Program PWSCF v.5.4.0 starts on 10Feb2017 at 15:46:55 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 & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 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: ./FeCu2GeS4.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group 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 73 57 16 1724 1164 180 Max 74 58 17 1729 1190 181 Sum 2659 2065 591 62165 42415 6491 bravais-lattice index = 14 lattice parameter (alat) = 12.2166 a.u. unit-cell volume = 1005.5611 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 4 number of electrons = 58.00 number of Kohn-Sham states= 70 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.216583 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.660760 celldm(5)= -0.660760 celldm(6)= 0.321520 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.321520 0.946903 0.000000 ) a(3) = ( -0.660760 -0.473451 0.582443 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.339549 0.858453 ) b(2) = ( 0.000000 1.056074 0.858453 ) b(3) = ( 0.000000 0.000000 1.716905 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) S 6.00 32.06500 S( 1.00) Fe 8.00 55.84500 Fe( 1.00) Cu 11.00 63.54600 Cu( 1.00) 2 Sym. Ops. (no 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 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E s 2 inv. 180 deg rotation - cart. axis [0,0,1] -s -2 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 289 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034602 k( 2) = ( 0.0000000 0.0000000 0.0204393), wk = 0.0034602 k( 3) = ( 0.0000000 0.0000000 0.0408787), wk = 0.0034602 k( 4) = ( 0.0000000 0.0000000 0.0613181), wk = 0.0034602 k( 5) = ( 0.0000000 0.0000000 0.0817574), wk = 0.0034602 k( 6) = ( 0.0000000 0.0000000 0.1021967), wk = 0.0034602 k( 7) = ( 0.0000000 0.0000000 0.1226361), wk = 0.0034602 k( 8) = ( 0.0000000 0.0000000 0.1430754), wk = 0.0034602 k( 9) = ( 0.0000000 0.0000000 0.1635148), wk = 0.0034602 k( 10) = ( 0.0000000 0.0000000 0.1839541), wk = 0.0034602 k( 11) = ( 0.0000000 0.0000000 0.2043935), wk = 0.0034602 k( 12) = ( 0.0000000 0.0000000 0.2248328), wk = 0.0034602 k( 13) = ( 0.0000000 0.0000000 0.2452722), wk = 0.0034602 k( 14) = ( 0.0000000 0.0000000 0.2657115), wk = 0.0034602 k( 15) = ( 0.0000000 0.0000000 0.2861509), wk = 0.0034602 k( 16) = ( 0.0000000 0.0000000 0.3065902), wk = 0.0034602 k( 17) = ( 0.0000000 0.0000000 0.3270296), wk = 0.0034602 k( 18) = ( 0.0000000 0.0000000 0.3474689), wk = 0.0034602 k( 19) = ( 0.0000000 0.0000000 0.3679082), wk = 0.0034602 k( 20) = ( 0.0000000 0.0000000 0.3883476), wk = 0.0034602 k( 21) = ( 0.0000000 0.0000000 0.4087870), wk = 0.0034602 k( 22) = ( 0.0000000 0.0000000 0.4292263), wk = 0.0034602 