (ev): -22.3411 -22.3411 -21.9420 -21.9420 -21.6099 -21.6099 -21.1711 -21.1711 -10.3584 -10.3584 -9.7522 -9.7522 -9.7176 -9.7176 -8.9429 -8.9429 -3.7351 -3.7351 -3.2748 -3.2748 -3.0623 -3.0623 -2.9699 -2.9699 -2.5911 -2.5911 -1.9322 -1.9322 -1.8828 -1.8828 -1.6932 -1.6932 -1.3714 -1.3714 -1.2118 -1.2118 -0.5194 -0.5194 -0.4617 -0.4617 3.5565 3.5565 4.1004 4.1004 4.1785 4.1785 4.5882 4.5882 4.9893 4.9893 5.5076 5.5076 5.8587 5.8587 5.9491 5.9491 13.5238 13.5238 k = 0.5947 0.2201 0.4271 ( 2642 PWs) bands (ev): -22.3378 -22.3378 -21.9535 -21.9535 -21.6070 -21.6070 -21.1646 -21.1646 -10.3769 -10.3769 -9.7690 -9.7690 -9.7116 -9.7116 -8.9041 -8.9041 -3.7276 -3.7276 -3.3165 -3.3165 -3.0744 -3.0744 -2.9845 -2.9845 -2.5739 -2.5739 -1.9223 -1.9223 -1.8913 -1.8913 -1.6992 -1.6992 -1.3424 -1.3424 -1.2271 -1.2271 -0.4841 -0.4841 -0.4583 -0.4583 3.5411 3.5411 4.1124 4.1124 4.1383 4.1383 4.5709 4.5709 4.9716 4.9716 5.5422 5.5422 5.8929 5.8929 5.9601 5.9601 13.4948 13.4948 k = 0.6033 0.2079 0.4271 ( 2642 PWs) bands (ev): -22.3344 -22.3344 -21.9654 -21.9654 -21.6038 -21.6038 -21.1580 -21.1580 -10.3978 -10.3978 -9.7828 -9.7828 -9.7051 -9.7051 -8.8656 -8.8656 -3.7196 -3.7196 -3.3591 -3.3591 -3.0877 -3.0877 -3.0004 -3.0004 -2.5561 -2.5561 -1.9154 -1.9154 -1.8993 -1.8993 -1.7056 -1.7056 -1.3101 -1.3101 -1.2395 -1.2395 -0.4556 -0.4556 -0.4483 -0.4483 3.5271 3.5271 4.0970 4.0970 4.1190 4.1190 4.5522 4.5522 4.9599 4.9599 5.5775 5.5775 5.9264 5.9264 5.9719 5.9719 13.4643 13.4643 k = 0.6119 0.1958 0.4271 ( 2636 PWs) bands (ev): -22.3309 -22.3309 -21.9776 -21.9776 -21.6004 -21.6004 -21.1512 -21.1512 -10.4211 -10.4211 -9.7937 -9.7937 -9.6982 -9.6982 -8.8273 -8.8273 -3.7113 -3.7113 -3.4022 -3.4022 -3.1021 -3.1021 -3.0177 -3.0177 -2.5382 -2.5382 -1.9120 -1.9120 -1.9055 -1.9055 -1.7124 -1.7124 -1.2756 -1.2756 -1.2482 -1.2482 -0.4508 -0.4508 -0.4152 -0.4152 3.5146 3.5146 4.0549 4.0549 4.1194 4.1194 4.5322 4.5322 4.9550 4.9550 5.6135 5.6135 5.9590 5.9590 5.9842 5.9842 13.4325 13.4325 k = 0.6205 0.1836 0.4271 ( 2638 PWs) bands (ev): -22.3274 -22.3274 -21.9900 -21.9900 -21.5968 -21.5968 -21.1443 -21.1443 -10.4466 -10.4466 -9.8016 -9.8016 -9.6907 -9.6907 -8.7895 -8.7895 -3.7027 -3.7027 -3.4457 -3.4457 -3.1178 -3.1178 -3.0360 -3.0360 -2.5206 -2.5206 -1.9152 -1.9152 -1.9067 -1.9067 -1.7194 -1.7194 -1.2591 -1.2591 -1.2335 -1.2335 -0.4461 -0.4461 -0.3825 -0.3825 3.5034 3.5034 4.0122 4.0122 4.1134 4.1134 4.5111 4.5111 4.9572 4.9572 5.6499 5.6499 5.9907 5.9907 5.9972 5.9972 13.3995 13.3995 k = 0.6291 0.1715 0.4271 ( 2638 PWs) bands (ev): -22.3241 -22.3241 -22.0024 -22.0024 -21.5929 -21.5929 -21.1375 -21.1375 -10.4741 -10.4741 -9.8068 -9.8068 -9.6828 -9.6828 -8.7523 -8.7523 -3.6942 -3.6942 -3.4893 -3.4893 -3.1347 -3.1347 -3.0553 -3.0553 -2.5036 -2.5036 -1.9198 -1.9198 -1.9071 -1.9071 -1.7266 -1.7266 -1.2623 -1.2623 -1.1942 -1.1942 -0.4411 -0.4411 -0.3507 -0.3507 3.4938 3.4938 3.9690 3.9690 4.1009 4.1009 4.4888 4.4888 4.9665 4.9665 5.6865 5.6865 6.0104 6.0104 6.0215 6.0215 13.3656 13.3656 k = 0.6377 0.1593 0.4271 ( 2638 PWs) bands (ev): -22.3210 -22.3210 -22.0146 -22.0146 -21.5889 -21.5889 -21.1307 -21.1307 -10.5034 -10.5034 -9.8093 -9.8093 -9.6744 -9.6744 -8.7157 -8.7157 -3.6859 -3.6859 -3.5328 -3.5328 -3.1527 -3.1527 -3.0751 -3.0751 -2.4876 -2.4876 -1.9228 -1.9228 -1.9092 -1.9092 -1.7339 -1.7339 -1.2640 -1.2640 -1.1520 -1.1520 -0.4356 -0.4356 -0.3202 -0.3202 3.4855 3.4855 3.9255 3.9255 4.0824 4.0824 4.4656 4.4656 4.9828 4.9828 5.7231 5.7231 6.0243 6.0243 6.0511 6.0511 13.3310 13.3310 k = 0.6463 0.1471 0.4271 ( 2640 PWs) bands (ev): -22.3183 -22.3183 -22.0264 -22.0264 -21.5847 -21.5847 -21.1241 -21.1241 -10.5342 -10.5342 -9.8094 -9.8094 -9.6657 -9.6657 -8.6798 -8.6798 -3.6783 -3.6783 -3.5759 -3.5759 -3.1719 -3.1719 -3.0951 -3.0951 -2.4731 -2.4731 -1.9238 -1.9238 -1.9127 -1.9127 -1.7412 -1.7412 -1.2634 -1.2634 -1.1083 -1.1083 -0.4297 -0.4297 -0.2908 -0.2908 3.4787 3.4787 3.8818 3.8818 4.0586 4.0586 4.4416 4.4416 5.0052 5.0052 5.7595 5.7595 6.0385 6.0385 6.0795 6.0795 13.2958 13.2958 k = 0.6549 0.1350 0.4271 ( 2640 PWs) bands (ev): -22.3162 -22.3162 -22.0376 -22.0376 -21.5802 -21.5802 -21.1176 -21.1176 -10.5662 -10.5662 -9.8074 -9.8074 -9.6565 -9.6565 -8.6447 -8.6447 -3.6719 -3.6719 -3.6187 -3.6187 -3.1923 -3.1923 -3.1148 -3.1148 -2.4601 -2.4601 -1.9230 -1.9230 -1.9170 -1.9170 -1.7486 -1.7486 -1.2603 -1.2603 -1.0633 -1.0633 -0.4234 -0.4234 -0.2626 -0.2626 3.4731 3.4731 3.8380 3.8380 4.0304 4.0304 4.4169 4.4169 5.0331 5.0331 5.7958 5.7958 6.0530 6.0530 6.1068 6.1068 13.2602 13.2602 k = 0.6636 0.1228 0.4271 ( 2644 PWs) bands (ev): -22.3147 -22.3147 -22.0480 -22.0480 -21.5756 -21.5756 -21.1113 -21.1113 -10.5992 -10.5992 -9.8034 -9.8034 -9.6470 -9.6470 -8.6104 -8.6104 -3.6677 -3.6677 -3.6603 -3.6603 -3.2139 -3.2139 -3.1336 -3.1336 -2.4491 -2.4491 -1.9256 -1.9256 -1.9165 -1.9165 -1.7559 -1.7559 -1.2549 -1.2549 -1.0176 -1.0176 -0.4166 -0.4166 -0.2357 -0.2357 3.4687 3.4687 3.7943 3.7943 3.9985 3.9985 4.3916 4.3916 5.0656 5.0656 5.8318 5.8318 6.0678 6.0678 6.1329 6.1329 13.2243 13.2243 k = 0.6722 0.1106 0.4271 ( 2642 PWs) bands (ev): -22.3142 -22.3142 -22.0573 -22.0573 -21.5709 -21.5709 -21.1052 -21.1052 -10.6328 -10.6328 -9.7976 -9.7976 -9.6371 -9.6371 -8.5770 -8.5770 -3.7027 -3.7027 -3.6643 -3.6643 -3.2366 -3.2366 -3.1506 -3.1506 -2.4401 -2.4401 -1.9324 -1.9324 -1.9102 -1.9102 -1.7631 -1.7631 -1.2471 -1.2471 -0.9713 -0.9713 -0.4093 -0.4093 -0.2101 -0.2101 3.4654 3.4654 3.7507 3.7507 3.9642 3.9642 4.3658 4.3658 5.1019 5.1019 5.8673 5.8673 6.0828 6.0828 6.1578 6.1578 13.1882 13.1882 k = 0.6808 0.0985 0.4271 ( 2646 PWs) bands (ev): -22.3149 -22.3149 -22.0652 -22.0652 -21.5660 -21.5660 -21.0994 -21.0994 -10.6670 -10.6670 -9.7903 -9.7903 -9.6269 -9.6269 -8.5446 -8.5446 -3.7434 -3.7434 -3.6648 -3.6648 -3.2603 -3.2603 -3.1651 -3.1651 -2.4331 -2.4331 -1.9405 -1.9405 -1.9012 -1.9012 -1.7702 -1.7702 -1.2368 -1.2368 -0.9248 -0.9248 -0.4016 -0.4016 -0.1860 -0.1860 3.4629 3.4629 3.7073 3.7073 3.9281 3.9281 4.3397 4.3397 5.1414 5.1414 5.9023 5.9023 6.0981 6.0981 6.1814 6.1814 13.1521 13.1521 k = 0.6894 0.0863 0.4271 ( 2646 PWs) bands (ev): -22.3168 -22.3168 -22.0717 -22.0717 -21.5609 -21.5609 -21.0939 -21.0939 -10.7015 -10.7015 -9.7816 -9.7816 -9.6163 -9.6163 -8.5132 -8.5132 -3.7834 -3.7834 -3.6691 -3.6691 -3.2852 -3.2852 -3.1762 -3.1762 -2.4280 -2.4280 -1.9493 -1.9493 -1.8900 -1.8900 -1.7771 -1.7771 -1.2242 -1.2242 -0.8782 -0.8782 -0.3935 -0.3935 -0.1632 -0.1632 3.4608 3.4608 3.6642 3.6642 3.8912 3.8912 4.3132 4.3132 5.1836 5.1836 5.9368 5.9368 6.1135 6.1135 6.2037 6.2037 13.1160 13.1160 k = 0.6980 0.0742 0.4271 ( 2646 PWs) bands (ev): -22.3201 -22.3201 -22.0764 -22.0764 -21.5558 -21.5558 -21.0886 -21.0886 -10.7362 -10.7362 -9.7716 -9.7716 -9.6056 -9.6056 -8.4828 -8.4828 -3.8223 -3.8223 -3.6776 -3.6776 -3.3110 -3.3110 -3.1833 -3.1833 -2.4246 -2.4246 -1.9586 -1.9586 -1.8771 -1.8771 -1.7838 -1.7838 -1.2090 -1.2090 -0.8318 -0.8318 -0.3849 -0.3849 -0.1418 -0.1418 3.4588 3.4588 3.6215 3.6215 3.8544 3.8544 4.2865 4.2865 5.2277 5.2277 5.9706 5.9706 6.1290 6.1290 6.2248 6.2248 13.0800 13.0800 k = 0.7066 0.0620 0.4271 ( 2650 PWs) bands (ev): -22.3249 -22.3249 -22.0795 -22.0795 -21.5505 -21.5505 -21.0838 -21.0838 -10.7708 -10.7708 -9.7605 -9.7605 -9.5946 -9.5946 -8.4534 -8.4534 -3.8603 -3.8603 -3.6907 -3.6907 -3.3379 -3.3379 -3.1859 -3.1859 -2.4227 -2.4227 -1.9684 -1.9684 -1.8630 -1.8630 -1.7903 -1.7903 -1.1914 -1.1914 -0.7857 -0.7857 -0.3760 -0.3760 -0.1218 -0.1218 3.4562 3.4562 3.5792 3.5792 3.8187 3.8187 4.2597 4.2597 5.2735 5.2735 6.0037 6.0037 6.1445 6.1445 6.2446 6.2446 13.0442 13.0442 k = 0.7152 0.0498 0.4271 ( 2648 PWs) bands (ev): -22.3312 -22.3312 -22.0807 -22.0807 -21.5452 -21.5452 -21.0792 -21.0792 -10.8053 -10.8053 -9.7485 -9.7485 -9.5833 -9.5833 -8.4251 -8.4251 -3.8973 -3.8973 -3.7085 -3.7085 -3.3657 -3.3657 -3.1838 -3.1838 -2.4221 -2.4221 -1.9786 -1.9786 -1.8482 -1.8482 -1.7965 -1.7965 -1.1712 -1.1712 -0.7401 -0.7401 -0.3666 -0.3666 -0.1033 -0.1033 3.4521 3.4521 3.5374 3.5374 3.7853 3.7853 4.2329 4.2329 5.3206 5.3206 6.0360 6.0360 6.1602 6.1602 6.2632 6.2632 13.0087 13.0087 k = 0.7238 0.0377 0.4271 ( 2648 PWs) bands (ev): -22.3388 -22.3388 -22.0802 -22.0802 -21.5398 -21.5398 -21.0750 -21.0750 -10.8395 -10.8395 -9.7356 -9.7356 -9.5719 -9.5719 -8.3979 -8.3979 -3.9330 -3.9330 -3.7307 -3.7307 -3.3943 -3.3943 -3.1772 -3.1772 -2.4225 -2.4225 -1.9890 -1.9890 -1.8331 -1.8331 -1.8024 -1.8024 -1.1485 -1.1485 -0.6951 -0.6951 -0.3570 -0.3570 -0.0862 -0.0862 3.4456 3.4456 3.4962 3.4962 3.7554 3.7554 4.2061 4.2061 5.3686 5.3686 6.0676 6.0676 6.1758 6.1758 6.2804 6.2804 12.9736 12.9736 k = 0.7324 0.0255 0.4271 ( 2648 PWs) bands (ev): -22.3477 -22.3477 -22.0782 -22.0782 -21.5343 -21.5343 -21.0712 -21.0712 -10.8733 -10.8733 -9.7220 -9.7220 -9.5604 -9.5604 -8.3719 -8.3719 -3.9676 -3.9676 -3.7567 -3.7567 -3.4238 -3.4238 -3.1663 -3.1663 -2.4237 -2.4237 -1.9995 -1.9995 -1.8190 -1.8190 -1.8071 -1.8071 -1.1234 -1.1234 -0.6508 -0.6508 -0.3469 -0.3469 -0.0706 -0.0706 3.4353 3.4353 3.4557 3.4557 3.7306 3.7306 4.1795 4.1795 5.4173 5.4173 6.0983 6.0983 6.1915 6.1915 6.2964 6.2964 12.9388 12.9388 k = 0.7410 0.0133 0.4271 ( 2642 PWs) bands (ev): -22.3576 -22.3576 -22.0747 -22.0747 -21.5288 -21.5288 -21.0678 -21.0678 -10.9067 -10.9067 -9.7077 -9.7077 -9.5487 -9.5487 -8.3469 -8.3469 -4.0010 -4.0010 -3.7860 -3.7860 -3.4540 -3.4540 -3.1519 -3.1519 -2.4255 -2.4255 -2.0101 -2.0101 -1.8156 -1.8156 -1.8012 -1.8012 -1.0958 -1.0958 -0.6074 -0.6074 -0.3366 -0.3366 -0.0564 -0.0564 3.4155 3.4155 3.4208 3.4208 3.7119 3.7119 4.1530 4.1530 5.4664 5.4664 6.1282 6.1282 6.2071 6.2071 6.3112 6.3112 12.9046 12.9046 k = 0.2590-0.3659 0.7286 ( 2642 PWs) bands (ev): -22.3576 -22.3576 -22.0747 -22.0747 -21.5288 -21.5288 -21.0678 -21.0678 -10.9067 -10.9067 -9.7077 -9.7077 -9.5487 -9.5487 -8.3469 -8.3469 -4.0010 -4.0010 -3.7860 -3.7860 -3.4540 -3.4540 -3.1519 -3.1519 -2.4255 -2.4255 -2.0101 -2.0101 -1.8156 -1.8156 -1.8012 -1.8012 -1.0958 -1.0958 -0.6074 -0.6074 -0.3366 -0.3366 -0.0564 -0.0564 3.4155 3.4155 3.4208 3.4208 3.7119 3.7119 4.1530 4.1530 5.4664 5.4664 6.1282 6.1282 6.2071 6.2071 6.3112 6.3112 12.9046 12.9046 k = 0.2503-0.3537 0.7286 ( 2638 PWs) bands (ev): -22.3684 -22.3684 -22.0700 -22.0700 -21.5233 -21.5233 -21.0647 -21.0647 -10.9396 -10.9396 -9.6928 -9.6928 -9.5369 -9.5369 -8.3231 -8.3231 -4.0331 -4.0331 -3.8181 -3.8181 -3.4850 -3.4850 -3.1342 -3.1342 -2.4278 -2.4278 -2.0207 -2.0207 -1.8201 -1.8201 -1.7877 -1.7877 -1.0659 -1.0659 -0.5648 -0.5648 -0.3259 -0.3259 -0.0437 -0.0437 3.3764 3.3764 3.4003 3.4003 3.7000 3.7000 4.1268 4.1268 5.5158 5.5158 6.1572 6.1572 6.2227 6.2227 6.3247 6.3247 12.8707 12.8707 k = 0.2417-0.3415 0.7286 ( 2640 PWs) bands (ev): -22.3798 -22.3798 -22.0642 -22.0642 -21.5177 -21.5177 -21.0619 -21.0619 -10.9718 -10.9718 -9.6775 -9.6775 -9.5251 -9.5251 -8.3003 -8.3003 -4.0639 -4.0639 -3.8522 -3.8522 -3.5166 -3.5166 -3.1140 -3.1140 -2.4305 -2.4305 -2.0313 -2.0313 -1.8248 -1.8248 -1.7744 -1.7744 -1.0339 -1.0339 -0.5233 -0.5233 -0.3149 -0.3149 -0.0324 -0.0324 3.3380 3.3380 3.3751 3.3751 3.6947 3.6947 4.1008 4.1008 5.5652 5.5652 6.1852 6.1852 6.2382 6.2382 6.3371 6.3371 12.8375 12.8375 k = 0.2331-0.3293 0.7286 ( 2632 PWs) bands (ev): -22.3918 -22.3918 -22.0575 -22.0575 -21.5121 -21.5121 -21.0596 -21.0596 -11.0034 -11.0034 -9.6618 -9.6618 -9.5133 -9.5133 -8.2788 -8.2788 -4.0933 -4.0933 -3.8879 -3.8879 -3.5486 -3.5486 -3.0916 -3.0916 -2.4333 -2.4333 -2.0419 -2.0419 -1.8293 -1.8293 -1.7620 -1.7620 -1.0000 -1.0000 -0.4829 -0.4829 -0.3036 -0.3036 -0.0225 -0.0225 3.3004 3.3004 3.3459 3.3459 3.6952 3.6952 4.0753 4.0753 5.6144 5.6144 6.2123 6.2123 6.2536 6.2536 6.3483 6.3483 12.8048 12.8048 k = 0.2244-0.3171 0.7286 ( 2634 PWs) bands (ev): -22.4041 -22.4041 -22.0502 -22.0502 -21.5066 -21.5066 -21.0576 -21.0576 -11.0342 -11.0342 -9.6457 -9.6457 -9.5015 -9.5015 -8.2583 -8.2583 -4.1213 -4.1213 -3.9245 -3.9245 -3.5811 -3.5811 -3.0676 -3.0676 -2.4363 -2.4363 -2.0523 -2.0523 -1.8334 -1.8334 -1.7505 -1.7505 -0.9644 -0.9644 -0.4439 -0.4439 -0.2921 -0.2921 -0.0140 -0.0140 3.2637 3.2637 3.3136 3.3136 3.7005 3.7005 4.0502 4.0502 5.6632 5.6632 6.2382 6.2382 6.2690 6.2690 6.3583 6.3583 12.7729 12.7729 k = 0.2158-0.3049 0.7286 ( 2636 PWs) bands (ev): -22.4165 -22.4165 -22.0423 -22.0423 -21.5011 -21.5011 -21.0560 -21.0560 -11.0642 -11.0642 -9.6295 -9.6295 -9.4897 -9.4897 -8.2390 -8.2390 -4.1478 -4.1478 -3.9618 -3.9618 -3.6139 -3.6139 -3.0422 -3.0422 -2.4394 -2.4394 -2.0625 -2.0625 -1.8371 -1.8371 -1.7400 -1.7400 -0.9274 -0.9274 -0.4063 -0.4063 -0.2802 -0.2802 -0.0070 -0.0070 3.2279 3.2279 3.2795 3.2795 3.7095 3.7095 4.0256 4.0256 5.7116 5.7116 6.2630 6.2630 6.2843 6.2843 6.3673 6.3673 12.7416 12.7416 k = 0.2072-0.2927 0.7286 ( 2638 PWs) bands (ev): -22.4291 -22.4291 -22.0339 -22.0339 -21.4957 -21.4957 -21.0547 -21.0547 -11.0933 -11.0933 -9.6130 -9.6130 -9.4780 -9.4780 -8.2209 -8.2209 -4.1729 -4.1729 -3.9994 -3.9994 -3.6470 -3.6470 -3.0158 -3.0158 -2.4425 -2.4425 -2.0726 -2.0726 -1.8403 -1.8403 -1.7304 -1.7304 -0.8892 -0.8892 -0.3703 -0.3703 -0.2680 -0.2680 -0.0013 -0.0013 3.1931 3.1931 3.2443 3.2443 3.7213 3.7213 4.0017 4.0017 5.7592 5.7592 6.2864 6.2864 6.2997 6.2997 6.3751 6.3751 12.7112 12.7112 k = 0.1985-0.2805 0.7286 ( 2636 PWs) bands (ev): -22.4416 -22.4416 -22.0251 -22.0251 -21.4903 -21.4903 -21.0537 -21.0537 -11.1215 -11.1215 -9.5965 -9.5965 -9.4665 -9.4665 -8.2038 -8.2038 -4.1964 -4.1964 -4.0370 -4.0370 -3.6802 -3.6802 -2.9887 -2.9887 -2.4456 -2.4456 -2.0824 -2.0824 -1.8431 -1.8431 -1.7218 -1.7218 -0.8502 -0.8502 -0.3361 -0.3361 -0.2552 -0.2552 0.0031 0.0031 3.1594 3.1594 3.2086 3.2086 3.7354 3.7354 3.9783 3.9783 5.8061 5.8061 6.3073 6.3073 6.3164 6.3164 6.3820 6.3820 12.6815 12.6815 k = 0.1899-0.2683 0.7286 ( 2636 PWs) bands (ev): -22.4540 -22.4540 -22.0161 -22.0161 -21.4851 -21.4851 -21.0531 -21.0531 -11.1488 -11.1488 -9.5800 -9.5800 -9.4551 -9.4551 -8.1879 -8.1879 -4.2184 -4.2184 -4.0743 -4.0743 -3.7134 -3.7134 -2.9612 -2.9612 -2.4487 -2.4487 -2.0920 -2.0920 -1.8454 -1.8454 -1.7141 -1.7141 -0.8105 -0.8105 -0.3044 -0.3044 -0.2413 -0.2413 0.0063 0.0063 3.1268 3.1268 3.1730 3.1730 3.7511 3.7511 3.9557 3.9557 5.8519 5.8519 6.3244 6.3244 6.3355 6.3355 6.3879 6.3879 12.6528 12.6528 k = 0.1813-0.2561 0.7286 ( 2640 PWs) bands (ev): -22.4662 -22.4662 -22.0070 -22.0070 -21.4799 -21.4799 -21.0527 -21.0527 -11.1751 -11.1751 -9.5636 -9.5636 -9.4439 -9.4439 -8.1730 -8.1730 -4.2389 -4.2389 -4.1111 -4.1111 -3.7466 -3.7466 -2.9335 -2.9335 -2.4517 -2.4517 -2.1014 -2.1014 -1.8471 -1.8471 -1.7072 -1.7072 -0.7704 -0.7704 -0.2760 -0.2760 -0.2255 -0.2255 0.0081 0.0081 3.0953 3.0953 3.1378 