k( 23) = ( 0.0000000 0.0000000 0.4496656), wk = 0.0034602 k( 24) = ( 0.0000000 0.0000000 0.4701050), wk = 0.0034602 k( 25) = ( 0.0000000 0.0000000 0.4905443), wk = 0.0034602 k( 26) = ( 0.0000000 0.0000000 0.5109837), wk = 0.0034602 k( 27) = ( 0.0000000 0.0000000 0.5314230), wk = 0.0034602 k( 28) = ( 0.0000000 0.0000000 0.5518624), wk = 0.0034602 k( 29) = ( 0.0000000 0.0000000 0.5723017), wk = 0.0034602 k( 30) = ( 0.0000000 0.0000000 0.5927411), wk = 0.0034602 k( 31) = ( 0.0000000 0.0000000 0.6131804), wk = 0.0034602 k( 32) = ( 0.0000000 0.0000000 0.6336198), wk = 0.0034602 k( 33) = ( 0.0000000 0.0000000 0.6540591), wk = 0.0034602 k( 34) = ( 0.0000000 0.0000000 0.6744985), wk = 0.0034602 k( 35) = ( 0.0000000 0.0000000 0.6949378), wk = 0.0034602 k( 36) = ( 0.0000000 0.0000000 0.7153772), wk = 0.0034602 k( 37) = ( 0.0000000 0.0000000 0.7358165), wk = 0.0034602 k( 38) = ( 0.0000000 0.0000000 0.7562559), wk = 0.0034602 k( 39) = ( 0.0000000 0.0000000 0.7766952), wk = 0.0034602 k( 40) = ( 0.0000000 0.0000000 0.7971345), wk = 0.0034602 k( 41) = ( 0.0000000 0.0000000 0.8175739), wk = 0.0034602 k( 42) = ( 0.0000000 0.0000000 0.8380133), wk = 0.0034602 k( 43) = ( 0.0000000 0.0000000 0.8584526), wk = 0.0034602 k( 44) = ( 0.0000000 0.0000000 0.8584526), wk = 0.0034602 k( 45) = ( -0.0116684 0.0162847 0.8584526), wk = 0.0034602 k( 46) = ( -0.0233368 0.0325694 0.8584526), wk = 0.0034602 k( 47) = ( -0.0350052 0.0488540 0.8584526), wk = 0.0034602 k( 48) = ( -0.0466736 0.0651387 0.8584526), wk = 0.0034602 k( 49) = ( -0.0583420 0.0814234 0.8584526), wk = 0.0034602 k( 50) = ( -0.0700104 0.0977081 0.8584526), wk = 0.0034602 k( 51) = ( -0.0816788 0.1139928 0.8584526), wk = 0.0034602 k( 52) = ( -0.0933472 0.1302774 0.8584526), wk = 0.0034602 k( 53) = ( -0.1050155 0.1465621 0.8584526), wk = 0.0034602 k( 54) = ( -0.1166839 0.1628468 0.8584526), wk = 0.0034602 k( 55) = ( -0.1283523 0.1791315 0.8584526), wk = 0.0034602 k( 56) = ( -0.1283523 0.1791315 0.8584526), wk = 0.0034602 k( 57) = ( -0.1367989 0.1909197 0.8439507), wk = 0.0034602 k( 58) = ( -0.1452454 0.2027078 0.8294488), wk = 0.0034602 k( 59) = ( -0.1536919 0.2144960 0.8149469), wk = 0.0034602 k( 60) = ( -0.1621385 0.2262842 0.8004450), wk = 0.0034602 k( 61) = ( -0.1705850 0.2380724 0.7859431), wk = 0.0034602 k( 62) = ( -0.1790316 0.2498606 0.7714412), wk = 0.0034602 k( 63) = ( -0.1874781 0.2616488 0.7569393), wk = 0.0034602 k( 64) = ( -0.1959246 0.2734369 0.7424374), wk = 0.0034602 k( 65) = ( -0.2043712 0.2852251 0.7279355), wk = 0.0034602 k( 66) = ( -0.2128177 0.2970133 0.7134335), wk = 0.0034602 k( 67) = ( -0.2212643 0.3088015 0.6989317), wk = 0.0034602 k( 68) = ( -0.2297108 0.3205897 0.6844297), wk = 0.0034602 k( 69) = ( -0.2381573 0.3323778 0.6699278), wk = 0.0034602 k( 70) = ( -0.2466039 0.3441660 0.6554259), wk = 0.0034602 k( 71) = ( -0.2550504 0.3559542 0.6409240), wk = 0.0034602 k( 72) = ( -0.2634969 0.3677424 0.6264221), wk = 0.0034602 k( 73) = ( -0.2719435 0.3795306 0.6119202), wk = 0.0034602 k( 74) = ( -0.2803900 0.3913188 0.5974183), wk = 0.0034602 k( 75) = ( -0.2888366 0.4031069 0.5829164), wk = 0.0034602 k( 76) = ( -0.2972831 0.4148951 0.5684145), wk = 0.0034602 k( 77) = ( -0.3057296 0.4266833 0.5539126), wk = 0.0034602 k( 78) = ( -0.3141762 0.4384715 0.5394107), wk = 0.0034602 k( 79) = ( -0.3141762 0.4384715 0.5394107), wk = 0.0034602 k( 80) = ( -0.3059084 0.4269328 0.5252157), wk = 0.0034602 k( 81) = ( -0.2976406 0.4153940 0.5110207), wk = 0.0034602 k( 82) = ( -0.2893728 0.4038553 0.4968256), wk = 0.0034602 k( 83) = ( -0.2811050 0.3923166 0.4826306), wk = 0.0034602 k( 84) = ( -0.2728372 0.3807779 0.4684356), wk = 0.0034602 k( 85) = ( -0.2645694 0.3692391 0.4542406), wk = 0.0034602 k( 86) = ( -0.2563016 0.3577004 0.4400456), wk = 0.0034602 k( 87) = ( -0.2480338 0.3461617 0.4258506), wk = 0.0034602 k( 88) = ( -0.2397660 0.3346230 0.4116555), wk = 0.0034602 k( 89) = ( -0.2314982 0.3230842 0.3974605), wk = 0.0034602 k( 90) = ( -0.2232304 0.3115455 0.3832655), wk = 0.0034602 k( 91) = ( -0.2149626 0.3000068 0.3690705), wk = 0.0034602 k( 92) = ( -0.2066949 0.2884681 0.3548755), wk = 0.0034602 k( 93) = ( -0.1984271 0.2769294 0.3406805), wk = 0.0034602 k( 94) = ( -0.1901593 0.2653906 0.3264854), wk = 0.0034602 k( 95) = ( -0.1818915 0.2538519 0.3122904), wk = 0.0034602 k( 96) = ( -0.1736237 0.2423132 0.2980954), wk = 0.0034602 k( 97) = ( -0.1653559 0.2307745 0.2839004), wk = 0.0034602 k( 98) = ( -0.1570881 0.2192357 0.2697054), wk = 0.0034602 k( 99) = ( -0.1488203 0.2076970 0.2555103), wk = 0.0034602 k( 100) = ( -0.1405525 0.1961583 0.2413153), wk = 0.0034602 k( 101) = ( -0.1322847 0.1846196 0.2271203), wk = 0.0034602 k( 102) = ( -0.1240169 0.1730808 0.2129253), wk = 0.0034602 k( 103) = ( -0.1157491 0.1615421 0.1987303), wk = 0.0034602 k( 104) = ( -0.1074813 0.1500034 0.1845352), wk = 0.0034602 k( 105) = ( -0.0992135 0.1384647 0.1703402), wk = 0.0034602 k( 106) = ( -0.0909457 0.1269259 0.1561452), wk = 0.0034602 k( 107) = ( -0.0826779 0.1153872 0.1419502), wk = 0.0034602 k( 108) = ( -0.0744101 0.1038485 0.1277552), wk = 0.0034602 k( 109) = ( -0.0661424 0.0923098 0.1135601), wk = 0.0034602 k( 110) = ( -0.0578746 0.0807711 0.0993651), wk = 0.0034602 k( 111) = ( -0.0496068 0.0692323 0.0851701), wk = 0.0034602 k( 112) = ( -0.0413390 0.0576936 0.0709751), wk = 0.0034602 k( 113) = ( -0.0330712 0.0461549 0.0567801), wk = 0.0034602 k( 114) = ( -0.0248034 0.0346162 0.0425851), wk = 