3.1378 3.7681 3.7681 3.9338 3.9338 5.8966 5.8966 6.3393 6.3393 6.3554 6.3554 6.3929 6.3929 12.6249 12.6249 k = 0.1726-0.2439 0.7286 ( 2640 PWs) bands (ev): -22.4782 -22.4782 -21.9977 -21.9977 -21.4749 -21.4749 -21.0526 -21.0526 -11.2003 -11.2003 -9.5473 -9.5473 -9.4330 -9.4330 -8.1591 -8.1591 -4.2577 -4.2577 -4.1472 -4.1472 -3.7797 -3.7797 -2.9058 -2.9058 -2.4546 -2.4546 -2.1104 -2.1104 -1.8483 -1.8483 -1.7011 -1.7011 -0.7303 -0.7303 -0.2523 -0.2523 -0.2066 -0.2066 0.0089 0.0089 3.0650 3.0650 3.1034 3.1034 3.7859 3.7859 3.9129 3.9129 5.9401 5.9401 6.3533 6.3533 6.3746 6.3746 6.3973 6.3973 12.5980 12.5980 k = 0.1640-0.2317 0.7286 ( 2636 PWs) bands (ev): -22.4898 -22.4898 -21.9884 -21.9884 -21.4700 -21.4700 -21.0528 -21.0528 -11.2245 -11.2245 -9.5312 -9.5312 -9.4223 -9.4223 -8.1463 -8.1463 -4.2750 -4.2750 -4.1823 -4.1823 -3.8125 -3.8125 -2.8784 -2.8784 -2.4574 -2.4574 -2.1192 -2.1192 -1.8488 -1.8488 -1.6956 -1.6956 -0.6903 -0.6903 -0.2336 -0.2336 -0.1843 -0.1843 0.0085 0.0085 3.0359 3.0359 3.0698 3.0698 3.8042 3.8042 3.8930 3.8930 5.9821 5.9821 6.3667 6.3667 6.3925 6.3925 6.4015 6.4015 12.5720 12.5720 k = 0.1554-0.2195 0.7286 ( 2630 PWs) bands (ev): -22.5010 -22.5010 -21.9792 -21.9792 -21.4652 -21.4652 -21.0532 -21.0532 -11.2476 -11.2476 -9.5153 -9.5153 -9.4120 -9.4120 -8.1345 -8.1345 -4.2907 -4.2907 -4.2165 -4.2165 -3.8451 -3.8451 -2.8514 -2.8514 -2.4602 -2.4602 -2.1276 -2.1276 -1.8488 -1.8488 -1.6908 -1.6908 -0.6506 -0.6506 -0.2185 -0.2185 -0.1601 -0.1601 0.0070 0.0070 3.0080 3.0080 3.0374 3.0374 3.8222 3.8222 3.8748 3.8748 6.0226 6.0226 6.3797 6.3797 6.4022 6.4022 6.4122 6.4122 12.5471 12.5471 k = 0.1468-0.2073 0.7286 ( 2628 PWs) bands (ev): -22.5119 -22.5119 -21.9701 -21.9701 -21.4606 -21.4606 -21.0538 -21.0538 -11.2696 -11.2696 -9.4998 -9.4998 -9.4019 -9.4019 -8.1236 -8.1236 -4.3047 -4.3047 -4.2495 -4.2495 -3.8772 -3.8772 -2.8250 -2.8250 -2.4628 -2.4628 -2.1357 -2.1357 -1.8481 -1.8481 -1.6866 -1.6866 -0.6116 -0.6116 -0.2056 -0.2056 -0.1354 -0.1354 0.0045 0.0045 2.9815 2.9815 3.0062 3.0062 3.8353 3.8353 3.8625 3.8625 6.0614 6.0614 6.3920 6.3920 6.4053 6.4053 6.4282 6.4282 12.5233 12.5233 k = 0.1381-0.1951 0.7286 ( 2624 PWs) bands (ev): -22.5222 -22.5222 -21.9612 -21.9612 -21.4562 -21.4562 -21.0546 -21.0546 -11.2905 -11.2905 -9.4848 -9.4848 -9.3923 -9.3923 -8.1136 -8.1136 -4.3171 -4.3171 -4.2811 -4.2811 -3.9089 -3.9089 -2.7994 -2.7994 -2.4654 -2.4654 -2.1434 -2.1434 -1.8468 -1.8468 -1.6829 -1.6829 -0.5734 -0.5734 -0.1939 -0.1939 -0.1114 -0.1114 0.0012 0.0012 2.9562 2.9562 2.9763 2.9763 3.8297 3.8297 3.8699 3.8699 6.0984 6.0984 6.4025 6.4025 6.4088 6.4088 6.4435 6.4435 12.5006 12.5006 k = 0.1295-0.1830 0.7286 ( 2624 PWs) bands (ev): -22.5321 -22.5321 -21.9525 -21.9525 -21.4520 -21.4520 -21.0555 -21.0555 -11.3102 -11.3102 -9.4702 -9.4702 -9.3830 -9.3830 -8.1046 -8.1046 -4.3278 -4.3278 -4.3114 -4.3114 -3.9400 -3.9400 -2.7748 -2.7748 -2.4679 -2.4679 -2.1507 -2.1507 -1.8449 -1.8449 -1.6796 -1.6796 -0.5362 -0.5362 -0.1831 -0.1831 -0.0883 -0.0883 -0.0030 -0.0030 2.9324 2.9324 2.9478 2.9478 3.8151 3.8151 3.8871 3.8871 6.1333 6.1333 6.4070 6.4070 6.4175 6.4175 6.4579 6.4579 12.4791 12.4791 k = 0.1209-0.1708 0.7286 ( 2626 PWs) bands (ev): -22.5415 -22.5415 -21.9440 -21.9440 -21.4480 -21.4480 -21.0566 -21.0566 -11.3287 -11.3287 -9.4562 -9.4562 -9.3742 -9.3742 -8.0963 -8.0963 -4.3401 -4.3401 -4.3369 -4.3369 -3.9705 -3.9705 -2.7512 -2.7512 -2.4703 -2.4703 -2.1577 -2.1577 -1.8424 -1.8424 -1.6768 -1.6768 -0.5002 -0.5002 -0.1730 -0.1730 -0.0666 -0.0666 -0.0079 -0.0079 2.9099 2.9099 2.9209 2.9209 3.7999 3.7999 3.9056 3.9056 6.1660 6.1660 6.4088 6.4088 6.4281 6.4281 6.4712 6.4712 12.4587 12.4587 k = 0.1122-0.1586 0.7286 ( 2626 PWs) bands (ev): -22.5504 -22.5504 -21.9359 -21.9359 -21.4442 -21.4442 -21.0577 -21.0577 -11.3460 -11.3460 -9.4428 -9.4428 -9.3659 -9.3659 -8.0889 -8.0889 -4.3672 -4.3672 -4.3444 -4.3444 -4.0003 -4.0003 -2.7289 -2.7289 -2.4726 -2.4726 -2.1642 -2.1642 -1.8394 -1.8394 -1.6744 -1.6744 -0.4655 -0.4655 -0.1636 -0.1636 -0.0462 -0.0462 -0.0134 -0.0134 2.8888 2.8888 2.8956 2.8956 3.7853 3.7853 3.9240 3.9240 6.1963 6.1963 6.4103 6.4103 6.4385 6.4385 6.4835 6.4835 12.4396 12.4396 k = 0.1036-0.1464 0.7286 ( 2626 PWs) bands (ev): -22.5586 -22.5586 -21.9282 -21.9282 -21.4406 -21.4406 -21.0590 -21.0590 -11.3621 -11.3621 -9.4300 -9.4300 -9.3580 -9.3580 -8.0823 -8.0823 -4.3926 -4.3926 -4.3502 -4.3502 -4.0292 -4.0292 -2.7078 -2.7078 -2.4749 -2.4749 -2.1704 -2.1704 -1.8359 -1.8359 -1.6724 -1.6724 -0.4323 -0.4323 -0.1547 -0.1547 -0.0282 -0.0282 -0.0187 -0.0187 2.8692 2.8692 2.8720 2.8720 3.7716 3.7716 3.9420 3.9420 6.2239 6.2239 6.4120 6.4120 6.4485 6.4485 6.4948 6.4948 12.4217 12.4217 k = 0.0950-0.1342 0.7286 ( 2624 PWs) bands (ev): -22.5663 -22.5663 -21.9208 -21.9208 -21.4373 -21.4373 -21.0603 -21.0603 -11.3770 -11.3770 -9.4181 -9.4181 -9.3507 -9.3507 -8.0763 -8.0763 -4.4162 -4.4162 -4.3543 -4.3543 -4.0574 -4.0574 -2.6882 -2.6882 -2.4771 -2.4771 -2.1761 -2.1761 -1.8320 -1.8320 -1.6706 -1.6706 -0.4007 -0.4007 -0.1464 -0.1464 -0.0274 -0.0274 -0.0087 -0.0087 2.8500 2.8500 2.8512 2.8512 3.7587 3.7587 3.9593 3.9593 6.2486 6.2486 6.4141 6.4141 6.4578 6.4578 6.5051 6.5051 12.4051 12.4051 k = 0.0863-0.1220 0.7286 ( 2618 PWs) bands (ev): -22.5734 -22.5734 -21.9140 -21.9140 -21.4342 -21.4342 -21.0615 -21.0615 -11.3906 -11.3906 -9.4069 -9.4069 -9.3439 -9.3439 -8.0710 -8.0710 -4.4380 -4.4380 -4.3568 -4.3568 -4.0845 -4.0845 -2.6700 -2.6700 -2.4792 -2.4792 -2.1813 -2.1813 -1.8278 -1.8278 -1.6692 -1.6692 -0.3709 -0.3709 -0.1387 -0.1387 -0.0342 -0.0342 0.0071 0.0071 2.8299 2.8299 2.8345 2.8345 3.7469 3.7469 3.9756 3.9756 6.2701 6.2701 6.4171 6.4171 6.4666 6.4666 6.5145 6.5145 12.3898 12.3898 k = 0.0777-0.1098 0.7286 ( 2622 PWs) bands (ev): -22.5798 -22.5798 -21.9077 -21.9077 -21.4314 -21.4314 -21.0628 -21.0628 -11.4030 -11.4030 -9.3966 -9.3966 -9.3377 -9.3377 -8.0664 -8.0664 -4.4579 -4.4579 -4.3576 -4.3576 -4.1107 -4.1107 -2.6533 -2.6533 -2.4814 -2.4814 -2.1861 -2.1861 -1.8234 -1.8234 -1.6680 -1.6680 -0.3429 -0.3429 -0.1316 -0.1316 -0.0417 -0.0417 0.0215 0.0215 2.8116 2.8116 2.8194 2.8194 3.7362 3.7362 3.9909 3.9909 6.2881 6.2881 6.4211 6.4211 6.4747 6.4747 6.5228 6.5228 12.3759 12.3759 k = 0.0691-0.0976 0.7286 ( 2616 PWs) bands (ev): -22.5856 -22.5856 -21.9019 -21.9019 -21.4289 -21.4289 -21.0640 -21.0640 -11.4141 -11.4141 -9.3872 -9.3872 -9.3320 -9.3320 -8.0624 -8.0624 -4.4758 -4.4758 -4.3568 -4.3568 -4.1359 -4.1359 -2.6382 -2.6382 -2.4835 -2.4835 -2.1904 -2.1904 -1.8189 -1.8189 -1.6670 -1.6670 -0.3168 -0.3168 -0.1253 -0.1253 -0.0494 -0.0494 0.0345 0.0345 2.7951 2.7951 2.8059 2.8059 3.7265 3.7265 4.0050 4.0050 6.3027 6.3027 6.4263 6.4263 6.4820 6.4820 6.5302 6.5302 12.3634 12.3634 k = 0.0604-0.0854 0.7286 ( 2614 PWs) bands (ev): -22.5908 -22.5908 -21.8967 -21.8967 -21.4266 -21.4266 -21.0652 -21.0652 -11.4239 -11.4239 -9.3788 -9.3788 -9.3270 -9.3270 -8.0590 -8.0590 -4.4917 -4.4917 -4.3543 -4.3543 -4.1599 -4.1599 -2.6246 -2.6246 -2.4855 -2.4855 -2.1942 -2.1942 -1.8145 -1.8145 -1.6663 -1.6663 -0.2928 -0.2928 -0.1195 -0.1195 -0.0573 -0.0573 0.0460 0.0460 2.7805 2.7805 2.7939 2.7939 3.7179 3.7179 4.0178 4.0178 6.3139 6.3139 6.4325 6.4325 6.4887 6.4887 6.5367 6.5367 12.3523 12.3523 k = 0.0518-0.0732 0.7286 ( 2618 PWs) bands (ev): -22.5953 -22.5953 -21.8921 -21.8921 -21.4247 -21.4247 -21.0662 -21.0662 -11.4324 -11.4324 -9.3715 -9.3715 -9.3226 -9.3226 -8.0561 -8.0561 -4.5056 -4.5056 -4.3502 -4.3502 -4.1827 -4.1827 -2.6127 -2.6127 -2.4875 -2.4875 -2.1976 -2.1976 -1.8103 -1.8103 -1.6657 -1.6657 -0.2709 -0.2709 -0.1146 -0.1146 -0.0653 -0.0653 0.0560 0.0560 2.7678 2.7678 2.7834 2.7834 3.7104 3.7104 4.0291 4.0291 6.3220 6.3220 6.4392 6.4392 6.4944 6.4944 6.5423 6.5423 12.3426 12.3426 k = 0.0432-0.0610 0.7286 ( 2618 PWs) bands (ev): -22.5991 -22.5991 -21.8882 -21.8882 -21.4230 -21.4230 -21.0671 -21.0671 -11.4396 -11.4396 -9.3651 -9.3651 -9.3189 -9.3189 -8.0537 -8.0537 -4.5174 -4.5174 -4.3445 -4.3445 -4.2044 -4.2044 -2.6025 -2.6025 -2.4894 -2.4894 -2.2004 -2.2004 -1.8064 -1.8064 -1.6653 -1.6653 -0.2513 -0.2513 -0.1103 -0.1103 -0.0732 -0.0732 0.0644 0.0644 2.7570 2.7570 2.7745 2.7745 3.7041 3.7041 4.0388 4.0388 6.3277 6.3277 6.4461 6.4461 6.4994 6.4994 6.5469 6.5469 12.3343 12.3343 k = 0.0345-0.0488 0.7286 ( 2616 PWs) bands (ev): -22.6022 -22.6022 -21.8850 -21.8850 -21.4216 -21.4216 -21.0679 -21.0679 -11.4456 -11.4456 -9.3599 -9.3599 -9.3158 -9.3158 -8.0517 -8.0517 -4.5271 -4.5271 -4.3373 -4.3373 -4.2247 -4.2247 -2.5939 -2.5939 -2.4911 -2.4911 -2.2028 -2.2028 -1.8030 -1.8030 -1.6650 -1.6650 -0.2341 -0.2341 -0.1068 -0.1068 -0.0808 -0.0808 0.0713 0.0713 2.7481 2.7481 2.7673 2.7673 3.6989 3.6989 4.0469 4.0469 6.3315 6.3315 6.4525 6.4525 6.5035 6.5035 6.5508 6.5508 12.3276 12.3276 k = 0.0259-0.0366 0.7286 ( 2618 PWs) bands (ev): -22.6046 -22.6046 -21.8824 -21.8824 -21.4205 -21.4205 -21.0685 -21.0685 -11.4502 -11.4502 -9.3558 -9.3558 -9.3134 -9.3134 -8.0502 -8.0502 -4.5347 -4.5347 -4.3284 -4.3284 -4.2438 -4.2438 -2.5871 -2.5871 -2.4926 -2.4926 -2.2046 -2.2046 -1.8003 -1.8003 -1.6648 -1.6648 -0.2197 -0.2197 -0.1040 -0.1040 -0.0878 -0.0878 0.0766 0.0766 2.7412 2.7412 2.7616 2.7616 3.6948 3.6948 4.0533 4.0533 6.3340 6.3340 6.4580 6.4580 6.5067 6.5067 6.5537 6.5537 12.3223 12.3223 k = 0.0173-0.0244 0.7286 ( 2614 PWs) bands (ev): -22.6064 -22.6064 -21.8806 -21.8806 -21.4198 -21.4198 -21.0690 -21.0690 -11.4535 -11.4535 -9.3529 -9.3529 -9.3117 -9.3117 -8.0492 -8.0492 -4.5401 -4.5401 -4.3180 -4.3180 -4.2615 -4.2615 -2.5821 -2.5821 -2.4938 -2.4938 -2.2059 -2.2059 -1.7982 -1.7982 -1.6647 -1.6647 -0.2085 -0.2085 -0.1020 -0.1020 -0.0937 -0.0937 0.0804 0.0804 2.7362 2.7362 2.7576 2.7576 3.6919 3.6919 4.0579 4.0579 6.3356 6.3356 6.4621 6.4621 6.5091 6.5091 6.5558 6.5558 12.3185 12.3185 k = 0.0086-0.0122 0.7286 ( 2618 PWs) bands (ev): -22.6074 -22.6074 -21.8795 -21.8795 -21.4193 -21.4193 -21.0693 -21.0693 -11.4555 -11.4555 -9.3511 -9.3511 -9.3107 -9.3107 -8.0486 -8.0486 -4.5434 -4.5434 -4.3061 -4.3061 -4.2778 -4.2778 -2.5791 -2.5791 -2.4946 -2.4946 -2.2067 -2.2067 -1.7969 -1.7969 -1.6646 -1.6646 -0.2012 -0.2012 -0.1009 -0.1009 -0.0977 -0.0977 0.0827 0.0827 2.7333 2.7333 2.7551 2.7551 3.6902 3.6902 4.0607 4.0607 6.3364 6.3364 6.4647 6.4647 6.5105 6.5105 6.5571 6.5571 12.3162 12.3162 k = 0.0000 0.0000 0.7286 ( 2616 PWs) bands (ev): -22.6078 -22.6078 -21.8791 -21.8791 -21.4192 -21.4192 -21.0694 -21.0694 -11.4561 -11.4561 -9.3505 -9.3505 -9.3103 -9.3103 -8.0484 -8.0484 -4.5444 -4.5444 -4.2931 -4.2931 -4.2923 -4.2923 -2.5781 -2.5781 -2.4948 -2.4948 -2.2070 -2.2070 -1.7965 -1.7965 -1.6646 -1.6646 -0.1987 -0.1987 -0.1007 -0.1007 -0.0990 -0.0990 0.0835 0.0835 2.7323 2.7323 2.7543 2.7543 3.6896 3.6896 4.0616 4.0616 6.3366 6.3366 6.4656 6.4656 6.5109 6.5109 6.5575 6.5575 12.3155 12.3155 k = 0.0000 0.0000 0.7286 ( 2616 PWs) bands (ev): -22.6078 -22.6078 -21.8791 -21.8791 -21.4192 -21.4192 -21.0694 -21.0694 -11.4561 -11.4561 -9.3505 -9.3505 -9.3103 -9.3103 -8.0484 -8.0484 -4.5444 -4.5444 -4.2931 -4.2931 -4.2923 -4.2923 -2.5781 -2.5781 -2.4948 -2.4948 -2.2070 -2.2070 -1.7965 -1.7965 -1.6646 -1.6646 -0.1987 -0.1987 -0.1007 -0.1007 -0.0990 -0.0990 0.0835 0.0835 2.7323 2.7323 2.7543 2.7543 3.6896 3.6896 4.0616 4.0616 6.3366 6.3366 6.4656 6.4656 6.5109 6.5109 6.5575 6.5575 12.3155 12.3155 k = 0.0122 0.0086 0.7286 ( 2616 PWs) bands (ev): -22.6075 -22.6075 -21.8791 -21.8791 -21.4193 -21.4193 -21.0697 -21.0697 -11.4554 -11.4554 -9.3505 -9.3505 -9.3104 -9.3104 -8.0490 -8.0490 -4.5443 -4.5443 -4.2922 -4.2922 -4.2908 -4.2908 -2.5780 -2.5780 -2.4950 -2.4950 -2.2066 -2.2066 -1.7963 -1.7963 -1.6647 -1.6647 -0.2001 -0.2001 -0.1019 -0.1019 -0.1006 -0.1006 0.0831 0.0831 2.7331 2.7331 2.7552 2.7552 3.6905 3.6905 4.0619 4.0619 6.3354 6.3354 6.4643 6.4643 6.5107 6.5107 6.5563 6.5563 12.3162 12.3162 k = 0.0243 0.0172 0.7286 ( 2613 PWs) bands (ev): -22.6065 -22.6065 -21.8792 -21.8792 -21.4198 -21.4198 -21.0707 -21.0707 -11.4534 -11.4534 -9.3506 -9.3506 -9.3106 -9.3106 -8.0508 -8.0508 -4.5440 -4.5440 -4.2892 -4.2892 -4.2866 -4.2866 -2.5777 -2.5777 -2.4953 -2.4953 -2.2056 -2.2056 -1.7959 -1.7959 -1.6648 -1.6648 -0.2043 -0.2043 -0.1088 -0.1088 -0.1022 -0.1022 0.0818 0.0818 2.7355 2.7355 2.7580 2.7580 3.6933 3.6933 4.0629 4.0629 6.3318 6.3318 6.4605 6.4605 6.5101 6.5101 6.5527 6.5527 12.3184 12.3184 k = 0.0365 0.0258 0.7286 ( 2617 PWs) bands (ev): -22.6049 -22.6049 -21.8794 -21.8794 -21.4207 -21.4207 -21.0723 -21.0723 -11.4501 -11.4501 -9.3506 -9.3506 -9.3109 -9.3109 -8.0538 -8.0538 -4.5433 -4.5433 -4.2844 -4.2844 -4.2797 -4.2797 -2.5773 -2.5773 -2.4960 -2.4960 -2.2040 -2.2040 -1.7952 -1.7952 -1.6651 -1.6651 -0.2113 -0.2113 -0.1204 -0.1204 -0.1046 -0.1046 0.0794 0.0794 2.7394 2.7394 2.7625 2.7625 3.6979 3.6979 4.0646 4.0646 6.3257 6.3257 6.4544 6.4544 6.5088 6.5088 6.5467 6.5467 12.3220 12.3220 k = 0.0487 0.0344 0.7286 ( 2615 PWs) bands (ev): -22.6027 -22.6027 -21.8795 -21.8795 -21.4218 -21.4218 -21.0746 -21.0746 -11.4455 -11.4455 -9.3507 -9.3507 -9.3113 -9.3113 -8.0580 -8.0580 -4.5423 -4.5423 -4.2777 -4.2777 -4.2702 -4.2702 -2.5767 -2.5767 -2.4968 -2.4968 -2.2017 -2.2017 -1.7943 -1.7943 -1.6655 -1.6655 -0.2209 -0.2209 -0.1363 -0.1363 -0.1079 -0.1079 0.0758 0.0758 2.7450 2.7450 2.7689 2.7689 3.7043 3.7043 4.0670 4.0670 6.3172 6.3172 6.4462 6.4462 6.5067 6.5067 6.5384 6.5384 12.3271 12.3271 k = 0.0608 0.0430 0.7286 ( 2621 PWs) bands (ev): -22.5998 -22.5998 -21.8798 -21.8798 -21.4233 -21.4233 -21.0774 -21.0774 -11.4395 -11.4395 -9.3508 -9.3508 -9.3118 -9.3118 -8.0634 -8.0634 -4.5408 -4.5408 -4.2690 -4.2690 -4.2582 -4.2582 -2.5759 -2.5759 -2.4977 -2.4977 -2.1988 -2.1988 -1.7931 -1.7931 -1.6661 -1.6661 -0.2332 -0.2332 -0.1561 -0.1561 -0.1122 -0.1122 0.0707 0.0707 2.7521 2.7521 2.7771 2.7771 3.7125 3.7125 4.0699 4.0699 6.3064 6.3064 6.4359 6.4359 6.5031 6.5031 6.5283 6.5283 12.3335 12.3335 k = 0.0730 0.0517 0.7286 ( 2621 PWs) bands (ev): -22.5964 -22.5964 -21.8801 -21.8801 -21.4252 -21.4252 -21.0809 -21.0809 -11.4322 -11.4322 -9.3509 -9.3509 -9.3125 -9.3125 -8.0699 -8.0699 -4.5387 -4.5387 -4.2584 -4.2584 -4.2438 -4.2438 -2.5750 -2.5750 -2.4988 -2.4988 -2.1954 -2.1954 -1.7917 -1.7917 -1.6667 -1.6667 -0.2478 -0.2478 -0.1796 -0.1796 -0.1176 -0.1176 0.0638 0.0638 2.7608 2.7608 2.7871 2.7871 3.7225 3.7225 4.0736 4.0736 6.2931 6.2931 6.4238 6.4238 6.4971 6.4971 6.5174 6.5174 12.3414 12.3414 k = 0.0852 0.0603 0.7286 ( 2625 PWs) bands (ev): -22.5923 -22.5923 -21.8804 -21.8804 -21.4274 -21.4274 -21.0849 -21.0849 -11.4236 -11.4236 -9.3511 -9.3511 -9.3132 -9.3132 -8.0776 -8.0776 -4.5360 -4.5360 -4.2460 -4.2460 -4.2273 -4.2273 -2.5739 -2.5739 -2.4999 -2.4999 -2.1915 -2.1915 -1.7900 -1.7900 -1.6675 -1.6675 -0.2648 -0.2648 -0.2064 -0.2064 -0.1241 -0.1241 0.0551 0.0551 2.7711 2.7711 2.7989 2.7989 3.7342 3.7342 4.0778 4.0778 6.2776 6.2776 6.4099 6.4099 6.4868 6.4868 6.5074 6.5074 12.3507 12.3507 k = 0.0973 0.0689 0.7286 ( 2628 PWs) bands (ev): -22.5877 -22.5877 -21.8808 -21.8808 -21.4300 -21.4300 -21.0895 -21.0895 -11.4137 -11.4137 -9.3512 -9.3512 -9.3140 -9.3140 -8.0865 -8.0865 -4.5325 -4.5325 -4.2317 -4.2317 -4.2089 -4.2089 -2.5728 -2.5728 -2.5009 -2.5009 -2.1872 -2.1872 -1.7883 -1.7883 -1.6685 -1.6685 -0.2841 -0.2841 -0.2362 -0.2362 -0.1316 -0.1316 0.0445 0.0445 2.7830 2.7830 2.8124 2.8124 3.7477 3.7477 4.0827 4.0827 6.2597 6.2597 6.3942 6.3942 6.4711 6.4711 6.4994 6.4994 12.3614 12.3614 k = 0.1095 0.0775 0.7286 ( 2636 PWs) bands (ev): -22.5825 -22.5825 -21.8813 -21.8813 -21.4330 -21.4330 -21.0945 -21.0945 -11.4024 -11.4024 -9.3513 -9.3513 -9.3150 -9.3150 -8.0964 -8.0964 -4.5283 -4.5283 -4.2156 -4.2156 -4.1886 -4.1886 -2.5716 -2.5716 -2.5018 -2.5018 -2.1824 -2.1824 -1.7864 -1.7864 -1.6696 -1.6696 -0.3055 -0.3055 -0.2688 -0.2688 -0.1402 -0.1402 0.0318 0.0318 2.7964 2.7964 2.8277 2.8277 3.7629 3.7629 4.0881 4.0881 6.2395 6.2395 6.3769 6.3769 6.4516 6.4516 6.4921 6.4921 12.3734 12.3734 k = 0.1216 0.0861 0.7286 ( 2638 PWs) bands (ev): -22.5767 -22.5767 -21.8817 -21.8817 -21.4364 -21.4364 -21.1000 -21.1000 -11.3899 -11.3899 -9.3515 -9.3515 -9.3160 -9.3160 -8.1074 -8.1074 -4.5232 -4.5232 -4.1977 -4.1977 -4.1666 -4.1666 -2.5704 -2.5704 -2.5025 -2.5025 -2.1773 -2.1773 -1.7844 -1.7844 -1.6709 -1.6709 -0.3292 -0.3292 -0.3038 -0.3038 -0.1499 -0.1499 0.0170 0.0170 2.8113 2.8113 2.8448 2.8448 3.7798 3.7798 4.0941 4.0941 6.2171 6.2171 6.3581 6.3581 6.4292 6.4292 6.4846 6.4846 12.3867 12.3867 k = 0.1338 0.0947 0.7286 ( 2639 PWs) bands (ev): -22.5703 -22.5703 -21.8822 -21.8822 -21.4401 -21.4401 -21.1059 -21.1059 -11.3762 -11.3762 -9.3516 -9.3516 -9.3171 -9.3171 -8.1195 -8.1195 -4.5173 -4.5173 -4.1780 -4.1780 -4.1431 -4.1431 -2.5691 -2.5691 -2.5029 -2.5029 -2.1719 -2.1719 -1.7823 -1.7823 -1.6724 -1.6724 -0.3555 -0.3555 -0.3403 -0.3403 -0.1605 -0.1605 0.0001 0.0001 2.8278 2.8278 2.8636 2.8636 3.7982 3.7982 4.1006 4.1006 6.1926 6.1926 6.3376 6.3376 6.4043 6.4043 6.4765 6.4765 12.4014 12.4014 k = 0.1460 0.1033 0.7286 ( 2645 PWs) bands (ev): -22.5635 -22.5635 -21.8828 -21.8828 -21.4443 -21.4443 -21.1121 -21.1121 -11.3611 -11.3611 -9.3517 -9.3517 -9.3183 -9.3183 -8.1327 -8.1327 -4.5106 -4.5106 -4.1566 -4.1566 -4.1182 -4.1182 -2.5679 -2.5679 -2.5030 -2.5030 -2.1663 -2.1663 -1.7803 -1.7803 -1.6741 -1.6741 -0.3877 -0.3877 -0.3750 -0.3750 -0.1721 -0.1721 -0.0187 -0.0187 2.8457 2.8457 2.8842 2.8842 3.8183 3.8183 4.1076 4.1076 6.1659 6.1659 6.3157 6.3157 6.3770 6.3770 6.4677 6.4677 12.4173 12.4173 k = 0.1581 0.1119 0.7286 ( 2649 PWs) bands (ev): -22.5561 -22.5561 -21.8834 -21.8834 -21.4490 -21.4490 -21.1187 -21.1187 -11.3448 -11.3448 -9.3518 -9.3518 -9.3196 -9.3196 -8.1468 -8.1468 -4.5030 -4.5030 -4.1335 -4.1335 -4.0921 -4.0921 -2.5668 -2.5668 -2.5026 -2.5026 -2.1605 -2.1605 -1.7784 -1.7784 -1.6760 -1.6760 -0.4275 -0.4275 -0.4056 -0.4056 -0.1846 -0.1846 -0.0396 -0.0396 2.8651 2.8651 2.9064 2.9064 3.8399 3.8399 4.1151 4.1151 6.1371 6.1371 6.2923 6.2923 6.3476 6.3476 6.4581 6.4581 12.4345 12.4345 k = 0.1703 0.1205 0.7286 ( 2651 PWs) bands (ev): -22.5483 -22.5483 -21.8840 -21.8840 -21.4540 -21.4540 -21.1255 -21.1255 -11.3272 -11.3272 -9.3518 -9.3518 -9.3209 -9.3209 -8.1619 -8.1619 -4.4947 -4.4947 -4.1088 -4.1088 -4.0648 -4.0648 -2.5658 -2.5658 -2.5017 -2.5017 -2.1545 -2.1545 -1.7767 -1.7767 -1.6782 -1.6782 -0.4708 -0.4708 -0.4357 -0.4357 -0.1979 -0.1979 -0.0623 -0.0623 2.8860 2.8860 2.9303 2.9303 3.8630 3.8630 4.1229 4.1229 6.1064 6.1064 6.2675 6.2675 6.3162 6.3162 6.4478 6.4478 12.4529 12.4529 k = 0.1825 0.1291 0.7286 ( 2652 PWs) bands (ev): -22.5401 -22.5401 -21.8847 -21.8847 -21.4595 -21.4595 -21.1324 -21.1324 -11.3084 -11.3084 -9.3518 -9.3518 -9.3222 -9.3222 -8.1779 -8.1779 -4.4857 -4.4857 -4.0825 -4.0825 -4.0366 -4.0366 -2.5650 -2.5650 -2.5002 -2.5002 -2.1484 -2.1484 -1.7752 -1.7752 -1.6807 -1.6807 -0.5162 -0.5162 -0.4667 -0.4667 -0.2119 -0.2119 -0.0868 -0.0868 2.9083 2.9083 2.9558 2.9558 3.8875 3.8875 4.1312 4.1312 6.0738 6.0738 6.2414 6.2414 6.2829 6.2829 6.4367 6.4367 12.4725 12.4725 k = 0.1946 0.1378 0.7286 ( 2656 PWs) bands (ev): -22.5315 -22.5315 -21.8854 -21.8854 -21.4655 -21.4655 -21.1395 -21.1395 -11.2884 -11.2884 -9.3518 -9.3518 -9.3236 -9.3236 -8.1948 -8.1948 -4.4760 -4.4760 -4.0547 -4.0547 -4.0075 -4.0075 -2.5644 -2.5644 -2.4981 -2.4981 -2.1423 -2.1423 -1.7741 -1.7741 -1.6835 -1.6835 -0.5632 -0.5632 -0.4984 -0.4984 -0.2266 -0.2266 -0.1130 -0.1130 2.9320 2.9320 2.9829 2.9829 3.9134 3.9134 4.1397 4.1397 6.0393 6.0393 6.2139 6.2139 6.2479 6.2479 6.4250 6.4250 12.4933 12.4933 k = 0.2068 0.1464 0.7286 ( 2657 PWs) bands (ev): -22.5225 -22.5225 -21.8861 -21.8861 -21.4720 -21.4720 -21.1466 -21.1466 -11.2672 -11.2672 -9.3517 -9.3517 -9.3250 -9.3250 -8.2126 -8.2126 -4.4657 -4.4657 -4.0254 -4.0254 -3.9778 -3.9778 -2.5641 -2.5641 -2.4952 -2.4952 -2.1361 -2.1361 -1.7734 -1.7734 -1.6866 -1.6866 -0.6115 -0.6115 -0.5308 -0.5308 -0.2420 -0.2420 -0.1408 -0.1408 2.9571 2.9571 3.0116 3.0116 3.9405 3.9405 4.1486 4.1486 6.0032 6.0032 6.1851 6.1851 6.2114 6.2114 6.4126 6.4126 12.5151 12.5151 k = 0.2190 0.1550 0.7286 ( 2661 PWs) bands (ev): -22.5131 -22.5131 -21.8868 -21.8868 -21.4789 -21.4789 -21.1537 -21.1537 -11.2448 -11.2448 -9.3515 -9.3515 -9.3264 -9.3264 -8.2311 -8.2311 -4.4550 -4.4550 -3.9948 -3.9948 -3.9474 -3.9474 -2.5642 -2.5642 -2.4915 -2.4915 -2.1300 -2.1300 -1.7732 -1.7732 -1.6901 -1.6901 -0.6608 -0.6608 -0.5636 -0.5636 -0.2578 -0.2578 -0.1700 -0.1700 2.9835 2.9835 3.0418 3.0418 3.9689 3.9689 4.1576 4.1576 5.9653 5.9653 6.1545 6.1545 6.1739 6.1739 6.3995 6.3995 12.5381 12.5381 k = 0.2311 0.1636 0.7286 ( 2659 PWs) bands (ev): -22.5036 -22.5036 -21.8876 -21.8876 -21.4862 -21.4862 -21.1607 -21.1607 -11.2213 -11.2213 -9.3512 -9.3512 -9.3279 -9.3279 -8.2505 -8.2505 -4.4439 -4.4439 -3.9628 -3.9628 -3.9167 -3.9167 -2.5648 -2.5648 -2.4871 -2.4871 -2.1239 -2.1239 -1.7737 -1.7737 -1.6940 -1.6940 -0.7108 -0.7108 -0.5967 -0.5967 -0.2741 -0.2741 -0.2004 -0.2004 3.0111 3.0111 3.0736 3.0736 3.9985 3.9985 4.1668 4.1668 5.9260 5.9260 6.1210 6.1210 6.1369 6.1369 6.3859 6.3859 12.5621 12.5621 k = 0.2433 0.1722 0.7286 ( 2657 PWs) bands (ev): -22.4937 -22.4937 -21.8883 -21.8883 -21.4941 -21.4941 -21.1676 -21.1676 -11.1966 -11.1966 -9.3509 -9.3509 -9.3293 -9.3293 -8.2705 -8.2705 -4.4325 -4.4325 -3.9295 -3.9295 -3.8856 -3.8856 -2.5659 -2.5659 -2.4818 -2.4818 -2.1179 -2.1179 -1.7749 -1.7749 -1.6983 -1.6983 -0.7613 -0.7613 -0.6297 -0.6297 -0.2907 -0.2907 -0.2319 -0.2319 3.0399 3.0399 3.1068 3.1068 4.0290 4.0290 4.1761 4.1761 5.8853 5.8853 6.0831 6.0831 6.1021 6.1021 6.3717 6.3717 12.5872 12.5872 k = 0.2555 0.1808 0.7286 ( 2659 PWs) bands (ev): -22.4838 -22.4838 -21.8891 -21.8891 -21.5023 -21.5023 -21.1743 -21.1743 -11.1708 -11.1708 -9.3504 -9.3504 -9.3308 -9.3308 -8.2913 -8.2913 -4.4209 -4.4209 -3.8951 -3.8951 -3.8544 -3.8544 -2.5677 -2.5677 -2.4757 -2.4757 -2.1121 -2.1121 -1.7771 -1.7771 -1.7031 -1.7031 -0.8120 -0.8120 -0.6624 -0.6624 -0.3075 -0.3075 -0.2643 -0.2643 3.0699 3.0699 3.1414 3.1414 4.0605 4.0605 4.1854 4.1854 5.8432 5.8432 6.0414 6.0414 6.0689 6.0689 6.3569 6.3569 12.6132 12.6132 k = 0.2676 0.1894 0.7286 ( 2659 PWs) bands (ev): -22.4737 -22.4737 -21.8899 -21.8899 -21.5109 -21.5109 -21.1809 -21.1809 -11.1439 -11.1439 -9.3499 -9.3499 -9.3322 -9.3322 -8.3126 -8.3126 -4.4094 -4.4094 -3.8597 -3.8597 -3.8232 -3.8232 -2.5702 -2.5702 -2.4689 -2.4689 -2.1065 -2.1065 -1.7802 -1.7802 -1.7084 -1.7084 -0.8625 -0.8625 -0.6946 -0.6946 -0.3248 -0.3248 -0.2970 -0.2970 3.1010 3.1010 3.1774 3.1774 4.0927 4.0927 4.1946 4.1946 5.8000 5.8000 5.9976 5.9976 6.0361 6.0361 6.3417 6.3417 12.6402 12.6402 k = 0.2798 0.1980 0.7286 ( 2657 PWs) bands (ev): -22.4635 -22.4635 -21.8907 -21.8907 -21.5198 -21.5198 -21.1871 -21.1871 -11.1159 -11.1159 -9.3492 -9.3492 -9.3336 -9.3336 -8.3345 -8.3345 -4.3979 -4.3979 -3.8233 -3.8233 -3.7922 -3.7922 -2.5736 -2.5736 -2.4612 -2.4612 -2.1010 -2.1010 -1.7845 -1.7845 -1.7143 -1.7143 -0.9125 -0.9125 -0.7260 -0.7260 -0.3435 -0.3435 -0.3289 -0.3289 3.1330 3.1330 3.2148 3.2148 4.1254 4.1254 4.2039 4.2039 5.7557 5.7557 5.9523 5.9523 6.0033 6.0033 6.3261 6.3261 12.6681 12.6681 k = 0.2920 0.2066 0.7286 ( 2659 PWs) bands (ev): -22.4535 -22.4535 -21.8915 -21.8915 -21.5290 -21.5290 -21.1931 -21.1931 -11.0869 -11.0869 -9.3484 -9.3484 -9.3350 -9.3350 -8.3570 -8.3570 -4.3867 -4.3867 -3.7860 -3.7860 -3.7615 -3.7615 -2.5780 -2.5780 -2.4530 -2.4530 -2.0959 -2.0959 -1.7899 -1.7899 -1.7207 -1.7207 -0.9617 -0.9617 -0.7562 -0.7562 -0.3697 -0.3697 -0.3534 -0.3534 3.1659 3.1659 3.2534 3.2534 4.1582 4.1582 4.2134 4.2134 5.7105 5.7105 5.9058 5.9058 5.9706 5.9706 6.3101 6.3101 12.6969 12.6969 k = 0.3041 0.2152 0.7286 ( 2655 PWs) bands (ev): -22.4435 -22.4435 -21.8922 -21.8922 -21.5384 -21.5384 -21.1987 -21.1987 -11.0569 -11.0569 -9.3475 -9.3475 -9.3363 -9.3363 -8.3798 -8.3798 -4.3759 -4.3759 -3.7481 -3.7481 -3.7313 -3.7313 -2.5835 -2.5835 -2.4442 -2.4442 -2.0911 -2.0911 -1.7965 -1.7965 -1.7277 -1.7277 -1.0097 -1.0097 -0.7851 -0.7851 -0.4024 -0.4024 -0.3710 -0.3710 3.1996 3.1996 3.2932 3.2932 4.1896 4.1896 4.2243 4.2243 5.6647 5.6647 5.8583 5.8583 5.9378 5.9378 6.2937 6.2937 12.7266 12.7266 k = 0.3163 0.2239 0.7286 ( 2659 PWs) bands (ev): -22.4337 -22.4337 -21.8930 -21.8930 -21.5479 -21.5479 -21.2040 -21.2040 -11.0258 -11.0258 -9.3464 -9.3464 -9.3376 -9.3376 -8.4032 -8.4032 -4.3655 -4.3655 -3.7095 -3.7095 -3.7017 -3.7017 -2.5904 -2.5904 -2.4351 -2.4351 -2.0868 -2.0868 -1.8043 -1.8043 -1.7353 -1.7353 -1.0559 -1.0559 -0.8125 -0.8125 -0.4363 -0.4363 -0.3871 -0.3871 3.2340 3.2340 3.3341 3.3341 4.2139 4.2139 4.2421 4.2421 5.6182 5.6182 5.8102 5.8102 5.9053 5.9053 6.2770 6.2770 12.7570 12.7570 k = 0.3284 0.2325 0.7286 ( 2659 PWs) bands (ev): -22.4242 -22.4242 -21.8938 -21.8938 -21.5574 -21.5574 -21.2089 -21.2089 -10.9939 -10.9939 -9.3451 -9.3451 -9.3389 -9.3389 -8.4268 -8.4268 -4.3557 -4.3557 -3.6732 -3.6732 -3.6704 -3.6704 -2.5987 -2.5987 -2.4258 -2.4258 -2.0829 -2.0829 -1.8134 -1.8134 -1.7434 -1.7434 -1.0998 -1.0998 -0.8382 -0.8382 -0.4702 -0.4702 -0.4022 -0.4022 3.2689 3.2689 3.3762 3.3762 4.2264 4.2264 4.2709 4.2709 5.5713 5.5713 5.7616 5.7616 5.8731 5.8731 6.2601 6.2601 12.7882 12.7882 k = 0.5000 0.3539-0.3014 ( 2672 PWs) bands (ev): -22.3974 -22.3974 -21.9424 -21.9424 -21.6557 -21.6557 -21.2886 -21.2886 -9.8223 -9.8223 -9.4645 -9.4645 -8.7993 -8.7993 -8.4061 -8.4061 -4.4466 -4.4466 -4.1421 -4.1421 -3.4198 -3.4198 -3.3413 -3.3413 -2.6957 -2.6957 -2.1139 -2.1139 -1.9708 -1.9708 -1.7960 -1.7960 -1.1763 -1.1763 -0.8861 -0.8861 -0.7674 -0.7674 -0.5319 -0.5319 3.3450 3.3450 3.7428 3.7428 4.0810 4.0810 4.1539 4.1539 4.8231 4.8231 5.3734 5.3734 5.6681 5.6681 5.9605 5.9605 14.3815 14.3815 k = 0.5086 0.3418-0.3014 ( 2668 PWs) bands (ev): -22.3973 -22.3973 -21.9433 -21.9433 -21.6555 -21.6555 -21.2880 -21.2880 -9.8219 -9.8219 -9.4642 -9.4642 -8.8001 -8.8001 -8.4059 -8.4059 -4.4466 -4.4466 -4.1416 -4.1416 -3.4206 -3.4206 -3.3417 -3.3417 -2.6975 -2.6975 -2.1139 -2.1139 -1.9705 -1.9705 -1.7962 -1.7962 -1.1751 -1.1751 -0.8972 -0.8972 -0.7553 -0.7553 -0.5313 -0.5313 3.3457 3.3457 3.7397 3.7397 4.0816 4.0816 4.1546 4.1546 4.8251 4.8251 5.3684 5.3684 5.6729 5.6729 5.9605 5.9605 14.3815 14.3815 k = 0.5172 0.3296-0.3014 ( 2672 PWs) bands (ev): -22.3968 -22.3968 -21.9459 -21.9459 -21.6551 -21.6551 -21.2860 -21.2860 -9.8209 -9.8209 -9.4635 -9.4635 -8.8023 -8.8023 -8.4054 -8.4054 -4.4469 -4.4469 -4.1402 -4.1402 -3.4231 -3.4231 -3.3429 -3.3429 -2.7028 -2.7028 -2.1140 -2.1140 -1.9696 -1.9696 -1.7967 -1.7967 -1.1716 -1.1716 -0.9222 -0.9222 -0.7271 -0.7271 -0.5295 -0.5295 3.3477 3.3477 3.7305 3.7305 4.0835 4.0835 4.1565 4.1565 4.8311 4.8311 5.3542 5.3542 5.6861 5.6861 5.9605 5.9605 14.3814 14.3814 k = 0.5258 0.3175-0.3014 ( 2666 PWs) bands (ev): -22.3961 -22.3961 -21.9502 -21.9502 -21.6543 -21.6543 -21.2828 -21.2828 -9.8192 -9.8192 -9.4623 -9.4623 -8.8060 -8.8060 -8.4044 -8.4044 -4.4473 -4.4473 -4.1379 -4.1379 -3.4274 -3.4274 -3.3449 -3.3449 -2.7115 -2.7115 -2.1143 -2.1143 -1.9683 -1.9683 -1.7975 -1.7975 -1.1657 -1.1657 -0.9516 -0.9516 -0.6923 -0.6923 -0.5265 -0.5265 3.3510 3.3510 3.7158 3.7158 4.0866 4.0866 4.1592 4.1592 4.8412 4.8412 5.3330 5.3330 5.7057 5.7057 5.9605 5.9605 14.3813 14.3813 k = 0.5343 0.3054-0.3014 ( 2670 PWs) bands (ev): -22.3951 -22.3951 -21.9561 -21.9561 -21.6533 -21.6533 -21.2784 -21.2784 -9.8168 -9.8168 -9.4607 -9.4607 -8.8110 -8.8110 -8.4032 -8.4032 -4.4479 -4.4479 -4.1345 -4.1345 -3.4334 -3.4334 -3.3478 -3.3478 -2.7232 -2.7232 -2.1150 -2.1150 -1.9671 -1.9671 -1.7985 -1.7985 -1.1574 -1.1574 -0.9816 -0.9816 -0.6548 -0.6548 -0.5223 -0.5223 3.3555 3.3555 3.6962 3.6962 4.0908 4.0908 4.1621 4.1621 4.8550 4.8550 5.3069 5.3069 5.7297 5.7297 5.9605 5.9605 14.3812 14.3812 k = 0.5429 0.2932-0.3014 ( 2674 PWs) bands (ev): -22.3939 -22.3939 -21.9635 -21.9635 -21.6519 -21.6519 -21.2729 -21.2729 -9.8137 -9.8137 -9.4586 -9.4586 -8.8174 -8.8174 -8.4018 -8.4018 -4.4488 -4.4488 -4.1301 -4.1301 -3.4411 -3.4411 -3.3515 -3.3515 -2.7375 -2.7375 -2.1162 -2.1162 -1.9663 -1.9663 -1.7998 -1.7998 -1.1465 -1.1465 -1.0103 -1.0103 -0.6160 -0.6160 -0.5170 -0.5170 3.3614 3.3614 3.6727 3.6727 4.0958 4.0958 4.1646 4.1646 4.8725 4.8725 5.2778 5.2778 5.7563 5.7563 5.9605 5.9605 14.3810 14.3811 k = 0.5515 0.2811-0.3014 ( 2672 PWs) bands (ev): -22.3924 -22.3924 -21.9723 -21.9723 -21.6503 -21.6503 -21.2664 -21.2664 -9.8100 -9.8100 -9.4561 -9.4561 -8.8251 -8.8251 -8.4002 -8.4002 -4.4501 -4.4501 -4.1246 -4.1246 -3.4506 -3.4506 -3.3561 -3.3561 -2.7540 -2.7540 -2.1183 -2.1183 -1.9664 -1.9664 -1.8011 -1.8011 -1.1330 -1.1330 -1.0367 -1.0367 -0.5768 -0.5768 -0.5107 -0.5107 3.3686 3.3686 3.6458 3.6458 4.1016 4.1016 4.1663 4.1663 4.8934 4.8934 5.2470 5.2470 5.7844 5.7844 5.9606 5.9606 14.3809 14.3809 k = 0.5601 0.2690-0.3014 ( 2676 PWs) bands (ev): -22.3907 -22.3907 -21.9822 -21.9822 -21.6483 -21.6483 -21.2591 -21.2591 -9.8056 -9.8056 -9.4531 -9.4531 -8.8339 -8.8339 -8.3984 -8.3984 -4.4518 -4.4518 -4.1178 -4.1178 -3.4619 -3.4619 -3.3616 -3.3616 -2.7722 -2.7722 -2.1215 -2.1215 -1.9677 -1.9677 -1.8022 -1.8022 -1.1171 -1.1171 -1.0600 -1.0600 -0.5377 -0.5377 -0.5033 -0.5033 3.3770 3.3770 3.6163 3.6163 4.1080 4.1080 4.1667 4.1667 4.9175 4.9175 5.2154 5.2154 5.8133 5.8133 5.9608 5.9608 14.3807 14.3807 k = 0.5687 0.2568-0.3014 ( 2672 PWs) bands (ev): -22.3889 -22.3889 -21.9932 -21.9932 -21.6461 -21.6461 -21.2510 -21.2510 -9.8006 -9.8006 -9.4496 -9.4496 -8.8437 -8.8437 -8.3966 -8.3966 -4.4539 -4.4539 -4.1099 -4.1099 -3.4750 -3.4750 -3.3681 -3.3681 -2.7917 -2.7917 -2.1263 -2.1263 -1.9707 -1.9707 -1.8029 -1.8029 -1.1005 -1.1005 -1.0780 -1.0780 -0.4996 -0.4996 -0.4942 -0.4942 3.3867 3.3867 3.5847 3.5847 4.1145 4.1145 4.1656 4.1656 4.9445 4.9445 5.1838 5.1838 5.8423 5.8423 5.9610 5.9610 14.3804 14.3804 k = 0.5773 0.2447-0.3014 ( 2670 PWs) bands (ev): -22.3871 -22.3871 -22.0050 -22.0050 -21.6436 -21.6436 -21.2423 -21.2423 -9.7949 -9.7949 -9.4457 -9.4457 -8.8546 -8.8546 -8.3949 -8.3949 -4.4567 -4.4567 -4.1006 -4.1006 -3.4899 -3.4899 -3.3755 -3.3755 -2.8121 -2.8121 -2.1330 -2.1330 -1.9756 -1.9756 -1.8028 -1.8028 -1.1021 -1.1021 -1.0717 -1.0717 -0.4863 -0.4863 -0.4600 -0.4600 3.3976 3.3976 3.5517 3.5517 4.1209 4.1209 4.1629 4.1629 4.9739 4.9739 5.1529 5.1529 5.8713 5.8713 5.9614 5.9614 14.3801 14.3801 k = 0.5859 0.2326-0.3014 ( 2670 PWs) bands (ev): -22.3852 -22.3852 -22.0174 -22.0174 -21.6408 -21.6408 -21.2330 -21.2330 -9.7886 -9.7886 -9.4414 -9.4414 -8.8663 -8.8663 -8.3933 -8.3933 -4.4601 -4.4601 -4.0899 -4.0899 -3.5065 -3.5065 -3.3839 -3.3839 -2.8331 -2.8331 -2.1419 -2.1419 -1.9825 -1.9825 -1.8016 -1.8016 -1.1141 -1.1141 -1.0487 -1.0487 -0.4763 -0.4763 -0.4223 -0.4223 3.4097 3.4097 3.5175 3.5175 4.1265 4.1265 4.1588 4.1588 5.0053 5.0053 5.1234 5.1234 5.8998 5.8998 5.9618 5.9618 14.3798 14.3798 k = 0.5944 0.2204-0.3014 ( 2672 PWs) bands (ev): -22.3834 -22.3834 -22.0303 -22.0303 -21.6378 -21.6378 -21.2234 -21.2234 -9.7817 -9.7817 -9.4367 -9.4367 -8.8787 -8.8787 -8.3918 -8.3918 -4.4642 -4.4642 -4.0779 -4.0779 -3.5249 -3.5249 -3.3934 -3.3934 -2.8543 -2.8543 -2.1534 -2.1534 -1.9915 -1.9915 -1.7991 -1.7991 -1.1234 -1.1234 -1.0219 -1.0219 -0.4657 -0.4657 -0.3853 -0.3853 3.4228 3.4228 3.4825 3.4825 4.1302 4.1302 4.1542 4.1542 5.0376 5.0376 5.0967 5.0967 5.9277 5.9277 5.9625 5.9625 14.3793 14.3793 k = 0.4056-0.5730-0.0000 ( 2672 PWs) bands (ev): -22.3834 -22.3834 -22.0303 -22.0303 -21.6378 -21.6378 -21.2234 -21.2234 -9.7817 -9.7817 -9.4367 -9.4367 -8.8787 -8.8787 -8.3918 -8.3918 -4.4642 -4.4642 -4.0779 -4.0779 -3.5249 -3.5249 -3.3934 -3.3934 -2.8543 -2.8543 -2.1534 -2.1534 -1.9915 -1.9915 -1.7991 -1.7991 -1.1234 -1.1234 -1.0219 -1.0219 -0.4657 -0.4657 -0.3853 -0.3853 3.4228 3.4228 3.4825 3.4825 4.1302 4.1302 4.1542 4.1542 5.0376 5.0376 5.0967 5.0967 5.9277 5.9277 5.9625 5.9625 14.3793 14.3793 k = 0.3967-0.5605-0.0000 ( 2670 PWs) bands (ev): -22.3817 -22.3817 -22.0438 -22.0438 -21.6344 -21.6344 -21.2132 -21.2132 -9.7740 -9.7740 -9.4314 -9.4314 -8.8923 -8.8923 -8.3905 -8.3905 -4.4692 -4.4692 -4.0641 -4.0641 -3.5456 -3.5456 -3.4042 -3.4042 -2.8763 -2.8763 -2.1678 -2.1678 -2.0029 -2.0029 -1.7948 -1.7948 -1.1292 -1.1292 -0.9919 -0.9919 -0.4542 -0.4542 -0.3484 -0.3484 3.4358 3.4358 3.4478 3.4478 4.1295 4.1295 4.1510 4.1510 5.0581 5.0581 5.0860 5.0860 5.9554 5.9554 5.9635 5.9635 14.3788 14.3788 k = 0.3879-0.5481-0.0000 ( 2668 PWs) bands (ev): -22.3804 -22.3804 -22.0572 -22.0572 -21.6308 -21.6308 -21.2028 -21.2028 -9.7657 -9.7657 -9.4258 -9.4258 -8.9064 -8.9064 -8.3895 -8.3895 -4.4749 -4.4749 -4.0489 -4.0489 -3.5679 -3.5679 -3.4162 -3.4162 -2.8982 -2.8982 -2.1849 -2.1849 -2.0164 -2.0164 -1.7886 -1.7886 -1.1312 -1.1312 -0.9595 -0.9595 -0.4420 -0.4420 -0.3125 -0.3125 3.4083 3.4083 3.4543 3.4543 4.1225 4.1225 4.1505 4.1505 5.0411 5.0411 5.1173 5.1173 5.9642 5.9642 5.9828 5.9828 14.3782 14.3782 k = 0.3791-0.5356-0.0000 ( 2668 PWs) bands (ev): -22.3795 -22.3795 -22.0704 -22.0704 -21.6269 -21.6269 -21.1923 -21.1923 -9.7568 -9.7568 -9.4197 -9.4197 -8.9211 -8.9211 -8.3889 -8.3889 -4.4815 -4.4815 -4.0323 -4.0323 -3.5918 -3.5918 -3.4294 -3.4294 -2.9199 -2.9199 -2.2043 -2.2043 -2.0318 -2.0318 -1.7805 -1.7805 -1.1294 -1.1294 -0.9252 -0.9252 -0.4292 -0.4292 -0.2778 -0.2778 3.3716 3.3716 3.4709 3.4709 4.1113 4.1113 4.1506 4.1506 5.0220 5.0220 5.1553 5.1553 5.9656 5.9656 6.0088 6.0088 14.3774 14.3774 k = 0.3703-0.5232-0.0000 ( 2668 PWs) bands (ev): -22.3794 -22.3794 -22.0830 -22.0830 -21.6228 -21.6228 -21.1818 -21.1818 -9.7474 -9.7474 -9.4133 -9.4133 -8.9362 -8.9362 -8.3887 -8.3887 -4.4888 -4.4888 -4.0145 -4.0145 -3.6172 -3.6172 -3.4437 -3.4437 -2.9414 -2.9414 -2.2258 -2.2258 -2.0490 -2.0490 -1.7705 -1.7705 -1.1240 -1.1240 -0.8892 -0.8892 -0.4160 -0.4160 -0.2444 -0.2444 3.3348 3.3348 3.4885 3.4885 4.0973 4.0973 4.1493 4.1493 5.0065 5.0065 5.1948 5.1948 5.9672 5.9672 6.0337 6.0337 14.3766 14.3766 k = 0.3615-0.5107-0.0000 ( 2664 PWs) bands (ev): -22.3801 -22.3801 -22.0947 -22.0947 -21.6184 -21.6184 -21.1714 -21.1714 -9.7375 -9.7375 -9.4065 -9.4065 -8.9516 -8.9516 -8.3889 -8.3889 -4.4969 -4.4969 -3.9955 -3.9955 -3.6438 -3.6438 -3.4592 -3.4592 -2.9626 -2.9626 -2.2488 -2.2488 -2.0676 -2.0676 -1.7589 -1.7589 -1.1151 -1.1151 -0.8518 -0.8518 -0.4023 -0.4023 -0.2124 -0.2124 3.2982 3.2982 3.5068 3.5068 4.0813 4.0813 4.1459 4.1459 4.9953 4.9953 5.2351 5.2351 5.9691 5.9691 6.0576 6.0576 14.3757 14.3757 k = 0.3527-0.4983-0.0000 ( 2662 PWs) bands (ev): -22.3819 -22.3819 -22.1054 -22.1054 -21.6138 -21.6138 -21.1610 -21.1610 -9.7270 -9.7270 -9.3994 -9.3994 -8.9673 -8.9673 -8.3895 -8.3895 -4.5057 -4.5057 -3.9756 -3.9756 -3.6717 -3.6717 -3.4756 -3.4756 -2.9837 -2.9837 -2.2729 -2.2729 -2.0875 -2.0875 -1.7457 -1.7457 -1.1031 -1.1031 -0.8132 -0.8132 -0.3883 -0.3883 -0.1817 -0.1817 3.2620 3.2620 3.5256 3.5256 4.0635 4.0635 4.1399 4.1399 4.9889 4.9889 5.2759 5.2759 5.9713 5.9713 6.0803 6.0803 14.3747 14.3747 k = 0.3438-0.4858-0.0000 ( 2658 PWs) bands (ev): -22.3851 -22.3851 -22.1146 -22.1146 -21.6091 -21.6091 -21.1509 -21.1509 -9.7162 -9.7162 -9.3920 -9.3920 -8.9831 -8.9831 -8.3907 -8.3907 -4.5151 -4.5151 -3.9550 -3.9550 -3.7004 -3.7004 -3.4930 -3.4930 -3.0047 -3.0047 -2.2976 -2.2976 -2.1084 -2.1084 -1.7313 -1.7313 -1.0881 -1.0881 -0.7738 -0.7738 -0.3739 -0.3739 -0.1525 -0.1525 3.2263 3.2263 3.5445 3.5445 4.0441 4.0441 4.1315 4.1315 4.9875 4.9875 5.3170 5.3170 5.9738 5.9738 6.1017 6.1017 14.3735 14.3735 k = 0.3350-0.4734-0.0000 ( 2656 PWs) bands (ev): -22.3897 -22.3897 -22.1221 -22.1221 -21.6041 -21.6041 -21.1410 -21.1410 -9.7049 -9.7049 -9.3842 -9.3842 -8.9990 -8.9990 -8.3923 -8.3923 -4.5252 -4.5252 -3.9341 -3.9341 -3.7300 -3.7300 -3.5109 -3.5109 -3.0256 -3.0256 -2.3223 -2.3223 -2.1300 -2.1300 -1.7157 -1.7157 -1.0704 -1.0704 -0.7337 -0.7337 -0.3592 -0.3592 -0.1249 -0.1249 3.1911 3.1911 3.5632 3.5632 4.0232 4.0232 4.1210 4.1210 4.9911 4.9911 5.3582 5.3582 5.9767 5.9767 6.1219 6.1219 14.3722 14.3722 k = 0.3262-0.4609-0.0000 ( 2648 PWs) bands (ev): -22.3960 -22.3960 -22.1278 -22.1278 -21.5990 -21.5990 -21.1314 -21.1314 -9.6932 -9.6932 -9.3762 -9.3762 -9.0149 -9.0149 -8.3945 -8.3945 -4.5359 -4.5359 -3.9135 -3.9135 -3.7602 -3.7602 -3.5289 -3.5289 -3.0466 -3.0466 -2.3467 -2.3467 -2.1522 -2.1522 -1.6993 -1.6993 -1.0501 -1.0501 -0.6931 -0.6931 -0.3443 -0.3443 -0.0987 -0.0987 3.1567 3.1567 3.5811 3.5811 4.0009 4.0009 4.1090 4.1090 4.9995 4.9995 5.3994 5.3994 5.9800 5.9800 6.1409 6.1409 14.3708 14.3708 k = 0.3174-0.4484-0.0000 ( 2646 PWs) bands (ev): -22.4039 -22.4039 -22.1316 -22.1316 -21.5937 -21.5937 -21.1221 -21.1221 -9.6813 -9.6813 -9.3680 -9.3680 -9.0306 -9.0306 -8.3972 -8.3972 -4.5471 -4.5471 -3.8940 -3.8940 -3.7908 -3.7908 -3.5463 -3.5463 -3.0677 -3.0677 -2.3704 -2.3704 -2.1747 -2.1747 -1.6822 -1.6822 -1.0274 -1.0274 -0.6523 -0.6523 -0.3291 -0.3291 -0.0742 -0.0742 3.1230 3.1230 3.5975 3.5975 3.9774 3.9774 4.0964 4.0964 5.0125 5.0125 5.4403 5.4403 5.9836 5.9836 6.1585 6.1585 14.3693 14.3693 k = 0.3086-0.4360-0.0000 ( 2646 PWs) bands (ev): -22.4134 -22.4134 -22.1335 -22.1335 -21.5883 -21.5883 -21.1132 -21.1132 -9.6691 -9.6691 -9.3595 -9.3595 -9.0462 -9.0462 -8.4005 -8.4005 -4.5588 -4.5588 -3.8766 -3.8766 -3.8217 -3.8217 -3.5620 -3.5620 -3.0891 -3.0891 -2.3931 -2.3931 -2.1974 -2.1974 -1.6647 -1.6647 -1.0025 -1.0025 -0.6115 -0.6115 -0.3138 -0.3138 -0.0513 -0.0513 3.0902 3.0902 3.6116 3.6116 3.9527 3.9527 4.0844 4.0844 5.0296 5.0296 5.4809 5.4809 5.9876 5.9876 6.1747 6.1747 14.3677 14.3677 k = 0.2998-0.4235-0.0000 ( 2648 PWs) bands (ev): -22.4244 -22.4244 -22.1336 -22.1336 -21.5827 -21.5827 -21.1047 -21.1047 -9.6567 -9.6567 -9.3508 -9.3508 -9.0615 -9.0615 -8.4043 -8.4043 -4.5709 -4.5709 -3.8631 -3.8631 -3.8527 -3.8527 -3.5744 -3.5744 -3.1109 -3.1109 -2.4145 -2.4145 -2.2199 -2.2199 -1.6468 -1.6468 -0.9756 -0.9756 -0.5707 -0.5707 -0.2984 -0.2984 -0.0300 -0.0300 3.0583 3.0583 3.6224 3.6224 3.9270 3.9270 4.0744 4.0744 5.0503 5.0503 5.5210 5.5210 5.9920 5.9920 6.1896 6.1896 14.3659 14.3659 k = 0.2909-0.4111-0.0000 ( 2650 PWs) bands (ev): -22.4367 -22.4367 -22.1319 -22.1319 -21.5770 -21.5770 -21.0965 -21.0965 -9.6442 -9.6442 -9.3420 -9.3420 -9.0763 -9.0763 -8.4087 -8.4087 -4.5834 -4.5834 -3.8838 -3.8838 -3.8553 -3.8553 -3.5817 -3.5817 -3.1331 -3.1331 -2.4344 -2.4344 -2.2421 -2.2421 -1.6287 -1.6287 -0.9469 -0.9469 -0.5302 -0.5302 -0.2828 -0.2828 -0.0103 -0.0103 3.0274 3.0274 3.6287 3.6287 3.9002 3.9002 4.0678 4.0678 5.0744 5.0744 5.5605 5.5605 5.9967 5.9967 6.2031 6.2031 14.3639 14.3640 k = 0.2821-0.3986-0.0000 ( 2648 PWs) bands (ev): -22.4501 -22.4501 -22.1288 -22.1288 -21.5713 -21.5713 -21.0888 -21.0888 -9.6317 -9.6317 -9.3330 -9.3330 -9.0907 -9.0907 -8.4136 -8.4136 -4.5961 -4.5961 -3.9147 -3.9147 -3.8549 -3.8549 -3.5821 -3.5821 -3.1557 -3.1557 -2.4526 -2.4526 -2.2639 -2.2639 -1.6107 -1.6107 -0.9165 -0.9165 -0.4901 -0.4901 -0.2671 -0.2671 0.0077 0.0077 2.9975 2.9975 3.6297 3.6297 3.8727 3.8727 4.0660 4.0660 5.1012 5.1012 5.5994 5.5994 6.0018 6.0018 6.2153 6.2153 14.3619 14.3619 k = 0.2733-0.3862-0.0000 ( 2648 PWs) bands (ev): -22.4644 -22.4644 -22.1244 -22.1244 -21.5655 -21.5655 -21.0816 -21.0816 -9.6193 -9.6193 -9.3238 -9.3238 -9.1044 -9.1044 -8.4191 -8.4191 -4.6091 -4.6091 -3.9453 -3.9453 -3.8628 -3.8628 -3.5748 -3.5748 -3.1789 -3.1789 -2.4689 -2.4689 -2.2852 -2.2852 -1.5927 -1.5927 -0.8846 -0.8846 -0.4506 -0.4506 -0.2514 -0.2514 0.0241 0.0241 2.9686 2.9686 3.6246 3.6246 3.8443 3.8443 4.0699 4.0699 5.1304 5.1304 5.6376 5.6376 6.0073 6.0073 6.2260 6.2260 14.3598 14.3598 k = 0.2645-0.3737-0.0000 ( 2643 PWs) bands (ev): -22.4794 -22.4794 -22.1189 -22.1189 -21.5596 -21.5596 -21.0747 -21.0747 -9.6071 -9.6071 -9.3146 -9.3146 -9.1174 -9.1174 -8.4251 -8.4251 -4.6223 -4.6223 -3.9755 -3.9755 -3.8784 -3.8784 -3.5605 -3.5605 -3.2027 -3.2027 -2.4834 -2.4834 -2.3057 -2.3057 -1.5748 -1.5748 -0.8513 -0.8513 -0.4116 -0.4116 -0.2357 -0.2357 0.0388 0.0388 2.9408 2.9408 3.6135 3.6135 3.8153 3.8153 4.0797 4.0797 5.1617 5.1617 5.6749 5.6749 6.0131 6.0131 6.2354 6.2354 14.3575 14.3575 k = 0.2557-0.3612-0.0000 ( 2647 PWs) bands (ev): -22.4949 -22.4949 -22.1124 -22.1124 -21.5537 -21.5537 -21.0684 -21.0684 -9.5951 -9.5951 -9.3053 -9.3053 -9.1295 -9.1295 -8.4317 -8.4317 -4.6356 -4.6356 -4.0052 -4.0052 -3.9001 -3.9001 -3.5406 -3.5406 -3.2271 -3.2271 -2.4959 -2.4959 -2.3255 -2.3255 -1.5573 -1.5573 -0.8169 -0.8169 -0.3734 -0.3734 -0.2200 -0.2200 0.0519 0.0519 2.9142 2.9142 3.5969 3.5969 3.7856 3.7856 4.0953 4.0953 5.1945 5.1945 5.7113 5.7113 6.0193 6.0193 6.2433 6.2433 14.3551 14.3551 k = 0.2469-0.3488-0.0000 ( 2647 PWs) bands (ev): -22.5107 -22.5107 -22.1051 -22.1051 -21.5477 -21.5477 -21.0625 -21.0625 -9.5836 -9.5836 -9.2960 -9.2960 -9.1405 -9.1405 -8.4388 -8.4388 -4.6490 -4.6490 -4.0344 -4.0344 -3.9263 -3.9263 -3.5167 -3.5167 -3.2520 -3.2520 -2.5063 -2.5063 -2.3444 -2.3444 -1.5401 -1.5401 -0.7814 -0.7814 -0.3361 -0.3361 -0.2042 -0.2042 0.0634 0.0634 2.8887 2.8887 3.5757 3.5757 3.7555 3.7555 4.1160 4.1160 5.2287 5.2287 5.7468 5.7468 6.0258 6.0258 6.2499 6.2499 14.3526 14.3526 k = 0.2380-0.3363-0.0000 ( 2647 PWs) bands (ev): -22.5267 -22.5267 -22.0972 -22.0972 -21.5418 -21.5418 -21.0570 -21.0570 -9.5728 -9.5728 -9.2867 -9.2867 -9.1504 -9.1504 -8.4464 -8.4464 -4.6624 -4.6624 -4.0629 -4.0629 -3.9558 -3.9558 -3.4901 -3.4901 -3.2774 -3.2774 -2.5147 -2.5147 -2.3625 -2.3625 -1.5233 -1.5233 -0.7451 -0.7451 -0.2997 -0.2997 -0.1885 -0.1885 0.0734 0.0734 2.8644 2.8644 3.5507 3.5507 3.7250 3.7250 4.1409 4.1409 5.2640 5.2640 5.7812 5.7812 6.0326 6.0326 6.2551 6.2551 14.3501 14.3501 k = 0.2292-0.3239-0.0000 ( 2649 PWs) bands (ev): -22.5428 -22.5428 -22.0887 -22.0887 -21.5358 -21.5358 -21.0520 -21.0520 -9.5626 -9.5626 -9.2773 -9.2773 -9.1588 -9.1588 -8.4545 -8.4545 -4.6758 -4.6758 -4.0906 -4.0906 -3.9875 -3.9875 -3.4618 -3.4618 -3.3032 -3.3032 -2.5210 -2.5210 -2.3795 -2.3795 -1.5069 -1.5069 -0.7081 -0.7081 -0.2644 -0.2644 -0.1728 -0.1728 0.0817 0.0817 2.8413 2.8413 3.5230 3.5230 3.6941 3.6941 4.1693 4.1693 5.2999 5.2999 5.8145 5.8145 6.0398 6.0398 6.2589 6.2589 14.3474 14.3474 k = 0.2204-0.3114-0.0000 ( 2645 PWs) bands (ev): -22.5587 -22.5587 -22.0799 -22.0799 -21.5299 -21.5299 -21.0474 -21.0474 -9.5534 -9.5534 -9.2681 -9.2681 -9.1658 -9.1658 -8.4631 -8.4631 -4.6891 -4.6891 -4.1175 -4.1175 -4.0206 -4.0206 -3.4328 -3.4328 -3.3293 -3.3293 -2.5252 -2.5252 -2.3956 -2.3956 -1.4911 -1.4911 -0.6705 -0.6705 -0.2303 -0.2303 -0.1571 -0.1571 0.0885 0.0885 2.8195 2.8195 3.4934 3.4934 3.6631 3.6631 4.2004 4.2004 5.3365 5.3365 5.8466 5.8466 6.0472 6.0472 6.2614 6.2614 14.3447 14.3447 k = 0.2116-0.2990-0.0000 ( 2643 PWs) bands (ev): -22.5746 -22.5746 -22.0707 -22.0707 -21.5241 -21.5241 -21.0433 -21.0433 -9.5453 -9.5453 -9.2589 -9.2589 -9.1710 -9.1710 -8.4722 -8.4722 -4.7024 -4.7024 -4.1436 -4.1436 -4.0547 -4.0547 -3.4040 -3.4040 -3.3550 -3.3550 -2.5272 -2.5272 -2.4108 -2.4108 -1.4758 -1.4758 -0.6327 -0.6327 -0.1976 -0.1976 -0.1412 -0.1412 0.0939 0.0939 2.7989 2.7989 3.4625 3.4625 3.6320 3.6320 4.2337 4.2337 5.3733 5.3733 5.8774 5.8774 6.0550 6.0550 6.2624 6.2624 14.3419 14.3419 k = 0.2028-0.2865-0.0000 ( 2647 PWs) bands (ev): -22.5902 -22.5902 -22.0612 -22.0612 -21.5183 -21.5183 -21.0396 -21.0396 -9.5384 -9.5384 -9.2498 -9.2498 -9.1744 -9.1744 -8.4817 -8.4817 -4.7154 -4.7154 -4.1688 -4.1688 -4.0893 -4.0893 -3.3885 -3.3885 -3.3677 -3.3677 -2.5272 -2.5272 -2.4249 -2.4249 -1.4611 -1.4611 -0.5947 -0.5947 -0.1668 -0.1668 -0.1249 -0.1249 0.0978 0.0978 2.7795 2.7795 3.4308 3.4308 3.6009 3.6009 4.2686 4.2686 5.4102 5.4102 5.9068 5.9068 6.0631 6.0631 6.2622 6.2622 14.3390 14.3390 k = 0.1940-0.2740-0.0000 ( 2651 PWs) bands (ev): -22.6055 -22.6055 -22.0516 -22.0516 -21.5126 -21.5126 -21.0363 -21.0363 -9.5328 -9.5328 -9.2409 -9.2409 -9.1758 -9.1758 -8.4917 -8.4917 -4.7283 -4.7283 -4.1930 -4.1930 -4.1240 -4.1240 -3.4117 -3.4117 -3.3424 -3.3424 -2.5250 -2.5250 -2.4382 -2.4382 -1.4470 -1.4470 -0.5567 -0.5567 -0.1385 -0.1385 -0.1075 -0.1075 0.1003 0.1003 2.7613 2.7613 3.3989 3.3989 3.5699 3.5699 4.3049 4.3049 5.4470 5.4470 5.9348 5.9348 6.0716 6.0716 6.2607 6.2607 14.3361 14.3361 k = 0.1851-0.2616-0.0000 ( 2657 PWs) bands (ev): -22.6205 -22.6205 -22.0420 -22.0420 -21.5071 -21.5071 -21.0335 -21.0335 -9.5287 -9.5287 -9.2321 -9.2321 -9.1752 -9.1752 -8.5021 -8.5021 -4.7409 -4.7409 -4.2161 -4.2161 -4.1585 -4.1585 -3.4382 -3.4382 -3.3145 -3.3145 -2.5207 -2.5207 -2.4505 -2.4505 -1.4335 -1.4335 -0.5188 -0.5188 -0.1143 -0.1143 -0.0875 -0.0875 0.1016 0.1016 2.7444 2.7444 3.3669 3.3669 3.5392 3.5392 4.3420 4.3420 5.4836 5.4836 5.9612 5.9612 6.0805 6.0805 6.2578 6.2578 14.3331 14.3331 k = 0.1763-0.2491-0.0000 ( 2651 PWs) bands (ev): -22.6350 -22.6350 -22.0322 -22.0322 -21.5016 -21.5016 -21.0310 -21.0310 -9.5259 -9.5259 -9.2235 -9.2235 -9.1726 -9.1726 -8.5129 -8.5129 -4.7533 -4.7533 -4.2383 -4.2383 -4.1926 -4.1926 -3.4649 -3.4649 -3.2874 -3.2874 -2.5143 -2.5143 -2.4619 -2.4619 -1.4206 -1.4206 -0.4814 -0.4814 -0.0950 -0.0950 -0.0642 -0.0642 0.1015 0.1015 2.7287 2.7287 3.3354 3.3354 3.5087 3.5087 4.3798 4.3798 5.5197 5.5197 5.9858 5.9858 6.0899 6.0899 6.2538 6.2538 14.3301 14.3301 k = 0.1675-0.2367-0.0000 ( 2653 PWs) bands (ev): -22.6491 -22.6491 -22.0226 -22.0226 -21.4963 -21.4963 -21.0288 -21.0288 -9.5245 -9.5245 -9.2151 -9.2151 -9.1681 -9.1681 -8.5241 -8.5241 -4.7653 -4.7653 -4.2594 -4.2594 -4.2260 -4.2260 -3.4913 -3.4913 -3.2616 -3.2616 -2.5059 -2.5059 -2.4725 -2.4725 -1.4084 -1.4084 -0.4445 -0.4445 -0.0788 -0.0788 -0.0395 -0.0395 0.1004 0.1004 2.7143 2.7143 3.3044 3.3044 3.4787 3.4787 4.4180 4.4180 5.5552 5.5552 6.0086 6.0086 6.1000 6.1000 6.2486 6.2486 14.3271 14.3271 k = 0.1587-0.2242-0.0000 ( 2653 PWs) bands (ev): -22.6626 -22.6626 -22.0130 -22.0130 -21.4911 -21.4911 -21.0270 -21.0270 -9.5244 -9.5244 -9.2070 -9.2070 -9.1617 -9.1617 -8.5356 -8.5356 -4.7770 -4.7770 -4.2794 -4.2794 -4.2586 -4.2586 -3.5175 -3.5175 -3.2372 -3.2372 -2.4957 -2.4957 -2.4823 -2.4823 -1.3969 -1.3969 -0.4083 -0.4083 -0.0643 -0.0643 -0.0148 -0.0148 0.0982 0.0982 2.7010 2.7010 3.2741 3.2741 3.4492 3.4492 4.4563 4.4563 5.5900 5.5900 6.0292 6.0292 6.1108 6.1108 6.2422 6.2422 14.3241 14.3241 k = 0.1499-0.2118-0.0000 ( 2651 PWs) bands (ev): -22.6756 -22.6756 -22.0035 -22.0035 -21.4861 -21.4861 -21.0255 -21.0255 -9.5254 -9.5254 -9.1991 -9.1991 -9.1537 -9.1537 -8.5474 -8.5474 -4.7883 -4.7883 -4.2982 -4.2982 -4.2902 -4.2902 -3.5431 -3.5431 -3.2144 -3.2144 -2.4915 -2.4915 -2.4835 -2.4835 -1.3860 -1.3860 -0.3729 -0.3729 -0.0508 -0.0508 0.0090 0.0090 0.0950 0.0950 2.6890 2.6890 3.2448 3.2448 3.4203 3.4203 4.4945 4.4945 5.6240 5.6240 6.0475 6.0475 6.1226 6.1226 6.2348 6.2348 14.3212 14.3212 k = 0.1411-0.1993-0.0000 ( 2651 PWs) bands (ev): -22.6880 -22.6880 -21.9943 -21.9943 -21.4813 -21.4813 -21.0242 -21.0242 -9.5273 -9.5273 -9.1915 -9.1915 -9.1442 -9.1442 -8.5595 -8.5595 -4.7992 -4.7992 -4.3207 -4.3207 -4.3159 -4.3159 -3.5681 -3.5681 -3.1933 -3.1933 -2.4997 -2.4997 -2.4698 -2.4698 -1.3757 -1.3757 -0.3386 -0.3386 -0.0380 -0.0380 0.0317 0.0317 0.0910 0.0910 2.6781 2.6781 3.2166 3.2166 3.3922 3.3922 4.5324 4.5324 5.6570 5.6570 6.0635 6.0635 6.1352 6.1352 6.2263 6.2263 14.3184 14.3184 k = 0.1322-0.1868-0.0000 ( 2649 PWs) bands (ev): -22.6998 -22.6998 -21.9854 -21.9854 -21.4767 -21.4767 -21.0233 -21.0233 -9.5299 -9.5299 -9.1843 -9.1843 -9.1335 -9.1335 -8.5719 -8.5719 -4.8096 -4.8096 -4.3498 -4.3498 -4.3326 -4.3326 -3.5923 -3.5923 -3.1741 -3.1741 -2.5073 -2.5073 -2.4547 -2.4547 -1.3662 -1.3662 -0.3055 -0.3055 -0.0259 -0.0259 0.0530 0.0530 0.0863 0.0863 2.6684 2.6684 3.1896 3.1896 3.3649 3.3649 4.5698 4.5698 5.6889 5.6889 6.0772 6.0772 6.1486 6.1486 6.2170 6.2170 14.3155 14.3155 k = 0.1234-0.1744-0.0000 ( 2647 PWs) bands (ev): -22.7110 -22.7110 -21.9767 -21.9767 -21.4723 -21.4723 -21.0225 -21.0225 -9.5331 -9.5331 -9.1774 -9.1774 -9.1217 -9.1217 -8.5844 -8.5844 -4.8196 -4.8196 -4.3775 -4.3775 -4.3481 -4.3481 -3.6156 -3.6156 -3.1566 -3.1566 -2.5143 -2.5143 -2.4384 -2.4384 -1.3572 -1.3572 -0.2737 -0.2737 -0.0144 -0.0144 0.0717 0.0717 0.0823 0.0823 2.6597 2.6597 3.1639 3.1639 3.3386 3.3386 4.6064 4.6064 5.7196 5.7196 6.0889 6.0889 6.1623 6.1623 6.2069 6.2069 14.3127 14.3127 k = 0.1146-0.1619-0.0000 ( 2645 PWs) bands (ev): -22.7215 -22.7215 -21.9684 -21.9684 -21.4682 -21.4682 -21.0220 -21.0220 -9.5367 -9.5367 -9.1709 -9.1709 -9.1092 -9.1092 -8.5971 -8.5971 -4.8291 -4.8291 -4.4037 -4.4037 -4.3625 -4.3625 -3.6379 -3.6379 -3.1409 -3.1409 -2.5206 -2.5206 -2.4213 -2.4213 -1.3490 -1.3490 -0.2434 -0.2434 -0.0035 -0.0035 0.0735 0.0735 0.0935 0.0935 2.6521 2.6521 3.1396 3.1396 3.3133 3.3133 4.6420 4.6420 5.7491 5.7491 6.0990 6.0990 6.1756 6.1756 6.1964 6.1964 14.3101 14.3101 k = 0.1058-0.1495-0.0000 ( 2647 PWs) bands (ev): -22.7313 -22.7313 -21.9606 -21.9606 -21.4643 -21.4643 -21.0217 -21.0217 -9.5405 -9.5405 -9.1648 -9.1648 -9.0960 -9.0960 -8.6100 -8.6100 -4.8380 -4.8380 -4.4282 -4.4282 -4.3757 -4.3757 -3.6590 -3.6590 -3.1269 -3.1269 -2.5264 -2.5264 -2.4035 -2.4035 -1.3414 -1.3414 -0.2148 -0.2148 0.0066 0.0066 0.0676 0.0676 0.1105 0.1105 2.6454 2.6454 3.1169 3.1169 3.2893 3.2893 4.6764 4.6764 5.7772 5.7772 6.1078 6.1078 6.1813 6.1813 6.1926 6.1926 14.3075 14.3075 k = 0.0970-0.1370-0.0000 ( 2647 PWs) bands (ev): -22.7403 -22.7403 -21.9531 -21.9531 -21.4607 -21.4607 -21.0215 -21.0215 -9.5445 -9.5445 -9.1590 -9.1590 -9.0825 -9.0825 -8.6228 -8.6228 -4.8463 -4.8463 -4.4510 -4.4510 -4.3878 -4.3878 -3.6790 -3.6790 -3.1145 -3.1145 -2.5316 -2.5316 -2.3856 -2.3856 -1.3344 -1.3344 -0.1879 -0.1879 0.0161 0.0161 0.0612 0.0612 0.1264 0.1264 2.6398 2.6398 3.0957 3.0957 3.2665 3.2665 4.7094 4.7094 5.8040 5.8040 6.1155 6.1155 6.1707 6.1707 6.2039 6.2039 14.3051 14.3051 k = 0.0882-0.1246-0.0000 ( 2641 PWs) bands (ev): -22.7487 -22.7487 -21.9462 -21.9462 -21.4574 -21.4574 -21.0214 -21.0214 -9.5484 -9.5484 -9.1537 -9.1537 -9.0687 -9.0687 -8.6356 -8.6356 -4.8541 -4.8541 -4.4720 -4.4720 -4.3988 -4.3988 -3.6975 -3.6975 -3.1037 -3.1037 -2.5363 -2.5363 -2.3677 -2.3677 -1.3281 -1.3281 -0.1629 -0.1629 0.0249 0.0249 0.0547 0.0547 0.1410 0.1410 2.6350 2.6350 3.0761 3.0761 3.2452 3.2452 4.7407 4.7407 5.8293 5.8293 6.1224 6.1224 6.1583 6.1583 6.2159 6.2159 14.3028 14.3028 k = 0.0793-0.1121-0.0000 ( 2637 PWs) bands (ev): -22.7563 -22.7563 -21.9398 -21.9398 -21.4543 -21.4543 -21.0215 -21.0215 -9.5522 -9.5522 -9.1489 -9.1489 -9.0550 -9.0550 -8.6482 -8.6482 -4.8612 -4.8612 -4.4912 -4.4912 -4.4087 -4.4087 -3.7146 -3.7146 -3.0942 -3.0942 -2.5404 -2.5404 -2.3503 -2.3503 -1.3225 -1.3225 -0.1400 -0.1400 0.0330 0.0330 0.0482 0.0482 0.1543 0.1543 2.6310 2.6310 3.0583 3.0583 3.2254 3.2254 4.7701 4.7701 5.8532 5.8532 6.1285 6.1285 6.1453 6.1453 6.2270 6.2270 14.3006 14.3006 k = 0.0705-0.0997-0.0000 ( 2635 PWs) bands (ev): -22.7631 -22.7631 -21.9339 -21.9339 -21.4515 -21.4515 -21.0216 -21.0216 -9.5558 -9.5558 -9.1445 -9.1445 -9.0414 -9.0414 -8.6605 -8.6605 -4.8676 -4.8676 -4.5085 -4.5085 -4.4175 -4.4175 -3.7302 -3.7302 -3.0861 -3.0861 -2.5441 -2.5441 -2.3337 -2.3337 -1.3174 -1.3174 -0.1192 -0.1192 0.0399 0.0399 0.0423 0.0423 0.1661 0.1661 2.6277 2.6277 3.0422 3.0422 3.2072 3.2072 4.7974 4.7974 5.8756 5.8756 6.1320 6.1320 6.1338 6.1338 6.2372 6.2372 14.2986 14.2986 k = 0.0617-0.0872-0.0000 ( 2633 PWs) bands (ev): -22.7692 -22.7692 -21.9287 -21.9287 -21.4490 -21.4490 -21.0217 -21.0217 -9.5591 -9.5591 -9.1406 -9.1406 -9.0283 -9.0283 -8.6724 -8.6724 -4.8734 -4.8734 -4.5238 -4.5238 -4.4252 -4.4252 -3.7441 -3.7441 -3.0792 -3.0792 -2.5473 -2.5473 -2.3182 -2.3182 -1.3130 -1.3130 -0.1006 -0.1006 0.0359 0.0359 0.0469 0.0469 0.1766 0.1766 2.6251 2.6251 3.0279 3.0279 3.1909 3.1909 4.8222 4.8222 5.8966 5.8966 6.1186 6.1186 6.1385 6.1385 6.2463 6.2463 14.2968 14.2969 k = 0.0529-0.0747-0.0000 ( 2635 PWs) bands (ev): -22.7745 -22.7745 -21.9240 -21.9240 -21.4469 -21.4469 -21.0219 -21.0219 -9.5621 -9.5621 -9.1372 -9.1372 -9.0160 -9.0160 -8.6836 -8.6836 -4.8785 -4.8785 -4.5372 -4.5372 -4.4319 -4.4319 -3.7564 -3.7564 -3.0734 -3.0734 -2.5501 -2.5501 -2.3041 -2.3041 -1.3093 -1.3093 -0.0844 -0.0844 0.0305 0.0305 0.0526 0.0526 0.1856 0.1856 2.6230 2.6230 3.0154 3.0154 3.1764 3.1764 4.8443 4.8443 5.9162 5.9162 6.1052 6.1052 6.1426 6.1426 6.2543 6.2543 14.2953 14.2953 k = 0.0441-0.0623-0.0000 ( 2629 PWs) bands (ev): -22.7790 -22.7790 -21.9201 -21.9201 -21.4450 -21.4450 -21.0221 -21.0221 -9.5647 -9.5647 -9.1343 -9.1343 -9.0046 -9.0046 -8.6940 -8.6940 -4.8828 -4.8828 -4.5485 -4.5485 -4.4375 -4.4375 -3.7669 -3.7669 -3.0687 -3.0687 -2.5524 -2.5524 -2.2917 -2.2917 -1.3061 -1.3061 -0.0706 -0.0706 0.0258 0.0258 0.0574 0.0574 0.1933 0.1933 2.6214 2.6214 3.0048 3.0048 3.1640 3.1640 4.8635 4.8635 5.9344 5.9344 6.0919 6.0919 6.1460 6.1460 6.2610 6.2610 14.2939 14.2939 k = 0.0353-0.0498-0.0000 ( 2625 PWs) bands (ev): -22.7826 -22.7826 -21.9168 -21.9168 -21.4435 -21.4435 -21.0223 -21.0223 -9.5669 -9.5669 -9.1319 -9.1319 -8.9945 -8.9945 -8.7031 -8.7031 -4.8864 -4.8864 -4.5578 -4.5578 -4.4420 -4.4420 -3.7755 -3.7755 -3.0649 -3.0649 -2.5543 -2.5543 -2.2812 -2.2812 -1.3035 -1.3035 -0.0593 -0.0593 0.0218 0.0218 0.0614 0.0614 0.1996 0.1996 2.6203 2.6203 2.9961 2.9961 3.1536 3.1536 4.8797 4.8797 5.9513 5.9513 6.0788 6.0788 6.1488 6.1488 6.2666 6.2666 14.2928 14.2928 k = 0.0264-0.0374-0.0000 ( 2621 PWs) bands (ev): -22.7855 -22.7855 -21.9142 -21.9142 -21.4424 -21.4424 -21.0225 -21.0225 -9.5686 -9.5686 -9.1301 -9.1301 -8.9861 -8.9861 -8.7108 -8.7108 -4.8892 -4.8892 -4.5651 -4.5651 -4.4456 -4.4456 -3.7823 -3.7823 -3.0620 -3.0620 -2.5557 -2.5557 -2.2728 -2.2728 -1.3015 -1.3015 -0.0506 -0.0506 0.0187 0.0187 0.0646 0.0646 0.2044 0.2044 2.6194 2.6194 2.9893 2.9893 3.1455 3.1455 4.8924 4.8924 5.9667 5.9667 6.0661 6.0661 6.1510 6.1510 6.2709 6.2709 14.2919 14.2920 k = 0.0176-0.0249-0.0000 ( 2619 PWs) bands (ev): -22.7876 -22.7876 -21.9124 -21.9124 -21.4415 -21.4415 -21.0226 -21.0226 -9.5699 -9.5699 -9.1287 -9.1287 -8.9797 -8.9797 -8.7166 -8.7166 -4.8912 -4.8912 -4.5703 -4.5703 -4.4481 -4.4481 -3.7872 -3.7872 -3.0599 -3.0599 -2.5567 -2.5567 -2.2667 -2.2667 -1.3000 -1.3000 -0.0443 -0.0443 0.0165 0.0165 0.0668 0.0668 0.2079 0.2079 2.6189 2.6189 2.9844 2.9844 3.1396 3.1396 4.9017 4.9017 5.9803 5.9803 6.0544 6.0544 6.1526 6.1526 6.2741 6.2741 14.2913 14.2913 k = 0.0088-0.0125-0.0000 ( 2621 PWs) bands (ev): -22.7888 -22.7888 -21.9113 -21.9113 -21.4410 -21.4410 -21.0227 -21.0227 -9.5706 -9.5706 -9.1279 -9.1279 -8.9758 -8.9758 -8.7202 -8.7202 -4.8925 -4.8925 -4.5734 -4.5734 -4.4496 -4.4496 -3.7901 -3.7901 -3.0587 -3.0587 -2.5573 -2.5573 -2.2630 -2.2630 -1.2992 -1.2992 -0.0406 -0.0406 0.0152 0.0152 0.0681 0.0681 0.2100 0.2100 2.6186 2.6186 2.9815 2.9815 3.1360 3.1360 4.9073 4.9073 5.9908 5.9908 6.0450 6.0450 6.1535 6.1535 6.2759 6.2759 14.2909 14.2909 k = 0.0000 0.0000 0.0000 ( 2619 PWs) bands (ev): -22.7892 -22.7892 -21.9109 -21.9109 -21.4408 -21.4408 -21.0227 -21.0227 -9.5709 -9.5709 -9.1277 -9.1277 -8.9744 -8.9744 -8.7215 -8.7215 -4.8929 -4.8929 -4.5744 -4.5744 -4.4501 -4.4501 -3.7911 -3.7911 -3.0583 -3.0583 -2.5576 -2.5576 -2.2618 -2.2618 -1.2989 -1.2989 -0.0394 -0.0394 0.0148 0.0148 0.0686 0.0686 0.2107 0.2107 2.6185 2.6185 2.9805 2.9805 3.1348 3.1348 4.9091 4.9091 5.9953 5.9953 6.0409 6.0409 6.1538 6.1538 6.2766 6.2766 14.2908 14.2908 k = 0.0000 0.0000 0.0000 ( 2619 PWs) bands (ev): -22.7892 -22.7892 -21.9109 -21.9109 -21.4408 -21.4408 -21.0227 -21.0227 -9.5709 -9.5709 -9.1277 -9.1277 -8.9744 -8.9744 -8.7215 -8.7215 -4.8929 -4.8929 -4.5744 -4.5744 -4.4501 -4.4501 -3.7911 -3.7911 -3.0583 -3.0583 -2.5576 -2.5576 -2.2618 -2.2618 -1.2989 -1.2989 -0.0394 -0.0394 0.0148 0.0148 0.0686 0.0686 0.2107 0.2107 2.6185 2.6185 2.9805 2.9805 3.1348 3.1348 4.9091 4.9091 5.9953 5.9953 6.0409 6.0409 6.1538 6.1538 6.2766 6.2766 14.2908 14.2908 k = 0.0135-0.0048-0.0041 ( 2622 PWs) bands (ev): -22.7888 -22.7888 -21.9111 -21.9111 -21.4410 -21.4410 -21.0228 -21.0228 -9.5709 -9.5709 -9.1280 -9.1280 -8.9751 -8.9751 -8.7206 -8.7206 -4.8923 -4.8923 -4.5736 -4.5736 -4.4497 -4.4497 -3.7903 -3.7903 -3.0585 -3.0585 -2.5574 -2.5574 -2.2623 -2.2623 -1.2993 -1.2993 -0.0406 -0.0406 0.0145 0.0145 0.0683 0.0683 0.2100 0.2100 2.6190 2.6190 2.9813 2.9813 3.1356 3.1356 4.9079 4.9079 5.9924 5.9924 6.0428 6.0428 6.1535 6.1535 6.2761 6.2761 14.2907 14.2907 k = 0.0270-0.0095-0.0081 ( 2620 PWs) bands (ev): -22.7877 -22.7877 -21.9118 -21.9118 -21.4414 -21.4414 -21.0232 -21.0232 -9.5709 -9.5709 -9.1289 -9.1289 -8.9773 -8.9773 -8.7179 -8.7179 -4.8906 -4.8906 -4.5711 -4.5711 -4.4484 -4.4484 -3.7878 -3.7878 -3.0589 -3.0589 -2.5569 -2.5569 -2.2640 -2.2640 -1.3003 -1.3003 -0.0440 -0.0440 0.0135 0.0135 0.0674 0.0674 0.2079 0.2079 2.6204 2.6204 2.9836 2.9836 3.1379 3.1379 4.9042 4.9042 5.9850 5.9850 6.0472 6.0472 6.1526 6.1526 6.2747 6.2747 14.2903 14.2903 k = 0.0405-0.0143-0.0122 ( 2623 PWs) bands (ev): -22.7859 -22.7859 -21.9130 -21.9130 -21.4421 -21.4421 -21.0237 -21.0237 -9.5709 -9.5709 -9.1305 -9.1305 -8.9806 -8.9806 -8.7137 -8.7137 -4.8878 -4.8878 -4.5671 -4.5671 -4.4461 -4.4461 -3.7837 -3.7837 -3.0595 -3.0595 -2.5560 -2.5560 -2.2668 -2.2668 -1.3022 -1.3022 -0.0495 -0.0495 0.0110 0.0110 0.0662 0.0662 0.2046 0.2046 2.6227 2.6227 2.9874 2.9874 3.1418 3.1418 4.8982 4.8982 5.9748 5.9748 6.0522 6.0522 6.1511 6.1511 6.2726 6.2726 14.2897 14.2897 k = 0.0541-0.0191-0.0163 ( 2623 PWs) bands (ev): -22.7833 -22.7833 -21.9147 -21.9147 -21.4430 -21.4430 -21.0245 -21.0245 -9.5709 -9.5709 -9.1328 -9.1328 -8.9851 -8.9851 -8.7079 -8.7079 -4.8839 -4.8839 -4.5614 -4.5614 -4.4430 -4.4430 -3.7780 -3.7780 -3.0605 -3.0605 -2.5549 -2.5549 -2.2706 -2.2706 -1.3047 -1.3047 -0.0568 -0.0568 0.0065 0.0065 0.0651 0.0651 0.2004 0.2004 2.6260 2.6260 2.9927 2.9927 3.1472 3.1472 4.8897 4.8897 5.9628 5.9628 6.0565 6.0565 6.1491 6.1491 6.2701 6.2701 14.2888 14.2888 k = 0.0676-0.0238-0.0204 ( 2628 PWs) bands (ev): -22.7800 -22.7800 -21.9168 -21.9168 -21.4442 -21.4442 -21.0255 -21.0255 -9.5709 -9.5709 -9.1357 -9.1357 -8.9905 -8.9905 -8.7009 -8.7009 -4.8789 -4.8789 -4.5544 -4.5544 -4.4388 -4.4388 -3.7709 -3.7709 -3.0617 -3.0617 -2.5534 -2.5534 -2.2753 -2.2753 -1.3080 -1.3080 -0.0660 -0.0660 -0.0007 -0.0007 0.0641 0.0641 0.1957 0.1957 2.6302 2.6302 2.9995 2.9995 3.1542 3.1542 4.8789 4.8789 5.9495 5.9495 6.0592 6.0592 6.1467 6.1467 6.2674 6.2674 14.2877 14.2877 k = 0.0811-0.0286-0.0244 ( 2629 PWs) bands (ev): -22.7759 -22.7759 -21.9194 -21.9194 -21.4457 -21.4457 -21.0267 -21.0267 -9.5709 -9.5709 -9.1392 -9.1392 -8.9965 -8.9965 -8.6928 -8.6928 -4.8727 -4.8727 -4.5460 -4.5460 -4.4336 -4.4336 -3.7623 -3.7623 -3.0631 -3.0631 -2.5515 -2.5515 -2.2808 -2.2808 -1.3120 -1.3120 -0.0771 -0.0771 -0.0108 -0.0108 0.0631 0.0631 0.1910 0.1910 2.6353 2.6353 3.0077 3.0077 3.1627 3.1627 4.8659 4.8659 5.9351 5.9351 6.0597 6.0597 6.1438 6.1438 6.2650 6.2650 14.2864 14.2864 k = 0.0946-0.0334-0.0285 ( 2634 PWs) bands (ev): -22.7712 -22.7712 -21.9226 -21.9226 -21.4473 -21.4473 -21.0281 -21.0281 -9.5709 -9.5709 -9.1434 -9.1434 -9.0031 -9.0031 -8.6839 -8.6839 -4.8656 -4.8656 -4.5364 -4.5364 -4.4271 -4.4271 -3.7525 -3.7525 -3.0649 -3.0649 -2.5494 -2.5494 -2.2870 -2.2870 -1.3168 -1.3168 -0.0904 -0.0904 -0.0236 -0.0236 0.0618 0.0618 0.1869 0.1869 2.6414 2.6414 3.0173 3.0173 3.1727 3.1727 4.8508 4.8508 5.9195 5.9195 6.0579 6.0579 6.1403 6.1403 6.2633 6.2633 14.2849 14.2849 k = 0.1081-0.0381-0.0326 ( 2641 PWs) bands (ev): -22.7657 -22.7657 -21.9263 -21.9263 -21.4491 -21.4491 -21.0297 -21.0297 -9.5708 -9.5708 -9.1482 -9.1482 -9.0099 -9.0099 -8.6743 -8.6743 -4.8574 -4.8574 -4.5258 -4.5258 -4.4194 -4.4194 -3.7415 -3.7415 -3.0668 -3.0668 -2.5470 -2.5470 -2.2937 -2.2937 -1.3223 -1.3223 -0.1064 -0.1064 -0.0384 -0.0384 0.0598 0.0598 0.1837 0.1837 2.6483 2.6483 3.0284 3.0284 3.1842 3.1842 4.8336 4.8336 5.9027 5.9027 6.0535 6.0535 6.1360 6.1360 6.2629 6.2629 14.2831 14.2831 k = 0.1216-0.0429-0.0367 ( 2641 PWs) bands (ev): -22.7595 -22.7595 -21.9305 -21.9305 -21.4510 -21.4510 -21.0315 -21.0315 -9.5708 -9.5708 -9.1536 -9.1536 -9.0168 -9.0168 -8.6642 -8.6642 -4.8481 -4.8481 -4.5143 -4.5143 -4.4102 -4.4102 -3.7296 -3.7296 -3.0690 -3.0690 -2.5443 -2.5443 -2.3006 -2.3006 -1.3286 -1.3286 -0.1257 -0.1257 -0.0547 -0.0547 0.0570 0.0570 0.1818 0.1818 2.6561 2.6561 3.0407 3.0407 3.1972 3.1972 4.8145 4.8145 5.8845 5.8845 6.0468 6.0468 6.1308 6.1308 6.2639 6.2639 14.2812 14.2812 k = 0.1351-0.0476-0.0407 ( 2643 PWs) bands (ev): -22.7527 -22.7527 -21.9353 -21.9353 -21.4530 -21.4530 -21.0335 -21.0335 -9.5708 -9.5708 -9.1595 -9.1595 -9.0238 -9.0238 -8.6537 -8.6537 -4.8379 -4.8379 -4.5022 -4.5022 -4.3996 -4.3996 -3.7168 -3.7168 -3.0713 -3.0713 -2.5414 -2.5414 -2.3075 -2.3075 -1.3356 -1.3356 -0.1489 -0.1489 -0.0717 -0.0717 0.0532 0.0532 0.1813 0.1813 2.6647 2.6647 3.0543 3.0543 3.2117 3.2117 4.7937 4.7937 5.8647 5.8647 6.0381 6.0381 6.1243 6.1243 6.2664 6.2664 14.2791 14.2791 k = 0.1486-0.0524-0.0448 ( 2649 PWs) bands (ev): -22.7452 -22.7452 -21.9407 -21.9407 -21.4551 -21.4551 -21.0356 -21.0356 -9.5707 -9.5707 -9.1660 -9.1660 -9.0306 -9.0306 -8.6430 -8.6430 -4.8267 -4.8267 -4.4896 -4.4896 -4.3873 -4.3873 -3.7035 -3.7035 -3.0737 -3.0737 -2.5385 -2.5385 -2.3142 -2.3142 -1.3434 -1.3434 -0.1764 -0.1764 -0.0891 -0.0891 0.0485 0.0485 0.1822 0.1822 2.6742 2.6742 3.0690 3.0690 3.2277 3.2277 4.7712 4.7712 5.8432 5.8432 6.0278 6.0278 6.1168 6.1168 6.2704 6.2704 14.2768 14.2768 k = 0.1622-0.0572-0.0489 ( 2650 PWs) bands (ev): -22.7370 -22.7370 -21.9467 -21.9467 -21.4573 -21.4573 -21.0379 -21.0379 -9.5706 -9.5706 -9.1730 -9.1730 -9.0373 -9.0373 -8.6321 -8.6321 -4.8147 -4.8147 -4.4767 -4.4767 -4.3734 -4.3734 -3.6899 -3.6899 -3.0761 -3.0761 -2.5354 -2.5354 -2.3203 -2.3203 -1.3520 -1.3520 -0.2082 -0.2082 -0.1066 -0.1066 0.0432 0.0432 0.1843 0.1843 2.6846 2.6846 3.0849 3.0849 3.2452 3.2452 4.7473 4.7473 5.8197 5.8197 6.0164 6.0164 6.1081 6.1081 6.2755 6.2755 14.2744 14.2744 k = 0.1757-0.0619-0.0530 ( 2647 PWs) bands (ev): -22.7282 -22.7282 -21.9533 -21.9533 -21.4594 -21.4594 -21.0404 -21.0404 -9.5705 -9.5705 -9.1804 -9.1804 -9.0438 -9.0438 -8.6213 -8.6213 -4.8017 -4.8017 -4.4636 -4.4636 -4.3579 -4.3579 -3.6762 -3.6762 -3.0784 -3.0784 -2.5324 -2.5324 -2.3256 -2.3256 -1.3614 -1.3614 -0.2439 -0.2439 -0.1243 -0.1243 0.0374 0.0374 0.1875 0.1875 2.6957 2.6957 3.1017 3.1017 3.2642 3.2642 4.7220 4.7220 5.7941 5.7941 6.0041 6.0041 6.0986 6.0986 6.2817 6.2817 14.2718 14.2718 k = 0.1892-0.0667-0.0570 ( 2645 PWs) bands (ev): -22.7188 -22.7188 -21.9605 -21.9605 -21.4615 -21.4615 -21.0429 -21.0429 -9.5703 -9.5703 -9.1882 -9.1882 -9.0501 -9.0501 -8.6104 -8.6104 -4.7880 -4.7880 -4.4504 -4.4504 -4.3410 -4.3410 -3.6627 -3.6627 -3.0805 -3.0805 -2.5295 -2.5295 -2.3296 -2.3296 -1.3715 -1.3715 -0.2831 -0.2831 -0.1423 -0.1423 0.0314 0.0314 0.1914 0.1914 2.7075 2.7075 3.1194 3.1194 3.2846 3.2846 4.6955 4.6955 5.7663 5.7663 5.9913 5.9913 6.0885 6.0885 6.2885 6.2885 14.2692 14.2692 k = 0.2027-0.0715-0.0611 ( 2650 PWs) bands (ev): -22.7088 -22.7088 -21.9683 -21.9683 -21.4635 -21.4635 -21.0456 -21.0456 -9.5702 -9.5702 -9.1961 -9.1961 -9.0562 -9.0562 -8.5997 -8.5997 -4.7734 -4.7734 -4.4369 -4.4369 -4.3227 -4.3227 -3.6498 -3.6498 -3.0821 -3.0821 -2.5269 -2.5269 -2.3322 -2.3322 -1.3825 -1.3825 -0.3256 -0.3256 -0.1609 -0.1609 0.0254 0.0254 0.1960 0.1960 2.7201 2.7201 3.1379 3.1379 3.3064 3.3064 4.6680 4.6680 5.7362 5.7362 5.9783 5.9783 6.0778 6.0778 6.2957 6.2957 14.2665 14.2665 k = 0.2162-0.0762-0.0652 ( 2647 PWs) bands (ev): -22.6982 -22.6982 -21.9768 -21.9768 -21.4655 -21.4655 -21.0484 -21.0484 -9.5700 -9.5700 -9.2043 -9.2043 -9.0620 -9.0620 -8.5892 -8.5892 -4.7582 -4.7582 -4.4233 -4.4233 -4.3035 -4.3035 -3.6378 -3.6378 -3.0832 -3.0832 -2.5244 -2.5244 -2.3330 -2.3330 -1.3942 -1.3942 -0.3708 -0.3708 -0.1800 -0.1800 0.0194 0.0194 0.2009 0.2009 2.7333 2.7333 3.1569 3.1569 3.3297 3.3297 4.6396 4.6396 5.7039 5.7039 5.9652 5.9652 6.0668 6.0668 6.3032 6.3032 14.2639 14.2639 k = 0.2297-0.0810-0.0692 ( 2644 PWs) bands (ev): -22.6870 -22.6870 -21.9859 -21.9859 -21.4673 -21.4673 -21.0512 -21.0512 -9.5698 -9.5698 -9.2126 -9.2126 -9.0675 -9.0675 -8.5788 -8.5788 -4.7423 -4.7423 -4.4094 -4.4094 -4.2834 -4.2834 -3.6270 -3.6270 -3.0834 -3.0834 -2.5221 -2.5221 -2.3319 -2.3319 -1.4067 -1.4067 -0.4185 -0.4185 -0.1996 -0.1996 0.0136 0.0136 0.2061 0.2061 2.7471 2.7471 3.1764 3.1764 3.3544 3.3544 4.6106 4.6106 5.6695 5.6695 5.9522 5.9522 6.0556 6.0556 6.3109 6.3109 14.2612 14.2612 k = 0.2432-0.0858-0.0733 ( 2641 PWs) bands (ev): -22.6754 -22.6754 -21.9955 -21.9955 -21.4690 -21.4690 -21.0541 -21.0541 -9.5695 -9.5695 -9.2209 -9.2209 -9.0729 -9.0729 -8.5688 -8.5688 -4.7259 -4.7259 -4.3951 -4.3951 -4.2629 -4.2629 -3.6179 -3.6179 -3.0826 -3.0826 -2.5200 -2.5200 -2.3286 -2.3286 -1.4200 -1.4200 -0.4683 -0.4683 -0.2196 -0.2196 0.0081 0.0081 0.2115 0.2115 2.7615 2.7615 3.1962 3.1962 3.3804 3.3804 4.5810 4.5810 5.6332 5.6332 5.9392 5.9392 6.0444 6.0444 6.3185 6.3185 14.2584 14.2584 k = 0.2568-0.0905-0.0774 ( 2638 PWs) bands (ev): -22.6633 -22.6633 -22.0058 -22.0058 -21.4706 -21.4706 -21.0571 -21.0571 -9.5692 -9.5692 -9.2291 -9.2291 -9.0780 -9.0780 -8.5590 -8.5590 -4.7090 -4.7090 -4.3805 -4.3805 -4.2421 -4.2421 -3.6106 -3.6106 -3.0805 -3.0805 -2.5177 -2.5177 -2.3233 -2.3233 -1.4341 -1.4341 -0.5200 -0.5200 -0.2400 -0.2400 0.0029 0.0029 0.2170 0.2170 2.7764 2.7764 3.2162 3.2162 3.4078 3.4078 4.5511 4.5511 5.5950 5.5950 5.9264 5.9264 6.0334 6.0334 6.3261 6.3261 14.2557 14.2557 k = 0.2703-0.0953-0.0815 ( 2639 PWs) bands (ev): -22.6508 -22.6508 -22.0167 -22.0167 -21.4720 -21.4720 -21.0601 -21.0601 -9.5689 -9.5689 -9.2373 -9.2373 -9.0829 -9.0829 -8.5497 -8.5497 -4.6917 -4.6917 -4.3656 -4.3656 -4.2215 -4.2215 -3.6056 -3.6056 -3.0772 -3.0772 -2.5150 -2.5150 -2.3158 -2.3158 -1.4490 -1.4490 -0.5731 -0.5731 -0.2607 -0.2607 -0.0021 -0.0021 0.2224 0.2224 2.7917 2.7917 3.2361 3.2361 3.4365 3.4365 4.5210 4.5210 5.5553 5.5553 5.9136 5.9136 6.0226 6.0226 6.3335 6.3335 14.2531 14.2531 k = 0.2838-0.1001-0.0855 ( 2640 PWs) bands (ev): -22.6378 -22.6378 -22.0280 -22.0280 -21.4733 -21.4733 -21.0630 -21.0630 -9.5686 -9.5686 -9.2453 -9.2453 -9.0876 -9.0876 -8.5407 -8.5407 -4.6740 -4.6740 -4.3502 -4.3502 -4.2012 -4.2012 -3.6030 -3.6030 -3.0723 -3.0723 -2.5116 -2.5116 -2.3064 -2.3064 -1.4646 -1.4646 -0.6274 -0.6274 -0.2815 -0.2815 -0.0067 -0.0067 0.2278 0.2278 2.8073 2.8073 3.2559 3.2559 3.4664 3.4664 4.4909 4.4909 5.5143 5.5143 5.9009 5.9009 6.0121 6.0121 6.3406 6.3406 14.2505 14.2505 k = 0.2973-0.1048-0.0896 ( 2642 PWs) bands (ev): -22.6245 -22.6245 -22.0399 -22.0399 -21.4743 -21.4743 -21.0660 -21.0660 -9.5682 -9.5682 -9.2530 -9.2530 -9.0920 -9.0920 -8.5321 -8.5321 -4.6562 -4.6562 -4.3345 -4.3345 -4.1816 -4.1816 -3.6029 -3.6029 -3.0660 -3.0660 -2.5073 -2.5073 -2.2953 -2.2953 -1.4810 -1.4810 -0.6826 -0.6826 -0.3022 -0.3022 -0.0109 -0.0109 0.2330 0.2330 2.8231 2.8231 3.2753 3.2753 3.4973 3.4973 4.4610 4.4610 5.4724 5.4724 5.8883 5.8883 6.0022 6.0022 6.3474 6.3474 14.2480 14.2480 k = 0.3108-0.1096-0.0937 ( 2643 PWs) bands (ev): -22.6110 -22.6110 -22.0521 -22.0521 -21.4753 -21.4753 -21.0689 -21.0689 -9.5678 -9.5678 -9.2605 -9.2605 -9.0963 -9.0963 -8.5240 -8.5240 -4.6383 -4.6383 -4.3184 -4.3184 -4.1628 -4.1628 -3.6052 -3.6052 -3.0584 -3.0584 -2.5016 -2.5016 -2.2825 -2.2825 -1.4981 -1.4981 -0.7382 -0.7382 -0.3227 -0.3227 -0.0149 -0.0149 0.2380 0.2380 2.8391 2.8391 3.2942 3.2942 3.5292 3.5292 4.4314 4.4314 5.4297 5.4297 5.8758 5.8758 5.9928 5.9928 6.3540 6.3540 14.2456 14.2456 k = 0.3243-0.1143-0.0978 ( 2641 PWs) bands (ev): -22.5972 -22.5972 -22.0648 -22.0648 -21.4760 -21.4760 -21.0717 -21.0717 -9.5674 -9.5674 -9.2676 -9.2676 -9.1003 -9.1003 -8.5163 -8.5163 -4.6204 -4.6204 -4.3020 -4.3020 -4.1452 -4.1452 -3.6100 -3.6100 -3.0497 -3.0497 -2.4945 -2.4945 -2.2682 -2.2682 -1.5159 -1.5159 -0.7940 -0.7940 -0.3428 -0.3428 -0.0185 -0.0185 0.2428 0.2428 2.8550 2.8550 3.3125 3.3125 3.5618 3.5618 4.4024 4.4024 5.3867 5.3867 5.8635 5.8635 5.9840 5.9840 6.3601 6.3601 14.2433 14.2433 k = 0.3378-0.1191-0.1018 ( 2644 PWs) bands (ev): -22.5832 -22.5832 -22.0777 -22.0777 -21.4766 -21.4766 -21.0745 -21.0745 -9.5670 -9.5670 -9.2743 -9.2743 -9.1041 -9.1041 -8.5091 -8.5091 -4.6027 -4.6027 -4.2853 -4.2853 -4.1290 -4.1290 -3.6169 -3.6169 -3.0400 -3.0400 -2.4857 -2.4857 -2.2528 -2.2528 -1.5343 -1.5343 -0.8495 -0.8495 -0.3623 -0.3623 -0.0219 -0.0219 0.2474 0.2474 2.8709 2.8709 3.3300 3.3300 3.5950 3.5950 4.3742 4.3742 5.3437 5.3437 5.8513 5.8513 5.9759 5.9759 6.3659 6.3659 14.2412 14.2412 k = 0.3514-0.1239-0.1059 ( 2640 PWs) bands (ev): -22.5692 -22.5692 -22.0908 -22.0908 -21.4771 -21.4771 -21.0771 -21.0771 -9.5666 -9.5666 -9.2807 -9.2807 -9.1076 -9.1076 -8.5025 -8.5025 -4.5854 -4.5854 -4.2685 -4.2685 -4.1142 -4.1142 -3.6258 -3.6258 -3.0298 -3.0298 -2.4752 -2.4752 -2.2362 -2.2362 -1.5532 -1.5532 -0.9042 -0.9042 -0.3811 -0.3811 -0.0249 -0.0249 0.2517 0.2517 2.8864 2.8864 3.3466 3.3466 3.6286 3.6286 4.3469 4.3469 5.3010 5.3010 5.8395 5.8395 5.9685 5.9685 6.3713 6.3713 14.2393 14.2393 k = 0.3649-0.1286-0.1100 ( 2636 PWs) bands (ev): -22.5553 -22.5553 -22.1040 -22.1040 -21.4775 -21.4775 -21.0796 -21.0796 -9.5662 -9.5662 -9.2866 -9.2866 -9.1109 -9.1109 -8.4963 -8.4963 -4.5685 -4.5685 -4.2516 -4.2516 -4.1011 -4.1011 -3.6362 -3.6362 -3.0193 -3.0193 -2.4629 -2.4629 -2.2188 -2.2188 -1.5725 -1.5725 -0.9578 -0.9578 -0.3989 -0.3989 -0.0277 -0.0277 0.2557 0.2557 2.9016 2.9016 3.3621 3.3621 3.6621 3.6621 4.3207 4.3207 5.2592 5.2592 5.8281 5.8281 5.9618 5.9618 6.3763 6.3763 14.2374 14.2374 k = 0.3784-0.1334-0.1141 ( 2639 PWs) bands (ev): -22.5415 -22.5415 -22.1171 -22.1171 -21.4777 -21.4777 -21.0820 -21.0820 -9.5658 -9.5658 -9.2920 -9.2920 -9.1139 -9.1139 -8.4907 -8.4907 -4.5524 -4.5524 -4.2348 -4.2348 -4.0897 -4.0897 -3.6477 -3.6477 -3.0089 -3.0089 -2.4492 -2.4492 -2.2008 -2.2008 -1.5921 -1.5921 -1.0096 -1.0096 -0.4156 -0.4156 -0.0301 -0.0301 0.2594 0.2594 2.9161 2.9161 3.3765 3.3765 3.6953 3.6953 4.2957 4.2957 5.2186 5.2186 5.8173 5.8173 5.9557 5.9557 6.3808 6.3808 14.2357 14.2357 k = 0.3919-0.1382-0.1181 ( 2644 PWs) bands (ev): -22.5280 -22.5280 -22.1300 -22.1300 -21.4779 -21.4779 -21.0841 -21.0841 -9.5654 -9.5654 -9.2970 -9.2970 -9.1166 -9.1166 -8.4857 -8.4857 -4.5371 -4.5371 -4.2182 -4.2182 -4.0801 -4.0801 -3.6599 -3.6599 -2.9989 -2.9989 -2.4342 -2.4342 -2.1824 -2.1824 -1.6119 -1.6119 -1.0590 -1.0590 -0.4311 -0.4311 -0.0323 -0.0323 0.2627 0.2627 2.9299 2.9299 3.3895 3.3895 3.7278 3.7278 4.2723 4.2723 5.1797 5.1797 5.8070 5.8070 5.9504 5.9504 6.3849 6.3849 14.2342 14.2342 k = 0.4054-0.1429-0.1222 ( 2643 PWs) bands (ev): -22.5150 -22.5150 -22.1426 -22.1426 -21.4780 -21.4780 -21.0861 -21.0861 -9.5650 -9.5650 -9.3014 -9.3014 -9.1191 -9.1191 -8.4812 -8.4812 -4.5229 -4.5229 -4.2020 -4.2020 -4.0724 -4.0724 -3.6725 -3.6725 -2.9895 -2.9895 -2.4184 -2.4184 -2.1639 -2.1639 -1.6316 -1.6316 -1.1054 -1.1054 -0.4451 -0.4451 -0.0343 -0.0343 0.2657 0.2657 2.9426 2.9426 3.4012 3.4012 3.7591 3.7591 4.2505 4.2505 5.1432 5.1432 5.7977 5.7977 5.9458 5.9458 6.3886 6.3886 14.2329 14.2329 k = 0.4189-0.1477-0.1263 ( 2645 PWs) bands (ev): -22.5027 -22.5027 -22.1544 -22.1544 -21.4780 -21.4780 -21.0878 -21.0878 -9.5647 -9.5647 -9.3053 -9.3053 -9.1212 -9.1212 -8.4773 -8.4773 -4.5101 -4.5101 -4.1865 -4.1865 -4.0665 -4.0665 -3.6848 -3.6848 -2.9810 -2.9810 -2.4024 -2.4024 -2.1458 -2.1458 -1.6508 -1.6508 -1.1481 -1.1481 -0.4576 -0.4576 -0.0359 -0.0359 0.2683 0.2683 2.9543 2.9543 3.4115 3.4115 3.7887 3.7887 4.2306 4.2306 5.1095 5.1095 5.7892 5.7892 5.9418 5.9418 6.3917 6.3917 14.2317 14.2317 k = 0.4324-0.1525-0.1303 ( 2644 PWs) bands (ev): -22.4914 -22.4914 -22.1654 -22.1654 -21.4781 -21.4781 -21.0893 -21.0893 -9.5644 -9.5644 -9.3086 -9.3086 -9.1231 -9.1231 -8.4740 -8.4740 -4.4987 -4.4987 -4.1719 -4.1719 -4.0623 -4.0623 -3.6964 -3.6964 -2.9735 -2.9735 -2.3869 -2.3869 -2.1283 -2.1283 -1.6691 -1.6691 -1.1861 -1.1861 -0.4684 -0.4684 -0.0373 -0.0373 0.2705 0.2705 2.9645 2.9645 3.4202 3.4202 3.8158 3.8158 4.2128 4.2128 5.0794 5.0794 5.7819 5.7819 5.9384 5.9384 6.3944 6.3944 14.2307 14.2307 k = 0.4459-0.1572-0.1344 ( 2643 PWs) bands (ev): -22.4815 -22.4815 -22.1752 -22.1752 -21.4780 -21.4780 -21.0906 -21.0906 -9.5641 -9.5641 -9.3113 -9.3113 -9.1246 -9.1246 -8.4713 -8.4713 -4.4891 -4.4891 -4.1587 -4.1587 -4.0597 -4.0597 -3.7068 -3.7068 -2.9672 -2.9672 -2.3726 -2.3726 -2.1123 -2.1123 -1.6859 -1.6859 -1.2188 -1.2188 -0.4774 -0.4774 -0.0385 -0.0385 0.2723 0.2723 2.9732 2.9732 3.4274 3.4274 3.8399 3.8399 4.1973 4.1973 5.0536 5.0536 5.7757 5.7757 5.9357 5.9357 6.3966 6.3966 14.2298 14.2298 k = 0.4595-0.1620-0.1385 ( 2645 PWs) bands (ev): -22.4731 -22.4731 -22.1833 -22.1833 -21.4780 -21.4780 -21.0915 -21.0915 -9.5639 -9.5639 -9.3134 -9.3134 -9.1258 -9.1258 -8.4692 -8.4692 -4.4814 -4.4814 -4.1473 -4.1473 -4.0585 -4.0585 -3.7155 -3.7155 -2.9622 -2.9622 -2.3604 -2.3604 -2.0984 -2.0984 -1.7004 -1.7004 -1.2453 -1.2453 -0.4845 -0.4845 -0.0393 -0.0393 0.2738 0.2738 2.9801 2.9801 3.4330 3.4330 3.8600 3.8600 4.1845 4.1845 5.0326 5.0326 5.7708 5.7708 5.9336 5.9336 6.3983 6.3983 14.2292 14.2292 k = 0.4730-0.1668-0.1426 ( 2644 PWs) bands (ev): -22.4668 -22.4668 -22.1895 -22.1895 -21.4780 -21.4780 -21.0922 -21.0922 -9.5638 -9.5638 -9.3149 -9.3149 -9.1266 -9.1266 -8.4677 -8.4677 -4.4758 -4.4758 -4.1384 -4.1384 -4.0582 -4.0582 -3.7221 -3.7221 -2.9586 -2.9586 -2.3510 -2.3510 -2.0875 -2.0875 -1.7118 -1.7118 -1.2649 -1.2649 -0.4896 -0.4896 -0.0400 -0.0400 0.2748 0.2748 2.9852 2.9852 3.4370 3.4370 3.8753 3.8753 4.1749 4.1749 5.0171 5.0171 5.7672 5.7672 5.9321 5.9321 6.3996 6.3996 14.2287 14.2287 k = 0.4865-0.1715-0.1466 ( 2643 PWs) bands (ev): -22.4629 -22.4629 -22.1934 -22.1934 -21.4780 -21.4780 -21.0927 -21.0927 -9.5637 -9.5637 -9.3159 -9.3159 -9.1271 -9.1271 -8.4667 -8.4667 -4.4723 -4.4723 -4.1326 -4.1326 -4.0583 -4.0583 -3.7262 -3.7262 -2.9564 -2.9564 -2.3450 -2.3450 -2.0805 -2.0805 -1.7192 -1.7192 -1.2769 -1.2769 -0.4926 -0.4926 -0.0403 -0.0403 0.2754 0.2754 2.9883 2.9883 3.4394 3.4394 3.8850 3.8850 4.1688 4.1688 5.0076 5.0076 5.7651 5.7651 5.9312 5.9312 6.4003 6.4003 14.2284 14.2284 k = 0.5000-0.1763-0.1507 ( 2642 PWs) bands (ev): -22.4615 -22.4615 -22.1947 -22.1947 -21.4780 -21.4780 -21.0928 -21.0928 -9.5636 -9.5636 -9.3162 -9.3162 -9.1273 -9.1273 -8.4664 -8.4664 -4.4712 -4.4712 -4.1306 -4.1306 -4.0585 -4.0585 -3.7276 -3.7276 -2.9557 -2.9557 -2.3430 -2.3430 -2.0781 -2.0781 -1.7217 -1.7217 -1.2809 -1.2809 -0.4937 -0.4937 -0.0405 -0.0405 0.2756 0.2756 2.9894 2.9894 3.4402 3.4402 3.8883 3.8883 4.1668 4.1668 5.0044 5.0044 5.7644 5.7644 5.9309 5.9309 6.4005 6.4005 14.2284 14.2284 k = 0.5000-0.1763 0.5778 ( 2634 PWs) bands (ev): -22.3516 -22.3516 -22.1080 -22.1080 -21.4827 -21.4827 -21.0839 -21.0839 -10.7668 -10.7668 -10.2774 -10.2774 -8.9883 -8.9883 -8.4479 -8.4479 -4.3164 -4.3164 -3.7952 -3.7952 -3.2137 -3.2137 -2.8540 -2.8540 -2.4267 -2.4267 -2.1414 -2.1414 -1.8404 -1.8404 -1.7734 -1.7734 -1.3622 -1.3622 -0.7473 -0.7473 -0.2656 -0.2656 0.2074 0.2074 3.1389 3.1389 3.2184 3.2184 4.1625 4.1625 4.5218 4.5218 4.9924 4.9924 5.7949 5.7949 6.4151 6.4151 6.5760 6.5760 13.0912 13.0912 k = 0.4904-0.1729 0.5667 ( 2635 PWs) bands (ev): -22.3524 -22.3524 -22.1075 -22.1075 -21.4827 -21.4827 -21.0839 -21.0839 -10.7660 -10.7660 -10.2764 -10.2764 -8.9883 -8.9883 -8.4482 -8.4482 -4.3180 -4.3180 -3.7945 -3.7945 -3.2160 -3.2160 -2.8539 -2.8539 -2.4270 -2.4270 -2.1452 -2.1452 -1.8388 -1.8388 -1.7713 -1.7713 -1.3610 -1.3610 -0.7464 -0.7464 -0.2654 -0.2654 0.2074 0.2074 3.1340 3.1340 3.2230 3.2230 4.1598 4.1598 4.5207 4.5207 4.9948 4.9948 5.7956 5.7956 6.4148 6.4148 6.5757 6.5757 13.0929 13.0929 k = 0.4808-0.1695 0.5556 ( 2631 PWs) bands (ev): -22.3547 -22.3547 -22.1057 -22.1057 -21.4825 -21.4825 -21.0837 -21.0837 -10.7636 -10.7636 -10.2733 -10.2733 -8.9883 -8.9883 -8.4489 -8.4489 -4.3228 -4.3228 -3.7925 -3.7925 -3.2228 -3.2228 -2.8536 -2.8536 -2.4281 -2.4281 -2.1561 -2.1561 -1.8349 -1.8349 -1.7649 -1.7649 -1.3571 -1.3571 -0.7437 -0.7437 -0.2646 -0.2646 0.2073 0.2073 3.1218 3.1218 3.2344 3.2344 4.1519 4.1519 4.5174 4.5174 5.0017 5.0017 5.7979 5.7979 6.4141 6.4141 6.5746 6.5746 13.0979 13.0979 k = 0.4712-0.1661 0.5445 ( 2633 PWs) bands (ev): -22.3587 -22.3587 -22.1030 -22.1030 -21.4824 -21.4824 -21.0834 -21.0834 -10.7597 -10.7597 -10.2682 -10.2682 -8.9884 -8.9884 -8.4500 -8.4500 -4.3307 -4.3307 -3.7893 -3.7893 -3.2339 -3.2339 -2.8531 -2.8531 -2.4305 -2.4305 -2.1721 -2.1721 -1.8302 -1.8302 -1.7540 -1.7540 -1.3506 -1.3506 -0.7393 -0.7393 -0.2634 -0.2634 0.2073 0.2073 3.1059 3.1059 3.2489 3.2489 4.1391 4.1391 4.5119 4.5119 5.0130 5.0130 5.8015 5.8015 6.4128 6.4128 6.5729 6.5729 13.1064 13.1064 k = 0.4615-0.1627 0.5334 ( 2632 PWs) bands (ev): -22.3640 -22.3640 -22.0992 -22.0992 -21.4821 -21.4821 -21.0830 -21.0830 -10.7541 -10.7541 -10.2611 -10.2611 -8.9884 -8.9884 -8.4517 -8.4517 -4.3413 -4.3413 -3.7853 -3.7853 -3.2492 -3.2492 -2.8525 -2.8525 -2.4350 -2.4350 -2.1912 -2.1912 -1.8258 -1.8258 -1.7393 -1.7393 -1.3413 -1.3413 -0.7331 -0.7331 -0.2617 -0.2617 0.2072 0.2072 3.0882 3.0882 3.2645 3.2645 4.1218 4.1218 4.5045 4.5045 5.0282 5.0282 5.8065 5.8065 6.4110 6.4110 6.5705 6.5705 13.1181 13.1181 k = 0.4519-0.1593 0.5223 ( 2633 PWs) bands (ev): -22.3706 -22.3706 -22.0947 -22.0947 -21.4818 -21.4818 -21.0824 -21.0824 -10.7470 -10.7470 -10.2519 -10.2519 -8.9885 -8.9885 -8.4538 -8.4538 -4.3543 -4.3543 -3.7808 -3.7808 -3.2682 -3.2682 -2.8519 -2.8519 -2.4428 -2.4428 -2.2107 -2.2107 -1.8221 -1.8221 -1.7221 -1.7221 -1.3290 -1.3290 -0.7252 -0.7252 -0.2594 -0.2594 0.2072 0.2072 3.0699 3.0699 3.2800 3.2800 4.1007 4.1007 4.4953 4.4953 5.0467 5.0467 5.8128 5.8128 6.4086 6.4086 6.5675 6.5675 13.1330 13.1330 k = 0.4423-0.1559 0.5112 ( 2632 PWs) bands (ev): -22.3783 -22.3783 -22.0894 -22.0894 -21.4814 -21.4814 -21.0817 -21.0817 -10.7383 -10.7383 -10.2408 -10.2408 -8.9886 -8.9886 -8.4563 -8.4563 -4.3693 -4.3693 -3.7761 -3.7761 -3.2905 -3.2905 -2.8512 -2.8512 -2.4555 -2.4555 -2.2283 -2.2283 -1.8190 -1.8190 -1.7041 -1.7041 -1.3135 -1.3135 -0.7157 -0.7157 -0.2567 -0.2567 0.2071 0.2071 3.0513 3.0513 3.2949 3.2949 4.0764 4.0764 4.4846 4.4846 5.0682 5.0682 5.8203 5.8203 6.4058 6.4058 6.5637 6.5637 13.1511 13.1511 k = 0.4327-0.1525 0.5001 ( 2627 PWs) bands (ev): -22.3870 -22.3870 -22.0836 -22.0836 -21.4809 -21.4809 -21.0809 -21.0809 -10.7280 -10.7280 -10.2277 -10.2277 -8.9888 -8.9888 -8.4593 -8.4593 -4.3858 -4.3858 -3.7716 -3.7716 -3.3159 -3.3159 -2.8507 -2.8507 -2.4746 -2.4746 -2.2419 -2.2419 -1.8161 -1.8161 -1.6864 -1.6864 -1.2946 -1.2946 -0.7046 -0.7046 -0.2535 -0.2535 0.2069 0.2069 3.0328 3.0328 3.3088 3.3088 4.0494 4.0494 4.4727 4.4727 5.0920 5.0920 5.8288 5.8288 6.4025 6.4025 6.5594 6.5594 13.1723 13.1723 k = 0.4231-0.1492 0.4889 ( 2625 PWs) bands (ev): -22.3965 -22.3965 -22.0774 -22.0774 -21.4804 -21.4804 -21.0800 -21.0800 -10.7162 -10.7162 -10.2128 -10.2128 -8.9890 -8.9890 -8.4627 -8.4627 -4.4036 -4.4036 -3.7676 -3.7676 -3.3437 -3.3437 -2.8502 -2.8502 -2.5008 -2.5008 -2.2504 -2.2504 -1.8132 -1.8132 -1.6703 -1.6703 -1.2722 -1.2722 -0.6921 -0.6921 -0.2498 -0.2498 0.2068 0.2068 3.0147 3.0147 3.3213 3.3213 4.0204 4.0204 4.4598 4.4598 5.1176 5.1176 5.8382 5.8382 6.3987 6.3987 6.5544 6.5544 13.1963 13.1963 k = 0.4135-0.1458 0.4778 ( 2629 PWs) bands (ev): -22.4067 -22.4067 -22.0709 -22.0709 -21.4798 -21.4798 -21.0790 -21.0790 -10.7029 -10.7029 -10.1959 -10.1959 -8.9892 -8.9892 -8.4666 -8.4666 -4.4223 -4.4223 -3.7646 -3.7646 -3.3735 -3.3735 -2.8501 -2.8501 -2.5339 -2.5339 -2.2537 -2.2537 -1.8104 -1.8104 -1.6564 -1.6564 -1.2462 -1.2462 -0.6782 -0.6782 -0.2457 -0.2457 0.2066 0.2066 2.9970 2.9970 3.3321 3.3321 3.9897 3.9897 4.4464 4.4464 5.1447 5.1447 5.8483 5.8483 6.3945 6.3945 6.5487 6.5487 13.2232 13.2232 k = 0.4038-0.1424 0.4667 ( 2634 PWs) bands (ev): -22.4175 -22.4175 -22.0641 -22.0641 -21.4792 -21.4792 -21.0779 -21.0779 -10.6880 -10.6880 -10.1773 -10.1773 -8.9895 -8.9895 -8.4709 -8.4709 -4.4416 -4.4416 -3.7628 -3.7628 -3.4048 -3.4048 -2.8502 -2.8502 -2.5728 -2.5728 -2.2526 -2.2526 -1.8075 -1.8075 -1.6451 -1.6451 -1.2169 -1.2169 -0.6630 -0.6630 -0.2410 -0.2410 0.2063 0.2063 2.9798 2.9798 3.3409 3.3409 3.9580 3.9580 4.4329 4.4329 5.1730 5.1730 5.8591 5.8591 6.3898 6.3898 6.5425 6.5425 13.2526 13.2526 k = 0.3942-0.1390 0.4556 ( 2633 PWs) bands (ev): -22.4289 -22.4289 -22.0573 -22.0573 -21.4785 -21.4785 -21.0767 -21.0767 -10.6716 -10.6716 -10.1570 -10.1570 -8.9898 -8.9898 -8.4756 -8.4756 -4.4611 -4.4611 -3.7625 -3.7625 -3.4370 -3.4370 -2.8510 -2.8510 -2.6162 -2.6162 -2.2483 -2.2483 -1.8045 -1.8045 -1.6365 -1.6365 -1.1844 -1.1844 -0.6467 -0.6467 -0.2359 -0.2359 0.2060 0.2060 2.9633 2.9633 3.3473 3.3473 3.9256 3.9256 4.4198 4.4198 5.2021 5.2021 5.8704 5.8704 6.3847 6.3847 6.5357 6.5357 13.2845 13.2845 k = 0.3846-0.1356 0.4445 ( 2631 PWs) bands (ev): -22.4406 -22.4406 -22.0503 -22.0503 -21.4777 -21.4777 -21.0754 -21.0754 -10.6537 -10.6537 -10.1349 -10.1349 -8.9901 -8.9901 -8.4807 -8.4807 -4.4806 -4.4806 -3.7643 -3.7643 -3.4697 -3.4697 -2.8530 -2.8530 -2.6626 -2.6626 -2.2417 -2.2417 -1.8015 -1.8015 -1.6305 -1.6305 -1.1492 -1.1492 -0.6292 -0.6292 -0.2303 -0.2303 0.2057 0.2057 2.9476 2.9476 3.3513 3.3513 3.8927 3.8927 4.4074 4.4074 5.2318 5.2318 5.8821 5.8821 6.3792 6.3792 6.5283 6.5283 13.3187 13.3187 k = 0.3750-0.1322 0.4334 ( 2631 PWs) bands (ev): -22.4527 -22.4527 -22.0434 -22.0434 -21.4769 -21.4769 -21.0741 -21.0741 -10.6343 -10.6343 -10.1113 -10.1113 -8.9906 -8.9906 -8.4862 -8.4862 -4.4999 -4.4999 -3.7685 -3.7685 -3.5019 -3.5019 -2.8573 -2.8573 -2.7102 -2.7102 -2.2337 -2.2337 -1.7988 -1.7988 -1.6267 -1.6267 -1.1116 -1.1116 -0.6108 -0.6108 -0.2243 -0.2243 0.2053 0.2053 2.9328 2.9328 3.3524 3.3524 3.8597 3.8597 4.3962 4.3962 5.2618 5.2618 5.8940 5.8940 6.3734 6.3734 6.5204 6.5204 13.3549 13.3549 k = 0.3654-0.1288 0.4223 ( 2634 PWs) bands (ev): -22.4650 -22.4650 -22.0365 -22.0365 -21.4760 -21.4760 -21.0726 -21.0726 -10.6135 -10.6135 -10.0861 -10.0861 -8.9911 -8.9911 -8.4920 -8.4920 -4.5188 -4.5188 -3.7756 -3.7756 -3.5330 -3.5330 -2.8672 -2.8672 -2.7552 -2.7552 -2.2247 -2.2247 -1.7965 -1.7965 -1.6247 -1.6247 -1.0721 -1.0721 -0.5915 -0.5915 -0.2178 -0.2178 0.2049 0.2049 2.9188 2.9188 3.3506 3.3506 3.8267 3.8267 4.3867 4.3867 5.2921 5.2921 5.9061 5.9061 6.3671 6.3671 6.5120 6.5120 13.3929 13.3929 k = 0.3558-0.1254 0.4112 ( 2636 PWs) bands (ev): -22.4776 -22.4776 -22.0297 -22.0297 -21.4750 -21.4750 -21.0711 -21.0711 -10.5913 -10.5913 -10.0594 -10.0594 -8.9916 -8.9916 -8.4982 -8.4982 -4.5372 -4.5372 -3.7862 -3.7862 -3.5622 -3.5622 -2.8899 -2.8899 -2.7900 -2.7900 -2.2155 -2.2155 -1.7950 -1.7950 -1.6240 -1.6240 -1.0310 -1.0310 -0.5714 -0.5714 -0.2108 -0.2108 0.2044 0.2044 2.9059 2.9059 3.3457 3.3457 3.7938 3.7938 4.3792 4.3792 5.3224 5.3224 5.9183 5.9183 6.3606 6.3606 6.5032 6.5032 13.4326 13.4326 k = 0.3462-0.1220 0.4000 ( 2636 PWs) bands (ev): -22.4903 -22.4903 -22.0231 -22.0231 -21.4740 -21.4740 -21.0695 -21.0695 -10.5677 -10.5677 -10.0313 -10.0313 -8.9923 -8.9923 -8.5047 -8.5047 -4.5548 -4.5548 -3.8010 -3.8010 -3.5885 -3.5885 -2.9306 -2.9306 -2.8089 -2.8089 -2.2064 -2.2064 -1.7949 -1.7949 -1.6238 -1.6238 -0.9888 -0.9888 -0.5507 -0.5507 -0.2034 -0.2034 0.2038 0.2038 2.8939 2.8939 3.3378 3.3378 3.7612 3.7612 4.3740 4.3740 5.3527 5.3527 5.9305 5.9305 6.3537 6.3537 6.4939 6.4939 13.4736 13.4736 k = 0.3365-0.1186 0.3889 ( 2633 PWs) bands (ev): -22.5030 -22.5030 -22.0165 -22.0165 -21.4730 -21.4730 -21.0678 -21.0678 -10.5428 -10.5428 -10.0020 -10.0020 -8.9930 -8.9930 -8.5115 -8.5115 -4.5715 -4.5715 -3.8202 -3.8202 -3.6113 -3.6113 -2.9839 -2.9839 -2.8174 -2.8174 -2.1978 -2.1978 -1.7965 -1.7965 -1.6234 -1.6234 -0.9457 -0.9457 -0.5295 -0.5295 -0.1956 -0.1956 0.2031 0.2031 2.8830 2.8830 3.3270 3.3270 3.7288 3.7288 4.3714 4.3714 5.3829 5.3829 5.9425 5.9425 6.3465 6.3465 6.4842 6.4842 13.5158 13.5158 k = 0.3269-0.1153 0.3778 ( 2632 PWs) bands (ev): -22.5159 -22.5159 -22.0101 -22.0101 -21.4719 -21.4719 -21.0661 -21.0661 -10.5166 -10.5166 -9.9714 -9.9714 -8.9939 -8.9939 -8.5185 -8.5185 -4.5873 -4.5873 -3.8438 -3.8438 -3.6305 -3.6305 -3.0434 -3.0434 -2.8213 -2.8213 -2.1901 -2.1901 -1.8006 -1.8006 -1.6219 -1.6219 -0.9021 -0.9021 -0.5079 -0.5079 -0.1872 -0.1872 0.2024 0.2024 2.8731 2.8731 3.3134 3.3134 3.6965 3.6965 4.3715 4.3715 5.4129 5.4129 5.9544 5.9544 6.3391 6.3391 6.4741 6.4741 13.5589 13.5589 k = 0.3173-0.1119 0.3667 ( 2634 PWs) bands (ev): -22.5287 -22.5287 -22.0039 -22.0039 -21.4708 -21.4708 -21.0644 -21.0644 -10.4891 -10.4891 -9.9398 -9.9398 -8.9948 -8.9948 -8.5259 -8.5259 -4.6020 -4.6020 -3.8712 -3.8712 -3.6464 -3.6464 -3.1063 -3.1063 -2.8234 -2.8234 -2.1836 -2.1836 -1.8077 -1.8077 -1.6188 -1.6188 -0.8582 -0.8582 -0.4860 -0.4860 -0.1785 -0.1785 0.2016 0.2016 2.8644 2.8644 3.2973 3.2973 3.6645 3.6645 4.3744 4.3744 5.4426 5.4426 5.9661 5.9661 6.3315 6.3315 6.4637 6.4637 13.6026 13.6026 k = 0.3077-0.1085 0.3556 ( 2634 PWs) bands (ev): -22.5416 -22.5416 -21.9979 -21.9979 -21.4696 -21.4696 -21.0626 -21.0626 -10.4605 -10.4605 -9.9071 -9.9071 -8.9959 -8.9959 -8.5334 -8.5334 -4.6157 -4.6157 -3.9016 -3.9016 -3.6596 -3.6596 -3.1715 -3.1715 -2.8247 -2.8247 -2.1785 -2.1785 -1.8179 -1.8179 -1.6135 -1.6135 -0.8142 -0.8142 -0.4639 -0.4639 -0.1693 -0.1693 0.2007 0.2007 2.8567 2.8567 3.2791 3.2791 3.6326 3.6326 4.3800 4.3800 5.4719 5.4719 5.9775 5.9775 6.3237 6.3237 6.4531 6.4531 13.6466 13.6466 k = 0.2981-0.1051 0.3445 ( 2635 PWs) bands (ev): -22.5544 -22.5544 -21.9921 -21.9921 -21.4684 -21.4684 -21.0608 -21.0608 -10.4307 -10.4307 -9.8735 -9.8735 -8.9970 -8.9970 -8.5411 -8.5411 -4.6281 -4.6281 -3.9341 -3.9341 -3.6706 -3.6706 -3.2382 -3.2382 -2.8257 -2.8257 -2.1748 -2.1748 -1.8314 -1.8314 -1.6061 -1.6061 -0.7703 -0.7703 -0.4418 -0.4418 -0.1596 -0.1596 0.1997 0.1997 2.8500 2.8500 3.2591 3.2591 3.6009 3.6009 4.3882 4.3882 5.5008 5.5008 5.9886 5.9886 6.3157 6.3157 6.4422 6.4422 13.6908 13.6908 k = 0.2885-0.1017 0.3334 ( 2637 PWs) bands (ev): -22.5670 -22.5670 -21.9865 -21.9865 -21.4672 -21.4672 -21.0590 -21.0590 -10.3998 -10.3998 -9.8391 -9.8391 -8.9983 -8.9983 -8.5490 -8.5490 -4.6394 -4.6394 -3.9680 -3.9680 -3.6802 -3.6802 -3.3061 -3.3061 -2.8266 -2.8266 -2.1728 -2.1728 -1.8481 -1.8481 -1.5964 -1.5964 -0.7268 -0.7268 -0.4197 -0.4197 -0.1496 -0.1496 0.1986 0.1986 2.8444 2.8444 3.2377 3.2377 3.5694 3.5694 4.3990 4.3990 5.5292 5.5292 5.9993 5.9993 6.3076 6.3076 6.4310 6.4310 13.7348 13.7348 k = 0.2788-0.0983 0.3223 ( 2645 PWs) bands (ev): -22.5796 -22.5796 -21.9812 -21.9812 -21.4660 -21.4660 -21.0571 -21.0571 -10.3680 -10.3680 -9.8040 -9.8040 -8.9996 -8.9996 -8.5570 -8.5570 -4.6494 -4.6494 -4.0026 -4.0026 -3.6886 -3.6886 -3.3747 -3.3747 -2.8276 -2.8276 -2.1725 -2.1725 -1.8675 -1.8675 -1.5849 -1.5849 -0.6836 -0.6836 -0.3977 -0.3977 -0.1391 -0.1391 0.1974 0.1974 2.8396 2.8396 3.2152 3.2152 3.5381 3.5381 4.4120 4.4120 5.5571 5.5571 6.0097 6.0097 6.2994 6.2994 6.4198 6.4198 13.7784 13.7784 k = 0.2692-0.0949 0.3111 ( 2645 PWs) bands (ev): -22.5920 -22.5920 -21.9760 -21.9760 -21.4647 -21.4647 -21.0553 -21.0553 -10.3352 -10.3352 -9.7683 -9.7683 -9.0011 -9.0011 -8.5650 -8.5650 -4.6582 -4.6582 -4.0374 -4.0374 -3.6962 -3.6962 -3.4439 -3.4439 -2.8289 -2.8289 -2.1738 -2.1738 -1.8893 -1.8893 -1.5717 -1.5717 -0.6411 -0.6411 -0.3760 -0.3760 -0.1282 -0.1282 0.1962 0.1962 2.8358 2.8358 3.1921 3.1921 3.5073 3.5073 4.4271 4.4271 5.5845 5.5845 6.0196 6.0197 6.2911 6.2911 6.4084 6.4084 13.8214 13.8214 k = 0.2596-0.0915 0.3000 ( 2646 PWs) bands (ev): -22.6042 -22.6042 -21.9711 -21.9711 -21.4634 -21.4634 -21.0534 -21.0534 -10.3015 -10.3015 -9.7322 -9.7322 -9.0027 -9.0027 -8.5732 -8.5732 -4.6657 -4.6657 -4.0721 -4.0721 -3.7031 -3.7031 -3.5134 -3.5134 -2.8306 -2.8306 -2.1767 -2.1767 -1.9132 -1.9132 -1.5574 -1.5574 -0.5992 -0.5992 -0.3547 -0.3547 -0.1169 -0.1169 0.1948 0.1948 2.8327 2.8327 3.1685 3.1685 3.4769 3.4769 4.4440 4.4440 5.6112 5.6112 6.0292 6.0292 6.2827 6.2827 6.3970 6.3970 13.8635 13.8635 k = 0.2500-0.0881 0.2889 ( 2643 PWs) bands (ev): -22.6162 -22.6162 -21.9664 -21.9664 -21.4621 -21.4621 -21.0516 -21.0516 -10.2672 -10.2672 -9.6958 -9.6958 -9.0044 -9.0044 -8.5813 -8.5813 -4.6721 -4.6721 -4.1063 -4.1063 -3.7097 -3.7097 -3.5829 -3.5829 -2.8328 -2.8328 -2.1811 -2.1811 -1.9387 -1.9387 -1.5421 -1.5421 -0.5582 -0.5582 -0.3338 -0.3338 -0.1052 -0.1052 0.1934 0.1934 2.8302 2.8302 3.1449 3.1449 3.4473 3.4473 4.4626 4.4626 5.6372 5.6372 6.0383 6.0383 6.2743 6.2743 6.3857 6.3857 13.9044 