0.0034602 k( 115) = ( -0.0165356 0.0230774 0.0283900), wk = 0.0034602 k( 116) = ( -0.0082678 0.0115387 0.0141950), wk = 0.0034602 k( 117) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034602 k( 118) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034602 k( 119) = ( 0.0166667 0.0119421 -0.0000000), wk = 0.0034602 k( 120) = ( 0.0333333 0.0238842 -0.0000000), wk = 0.0034602 k( 121) = ( 0.0500000 0.0358263 -0.0000000), wk = 0.0034602 k( 122) = ( 0.0666667 0.0477684 -0.0000000), wk = 0.0034602 k( 123) = ( 0.0833333 0.0597105 -0.0000000), wk = 0.0034602 k( 124) = ( 0.1000000 0.0716526 -0.0000000), wk = 0.0034602 k( 125) = ( 0.1166667 0.0835947 -0.0000000), wk = 0.0034602 k( 126) = ( 0.1333333 0.0955368 -0.0000000), wk = 0.0034602 k( 127) = ( 0.1500000 0.1074789 -0.0000000), wk = 0.0034602 k( 128) = ( 0.1666667 0.1194210 -0.0000000), wk = 0.0034602 k( 129) = ( 0.1833333 0.1313631 -0.0000000), wk = 0.0034602 k( 130) = ( 0.2000000 0.1433052 -0.0000000), wk = 0.0034602 k( 131) = ( 0.2166667 0.1552473 -0.0000000), wk = 0.0034602 k( 132) = ( 0.2333333 0.1671894 -0.0000000), wk = 0.0034602 k( 133) = ( 0.2500000 0.1791315 -0.0000000), wk = 0.0034602 k( 134) = ( 0.2666667 0.1910736 -0.0000000), wk = 0.0034602 k( 135) = ( 0.2833333 0.2030157 -0.0000000), wk = 0.0034602 k( 136) = ( 0.3000000 0.2149578 -0.0000000), wk = 0.0034602 k( 137) = ( 0.3166667 0.2268999 -0.0000000), wk = 0.0034602 k( 138) = ( 0.3333333 0.2388420 -0.0000000), wk = 0.0034602 k( 139) = ( 0.3500000 0.2507841 -0.0000000), wk = 0.0034602 k( 140) = ( 0.3666667 0.2627262 -0.0000000), wk = 0.0034602 k( 141) = ( 0.3833333 0.2746683 -0.0000000), wk = 0.0034602 k( 142) = ( 0.4000000 0.2866104 -0.0000000), wk = 0.0034602 k( 143) = ( 0.4166667 0.2985525 -0.0000000), wk = 0.0034602 k( 144) = ( 0.4333333 0.3104946 -0.0000000), wk = 0.0034602 k( 145) = ( 0.4500000 0.3224367 -0.0000000), wk = 0.0034602 k( 146) = ( 0.4666667 0.3343788 -0.0000000), wk = 0.0034602 k( 147) = ( 0.4833333 0.3463208 -0.0000000), wk = 0.0034602 k( 148) = ( 0.5000000 0.3582630 -0.0000000), wk = 0.0034602 k( 149) = ( 0.5000000 0.3582630 -0.0000000), wk = 0.0034602 k( 150) = ( 0.4915535 0.3700511 0.0145019), wk = 0.0034602 k( 151) = ( 0.4831069 0.3818393 0.0290038), wk = 0.0034602 k( 152) = ( 0.4746604 0.3936275 0.0435057), wk = 0.0034602 k( 153) = ( 0.4662138 0.4054157 0.0580076), wk = 0.0034602 k( 154) = ( 0.4577673 0.4172039 0.0725095), wk = 0.0034602 k( 155) = ( 0.4493208 0.4289920 0.0870114), wk = 0.0034602 k( 156) = ( 0.4408742 0.4407802 0.1015133), wk = 0.0034602 k( 157) = ( 0.4324277 0.4525684 0.1160152), wk = 0.0034602 k( 158) = ( 0.4239812 0.4643566 0.1305171), wk = 0.0034602 k( 159) = ( 0.4155346 0.4761448 0.1450190), wk = 0.0034602 