13.9044 k = 0.2404-0.0847 0.2778 ( 2642 PWs) bands (ev): -22.6280 -22.6280 -21.9619 -21.9619 -21.4608 -21.4608 -21.0497 -21.0497 -10.2321 -10.2321 -9.6592 -9.6592 -9.0062 -9.0062 -8.5895 -8.5895 -4.6773 -4.6773 -4.1399 -4.1399 -3.7159 -3.7159 -3.6521 -3.6521 -2.8355 -2.8355 -2.1869 -2.1869 -1.9656 -1.9656 -1.5262 -1.5262 -0.5181 -0.5181 -0.3134 -0.3134 -0.0932 -0.0932 0.1919 0.1919 2.8282 2.8282 3.1216 3.1216 3.4184 3.4184 4.4825 4.4825 5.6626 5.6626 6.0470 6.0470 6.2659 6.2659 6.3744 6.3744 13.9439 13.9439 k = 0.2308-0.0814 0.2667 ( 2643 PWs) bands (ev): -22.6395 -22.6395 -21.9576 -21.9576 -21.4596 -21.4596 -21.0479 -21.0479 -10.1966 -10.1966 -9.6225 -9.6225 -9.0081 -9.0081 -8.5975 -8.5975 -4.6814 -4.6814 -4.1727 -4.1727 -3.7255 -3.7255 -3.7171 -3.7171 -2.8389 -2.8389 -2.1941 -2.1941 -1.9934 -1.9934 -1.5099 -1.5099 -0.4791 -0.4791 -0.2936 -0.2936 -0.0809 -0.0809 0.1903 0.1903 2.8263 2.8263 3.0989 3.0989 3.3905 3.3905 4.5035 4.5035 5.6871 5.6871 6.0552 6.0552 6.2575 6.2575 6.3633 6.3633 13.9819 13.9819 k = 0.2212-0.0780 0.2556 ( 2642 PWs) bands (ev): -22.6507 -22.6507 -21.9535 -21.9535 -21.4583 -21.4583 -21.0461 -21.0461 -10.1606 -10.1606 -9.5859 -9.5859 -9.0100 -9.0100 -8.6056 -8.6056 -4.6846 -4.6846 -4.2046 -4.2046 -3.7897 -3.7897 -3.7264 -3.7264 -2.8431 -2.8431 -2.2025 -2.2025 -2.0218 -2.0218 -1.4935 -1.4935 -0.4412 -0.4412 -0.2744 -0.2744 -0.0683 -0.0683 0.1887 0.1887 2.8242 2.8242 3.0771 3.0771 3.3637 3.3637 4.5255 4.5255 5.7108 5.7108 6.0630 6.0630 6.2491 6.2491 6.3524 6.3524 14.0180 14.0180 k = 0.2115-0.0746 0.2445 ( 2639 PWs) bands (ev): -22.6616 -22.6616 -21.9497 -21.9497 -21.4570 -21.4570 -21.0444 -21.0444 -10.1242 -10.1242 -9.5496 -9.5496 -9.0120 -9.0120 -8.6135 -8.6135 -4.6868 -4.6868 -4.2353 -4.2353 -3.8568 -3.8568 -3.7317 -3.7317 -2.8481 -2.8481 -2.2123 -2.2123 -2.0502 -2.0502 -1.4773 -1.4773 -0.4045 -0.4045 -0.2559 -0.2559 -0.0556 -0.0556 0.1871 0.1871 2.8217 2.8217 3.0567 3.0567 3.3381 3.3381 4.5482 4.5482 5.7336 5.7336 6.0702 6.0702 6.2408 6.2408 6.3419 6.3419 14.0522 14.0522 k = 0.2019-0.0712 0.2334 ( 2640 PWs) bands (ev): -22.6722 -22.6722 -21.9460 -21.9460 -21.4558 -21.4558 -21.0426 -21.0426 -10.0877 -10.0877 -9.5136 -9.5136 -9.0140 -9.0140 -8.6212 -8.6212 -4.6883 -4.6883 -4.2649 -4.2649 -3.9226 -3.9226 -3.7366 -3.7366 -2.8540 -2.8540 -2.2233 -2.2233 -2.0783 -2.0783 -1.4613 -1.4613 -0.3691 -0.3691 -0.2379 -0.2379 -0.0428 -0.0428 0.1854 0.1854 2.8183 2.8183 3.0382 3.0382 3.3138 3.3138 4.5715 4.5715 5.7555 5.7555 6.0769 6.0769 6.2325 6.2325 6.3318 6.3318 14.0843 14.0843 k = 0.1923-0.0678 0.2222 ( 2642 PWs) bands (ev): -22.6824 -22.6824 -21.9426 -21.9426 -21.4546 -21.4546 -21.0410 -21.0410 -10.0511 -10.0511 -9.4781 -9.4781 -9.0161 -9.0161 -8.6288 -8.6288 -4.6892 -4.6892 -4.2933 -4.2933 -3.9868 -3.9868 -3.7413 -3.7413 -2.8609 -2.8609 -2.2359 -2.2359 -2.1053 -2.1053 -1.4457 -1.4457 -0.3352 -0.3352 -0.2206 -0.2206 -0.0301 -0.0301 0.1838 0.1838 2.8136 2.8136 3.0218 3.0218 3.2911 3.2911 4.5951 4.5951 5.7765 5.7765 6.0831 6.0831 6.2243 6.2243 6.3222 6.3222 14.1141 14.1141 k = 0.1827-0.0644 0.2111 ( 2643 PWs) bands (ev): -22.6922 -22.6922 -21.9393 -21.9393 -21.4534 -21.4534 -21.0393 -21.0393 -10.0146 -10.0146 -9.4433 -9.4433 -9.0181 -9.0181 -8.6363 -8.6363 -4.6897 -4.6897 -4.3204 -4.3204 -4.0490 -4.0490 -3.7457 -3.7457 -2.8688 -2.8688 -2.2503 -2.2503 -2.1307 -2.1307 -1.4307 -1.4307 -0.3029 -0.3029 -0.2039 -0.2039 -0.0174 -0.0174 0.1823 0.1823 2.8072 2.8072 3.0081 3.0081 3.2698 3.2698 4.6189 4.6189 5.7964 5.7964 6.0887 6.0887 6.2162 6.2162 6.3133 6.3133 14.1416 14.1416 k = 0.1731-0.0610 0.2000 ( 2643 PWs) bands (ev): -22.7017 -22.7017 -21.9363 -21.9363 -21.4522 -21.4522 -21.0377 -21.0377 -9.9784 -9.9784 -9.4094 -9.4094 -9.0200 -9.0200 -8.6435 -8.6435 -4.6902 -4.6902 -4.3462 -4.3462 -4.1088 -4.1088 -3.7499 -3.7499 -2.8777 -2.8777 -2.2668 -2.2668 -2.1537 -2.1537 -1.4164 -1.4164 -0.2722 -0.2722 -0.1877 -0.1877 -0.0051 -0.0051 0.1810 0.1810 2.7988 2.7988 2.9972 2.9972 3.2501 3.2501 4.6426 4.6426 5.8153 5.8153 6.0936 6.0936 6.2082 6.2082 6.3050 6.3050 14.1665 14.1665 k = 0.1635-0.0576 0.1889 ( 2643 PWs) bands (ev): -22.7107 -22.7107 -21.9334 -21.9334 -21.4511 -21.4511 -21.0362 -21.0362 -9.9425 -9.9425 -9.3766 -9.3766 -9.0217 -9.0217 -8.6505 -8.6505 -4.6909 -4.6909 -4.3707 -4.3707 -4.1655 -4.1655 -3.7538 -3.7538 -2.8876 -2.8876 -2.2856 -2.2856 -2.1736 -2.1736 -1.4028 -1.4028 -0.2433 -0.2433 -0.1718 -0.1718 0.0067 0.0067 0.1798 0.1798 2.7885 2.7885 2.9891 2.9891 3.2320 3.2320 4.6663 4.6663 5.8332 5.8332 6.0978 6.0978 6.2004 6.2004 6.2976 6.2976 14.1890 14.1890 k = 0.1538-0.0542 0.1778 ( 2638 PWs) bands (ev): -22.7193 -22.7193 -21.9308 -21.9308 -21.4500 -21.4500 -21.0348 -21.0348 -9.9072 -9.9072 -9.3449 -9.3449 -9.0232 -9.0232 -8.6573 -8.6573 -4.6924 -4.6924 -4.3940 -4.3940 -4.2185 -4.2185 -3.7576 -3.7576 -2.8984 -2.8984 -2.3066 -2.3066 -2.1904 -2.1904 -1.3900 -1.3900 -0.2164 -0.2164 -0.1562 -0.1562 0.0180 0.0180 0.1790 0.1790 2.7764 2.7764 2.9837 2.9837 3.2156 3.2156 4.6896 4.6896 5.8500 5.8500 6.1012 6.1012 6.1928 6.1928 6.2911 6.2911 14.2089 14.2089 k = 0.1442-0.0508 0.1667 ( 2638 PWs) bands (ev): -22.7275 -22.7275 -21.9283 -21.9283 -21.4490 -21.4490 -21.0334 -21.0334 -9.8726 -9.8726 -9.3147 -9.3147 -9.0244 -9.0244 -8.6638 -8.6638 -4.6951 -4.6951 -4.4161 -4.4161 -4.2672 -4.2672 -3.7612 -3.7612 -2.9101 -2.9101 -2.3292 -2.3292 -2.2043 -2.2043 -1.3780 -1.3780 -0.1918 -0.1918 -0.1406 -0.1406 0.0284 0.0284 0.1785 0.1785 2.7630 2.7630 2.9804 2.9804 3.2009 3.2009 4.7124 4.7124 5.8657 5.8657 6.1035 6.1035 6.1856 6.1856 6.2855 6.2855 14.2264 14.2264 k = 0.1346-0.0475 0.1556 ( 2637 PWs) bands (ev): -22.7352 -22.7352 -21.9260 -21.9260 -21.4480 -21.4480 -21.0321 -21.0321 -9.8390 -9.8390 -9.2862 -9.2862 -9.0251 -9.0251 -8.6700 -8.6700 -4.6997 -4.6997 -4.4373 -4.4373 -4.3105 -4.3105 -3.7646 -3.7646 -2.9225 -2.9225 -2.3528 -2.3528 -2.2157 -2.2157 -1.3670 -1.3670 -0.1696 -0.1696 -0.1247 -0.1247 0.0379 0.0379 0.1785 0.1785 2.7487 2.7487 2.9787 2.9787 3.1879 3.1879 4.7347 4.7347 5.8803 5.8803 6.1048 6.1048 6.1790 6.1790 6.2809 6.2809 14.2414 14.2414 k = 0.1250-0.0441 0.1445 ( 2638 PWs) bands (ev): -22.7425 -22.7425 -21.9238 -21.9238 -21.4471 -21.4471 -21.0308 -21.0308 -9.8065 -9.8065 -9.2595 -9.2595 -9.0253 -9.0253 -8.6760 -8.6760 -4.7068 -4.7068 -4.4576 -4.4576 -4.3476 -4.3476 -3.7678 -3.7678 -2.9356 -2.9356 -2.3766 -2.3766 -2.2250 -2.2250 -1.3569 -1.3569 -0.1502 -0.1502 -0.1085 -0.1085 0.0462 0.0462 0.1791 0.1791 2.7340 2.7340 2.9782 2.9782 3.1765 3.1765 4.7561 4.7561 5.8939 5.8939 6.1047 6.1047 6.1731 6.1731 6.2773 6.2773 14.2540 14.2540 k = 0.1154-0.0407 0.1333 ( 2639 PWs) bands (ev): -22.7492 -22.7492 -21.9219 -21.9219 -21.4462 -21.4462 -21.0297 -21.0297 -9.7753 -9.7753 -9.2350 -9.2350 -9.0248 -9.0248 -8.6818 -8.6818 -4.7171 -4.7171 -4.4769 -4.4769 -4.3779 -4.3779 -3.7709 -3.7709 -2.9490 -2.9490 -2.4001 -2.4001 -2.2327 -2.2327 -1.3476 -1.3476 -0.1333 -0.1333 -0.0920 -0.0920 0.0532 0.0532 0.1803 0.1803 2.7193 2.7193 2.9785 2.9785 3.1668 3.1668 4.7767 4.7767 5.9065 5.9065 6.1032 6.1032 6.1682 6.1682 6.2746 6.2746 14.2643 14.2643 k = 0.1058-0.0373 0.1222 ( 2634 PWs) bands (ev): -22.7555 -22.7555 -21.9201 -21.9201 -21.4454 -21.4454 -21.0286 -21.0286 -9.7456 -9.7456 -9.2129 -9.2129 -9.0233 -9.0233 -8.6872 -8.6872 -4.7308 -4.7308 -4.4949 -4.4949 -4.4014 -4.4014 -3.7738 -3.7738 -2.9626 -2.9626 -2.4229 -2.4229 -2.2390 -2.2390 -1.3393 -1.3393 -0.1186 -0.1186 -0.0756 -0.0756 0.0589 0.0589 0.1822 0.1822 2.7049 2.7049 2.9791 2.9791 3.1587 3.1587 4.7962 4.7962 5.9182 5.9182 6.1003 6.1003 6.1642 6.1642 6.2728 6.2728 14.2726 14.2726 k = 0.0962-0.0339 0.1111 ( 2629 PWs) bands (ev): -22.7613 -22.7613 -21.9185 -21.9185 -21.4446 -21.4446 -21.0276 -21.0276 -9.7176 -9.7176 -9.1935 -9.1935 -9.0208 -9.0208 -8.6924 -8.6924 -4.7478 -4.7478 -4.5109 -4.5109 -4.4188 -4.4188 -3.7765 -3.7765 -2.9762 -2.9762 -2.4446 -2.4446 -2.2441 -2.2441 -1.3318 -1.3318 -0.1056 -0.1056 -0.0600 -0.0600 0.0632 0.0632 0.1848 0.1848 2.6911 2.6911 2.9798 2.9798 3.1520 3.1520 4.8145 4.8145 5.9290 5.9290 6.0960 6.0960 6.1612 6.1612 6.2718 6.2718 14.2791 14.2791 k = 0.0865-0.0305 0.1000 ( 2626 PWs) bands (ev): -22.7665 -22.7665 -21.9170 -21.9170 -21.4439 -21.4439 -21.0267 -21.0267 -9.6914 -9.6914 -9.1769 -9.1769 -9.0171 -9.0171 -8.6972 -8.6972 -4.7672 -4.7672 -4.5248 -4.5248 -4.4312 -4.4312 -3.7790 -3.7790 -2.9895 -2.9895 -2.4648 -2.4648 -2.2484 -2.2484 -1.3252 -1.3252 -0.0941 -0.0941 -0.0453 -0.0453 0.0662 0.0662 0.1879 0.1879 2.6781 2.6781 2.9805 2.9805 3.1468 3.1468 4.8315 4.8315 5.9390 5.9390 6.0907 6.0907 6.1590 6.1590 6.2714 6.2714 14.2838 14.2838 k = 0.0769-0.0271 0.0889 ( 2627 PWs) bands (ev): -22.7712 -22.7712 -21.9157 -21.9157 -21.4433 -21.4433 -21.0258 -21.0258 -9.6674 -9.6674 -9.1633 -9.1633 -9.0123 -9.0123 -8.7018 -8.7018 -4.7881 -4.7881 -4.5364 -4.5364 -4.4396 -4.4396 -3.7814 -3.7814 -3.0022 -3.0022 -2.4834 -2.4834 -2.2518 -2.2518 -1.3194 -1.3194 -0.0836 -0.0836 -0.0321 -0.0321 0.0681 0.0681 0.1913 0.1913 2.6662 2.6662 2.9810 2.9810 3.1428 3.1428 4.8471 4.8471 5.9483 5.9483 6.0845 6.0845 6.1574 6.1574 6.2715 6.2715 14.2871 14.2871 k = 0.0673-0.0237 0.0778 ( 2625 PWs) bands (ev): -22.7754 -22.7754 -21.9146 -21.9146 -21.4427 -21.4427 -21.0251 -21.0251 -9.6457 -9.6457 -9.1525 -9.1525 -9.0065 -9.0065 -8.7060 -8.7060 -4.8091 -4.8091 -4.5460 -4.5460 -4.4449 -4.4449 -3.7835 -3.7835 -3.0142 -3.0142 -2.5003 -2.5003 -2.2546 -2.2546 -1.3144 -1.3144 -0.0742 -0.0742 -0.0204 -0.0204 0.0691 0.0691 0.1950 0.1950 2.6554 2.6554 2.9813 2.9813 3.1398 3.1398 4.8612 4.8612 5.9569 5.9569 6.0778 6.0778 6.1563 6.1563 6.2721 6.2721 14.2893 14.2893 k = 0.0577-0.0203 0.0667 ( 2625 PWs) bands (ev): -22.7791 -22.7791 -21.9136 -21.9136 -21.4422 -21.4422 -21.0245 -21.0245 -9.6264 -9.6264 -9.1442 -9.1442 -9.0000 -9.0000 -8.7098 -8.7098 -4.8292 -4.8292 -4.5540 -4.5540 -4.4481 -4.4481 -3.7854 -3.7854 -3.0251 -3.0251 -2.5151 -2.5151 -2.2567 -2.2567 -1.3102 -1.3102 -0.0657 -0.0657 -0.0104 -0.0104 0.0695 0.0695 0.1986 0.1986 2.6458 2.6458 2.9814 2.9814 3.1378 3.1378 4.8736 4.8736 5.9649 5.9649 6.0708 6.0708 6.1555 6.1555 6.2728 6.2728 14.2905 14.2906 k = 0.0481-0.0169 0.0556 ( 2629 PWs) bands (ev): -22.7822 -22.7822 -21.9128 -21.9128 -21.4418 -21.4418 -21.0240 -21.0240 -9.6098 -9.6098 -9.1382 -9.1382 -8.9935 -8.9935 -8.7131 -8.7131 -4.8475 -4.8475 -4.5604 -4.5604 -4.4497 -4.4497 -3.7871 -3.7871 -3.0348 -3.0348 -2.5279 -2.5279 -2.2584 -2.2584 -1.3066 -1.3066 -0.0582 -0.0582 -0.0021 -0.0021 0.0695 0.0695 0.2019 0.2019 2.6376 2.6376 2.9813 2.9813 3.1365 3.1365 4.8843 4.8843 5.9724 5.9724 6.0639 6.0639 6.1549 6.1549 6.2737 6.2737 14.2911 14.2911 k = 0.0385-0.0136 0.0444 ( 2626 PWs) bands (ev): -22.7847 -22.7847 -21.9121 -21.9121 -21.4415 -21.4415 -21.0235 -21.0235 -9.5960 -9.5960 -9.1339 -9.1339 -8.9873 -8.9873 -8.7160 -8.7160 -4.8632 -4.8632 -4.5656 -4.5656 -4.4504 -4.4504 -3.7885 -3.7885 -3.0430 -3.0430 -2.5385 -2.5385 -2.2597 -2.2597 -1.3038 -1.3038 -0.0518 -0.0518 0.0044 0.0044 0.0692 0.0692 0.2049 0.2049 2.6308 2.6308 2.9811 2.9811 3.1356 3.1356 4.8931 4.8931 5.9792 5.9792 6.0572 6.0572 6.1545 6.1545 6.2746 6.2746 14.2913 14.2913 k = 0.0288-0.0102 0.0333 ( 2624 PWs) bands (ev): -22.7867 -22.7867 -21.9116 -21.9116 -21.4412 -21.4412 -21.0232 -21.0232 -9.5851 -9.5851 -9.1309 -9.1309 -8.9820 -8.9820 -8.7184 -8.7184 -4.8760 -4.8760 -4.5695 -4.5695 -4.4505 -4.4505 -3.7896 -3.7896 -3.0496 -3.0496 -2.5468 -2.5468 -2.2607 -2.2607 -1.3016 -1.3016 -0.0466 -0.0466 0.0092 0.0092 0.0690 0.0690 0.2074 0.2074 2.6254 2.6254 2.9809 2.9809 3.1352 3.1352 4.9001 4.9001 5.9853 5.9853 6.0511 6.0511 6.1542 6.1542 6.2754 6.2754 14.2912 14.2912 k = 0.0192-0.0068 0.0222 ( 2622 PWs) bands (ev): -22.7881 -22.7881 -21.9112 -21.9112 -21.4410 -21.4410 -21.0229 -21.0229 -9.5772 -9.5772 -9.1290 -9.1290 -8.9779 -8.9779 -8.7201 -8.7201 -4.8853 -4.8853 -4.5722 -4.5722 -4.4503 -4.4503 -3.7904 -3.7904 -3.0544 -3.0544 -2.5527 -2.5527 -2.2613 -2.2613 -1.3001 -1.3001 -0.0426 -0.0426 0.0124 0.0124 0.0688 0.0688 0.2092 0.2092 2.6216 2.6216 2.9807 2.9807 3.1350 3.1350 4.9051 4.9051 5.9904 5.9904 6.0459 6.0459 6.1540 6.1540 6.2760 6.2760 14.2910 14.2910 k = 0.0096-0.0034 0.0111 ( 2622 PWs) bands (ev): -22.7889 -22.7889 -21.9110 -21.9110 -21.4409 -21.4409 -21.0228 -21.0228 -9.5725 -9.5725 -9.1280 -9.1280 -8.9753 -8.9753 -8.7211 -8.7211 -4.8910 -4.8910 -4.5739 -4.5739 -4.4502 -4.4502 -3.7909 -3.7909 -3.0573 -3.0573 -2.5563 -2.5563 -2.2617 -2.2617 -1.2992 -1.2992 -0.0402 -0.0402 0.0142 0.0142 0.0686 0.0686 0.2103 0.2103 2.6193 2.6193 2.9806 2.9806 3.1349 3.1349 4.9081 4.9081 5.9940 5.9940 6.0422 6.0422 6.1538 6.1538 6.2764 6.2764 14.2908 14.2909 k = 0.0000 0.0000 0.0000 ( 2619 PWs) bands (ev): -22.7892 -22.7892 -21.9109 -21.9109 -21.4408 -21.4408 -21.0227 -21.0227 -9.5709 -9.5709 -9.1277 -9.1277 -8.9744 -8.9744 -8.7215 -8.7215 -4.8929 -4.8929 -4.5744 -4.5744 -4.4501 -4.4501 -3.7911 -3.7911 -3.0583 -3.0583 -2.5576 -2.5576 -2.2618 -2.2618 -1.2989 -1.2989 -0.0394 -0.0394 0.0148 0.0148 0.0686 0.0686 0.2107 0.2107 2.6185 2.6185 2.9805 2.9805 3.1348 3.1348 4.9091 4.9091 5.9953 5.9953 6.0409 6.0409 6.1538 6.1538 6.2766 6.2766 14.2908 14.2908 Writing output data file O2.save init_run : 0.06s CPU 0.18s WALL ( 1 calls) electrons : 251.27s CPU 255.50s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 251.26s CPU 255.50s 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 : 0.00s CPU 0.01s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.02s WALL ( 343 calls) cegterg : 242.85s CPU 246.60s WALL ( 1178 calls) Called by sum_band: Called by *egterg: h_psi : 76.81s CPU 78.65s WALL ( 22277 calls) s_psi : 3.79s CPU 3.86s WALL ( 22277 calls) g_psi : 0.21s CPU 0.24s WALL ( 20756 calls) cdiaghg : 148.75s CPU 150.78s WALL ( 21099 calls) cegterg:over : 6.80s CPU 6.91s WALL ( 20756 calls) cegterg:upda : 5.24s CPU 5.33s WALL ( 20756 calls) cegterg:last : 2.62s CPU 2.63s WALL ( 1864 calls) cdiaghg:chol : 7.72s CPU 7.54s WALL ( 21099 calls) cdiaghg:inve : 5.46s CPU 5.51s WALL ( 21099 calls) cdiaghg:para : 8.10s CPU 8.34s WALL ( 42198 calls) Called by h_psi: h_psi:vloc : 66.62s CPU 68.37s WALL ( 22277 calls) h_psi:vnl : 9.90s CPU 10.02s WALL ( 22277 calls) add_vuspsi : 3.93s CPU 3.96s WALL ( 22277 calls) General routines calbec : 5.88s CPU 6.00s WALL ( 22277 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 61.29s CPU 62.70s WALL ( 1256376 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.14s CPU 0.17s WALL ( 686 calls) Parallel routines fft_scatter : 29.75s CPU 30.01s WALL ( 1256399 calls) PWSCF : 4m25.74s CPU 4m49.24s WALL This run was terminated on: 21: 9: 7 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=