k( 160) = ( 0.4070881 0.4879329 0.1595209), wk = 0.0034602 k( 161) = ( 0.3986416 0.4997211 0.1740228), wk = 0.0034602 k( 162) = ( 0.3901950 0.5115093 0.1885248), wk = 0.0034602 k( 163) = ( 0.3817485 0.5232975 0.2030267), wk = 0.0034602 k( 164) = ( 0.3733019 0.5350857 0.2175286), wk = 0.0034602 k( 165) = ( 0.3648554 0.5468739 0.2320305), wk = 0.0034602 k( 166) = ( 0.3564089 0.5586620 0.2465324), wk = 0.0034602 k( 167) = ( 0.3479623 0.5704502 0.2610343), wk = 0.0034602 k( 168) = ( 0.3395158 0.5822384 0.2755362), wk = 0.0034602 k( 169) = ( 0.3310692 0.5940266 0.2900381), wk = 0.0034602 k( 170) = ( 0.3226227 0.6058148 0.3045400), wk = 0.0034602 k( 171) = ( 0.3141762 0.6176030 0.3190419), wk = 0.0034602 k( 172) = ( 0.3141762 0.6176030 0.3190419), wk = 0.0034602 k( 173) = ( 0.2956952 0.6123344 0.3255233), wk = 0.0034602 k( 174) = ( 0.2772143 0.6070658 0.3320048), wk = 0.0034602 k( 175) = ( 0.2587333 0.6017972 0.3384862), wk = 0.0034602 k( 176) = ( 0.2402524 0.5965287 0.3449676), wk = 0.0034602 k( 177) = ( 0.2217714 0.5912601 0.3514491), wk = 0.0034602 k( 178) = ( 0.2032905 0.5859915 0.3579305), wk = 0.0034602 k( 179) = ( 0.1848095 0.5807229 0.3644119), wk = 0.0034602 k( 180) = ( 0.1663286 0.5754544 0.3708934), wk = 0.0034602 k( 181) = ( 0.1478476 0.5701858 0.3773748), wk = 0.0034602 k( 182) = ( 0.1293667 0.5649172 0.3838562), wk = 0.0034602 k( 183) = ( 0.1108857 0.5596487 0.3903377), wk = 0.0034602 k( 184) = ( 0.0924048 0.5543801 0.3968191), wk = 0.0034602 k( 185) = ( 0.0739238 0.5491115 0.4033006), wk = 0.0034602 k( 186) = ( 0.0554429 0.5438429 0.4097820), wk = 0.0034602 k( 187) = ( 0.0369619 0.5385744 0.4162634), wk = 0.0034602 k( 188) = ( 0.0184809 0.5333058 0.4227449), wk = 0.0034602 k( 189) = ( 0.0000000 0.5280372 0.4292263), wk = 0.0034602 k( 190) = ( 0.0000000 0.5280372 0.4292263), wk = 0.0034602 k( 191) = ( 0.0083333 0.5164070 0.4435338), wk = 0.0034602 k( 192) = ( 0.0166667 0.5047768 0.4578414), wk = 0.0034602 k( 193) = ( 0.0250000 0.4931466 0.4721489), wk = 0.0034602 k( 194) = ( 0.0333333 0.4815165 0.4864565), wk = 0.0034602 k( 195) = ( 0.0416667 0.4698863 0.5007640), wk = 0.0034602 k( 196) = ( 0.0500000 0.4582561 0.5150716), wk = 0.0034602 k( 197) = ( 0.0583333 0.4466259 0.5293791), wk = 0.0034602 k( 198) = ( 0.0666667 0.4349957 0.5436867), wk = 0.0034602 k( 199) = ( 0.0750000 0.4233655 0.5579942), wk = 0.0034602 k( 200) = ( 0.0833333 0.4117353 0.5723017), wk = 0.0034602 k( 201) = ( 0.0916667 0.4001051 0.5866093), wk = 0.0034602 k( 202) = ( 0.1000000 0.3884749 0.6009168), wk = 0.0034602 k( 203) = ( 0.1083333 0.3768447 0.6152244), wk = 0.0034602 k( 204) = ( 0.1166667 0.3652145 0.6295319), wk = 0.0034602 k( 205) = ( 0.1250000 0.3535843 0.6438394), wk = 0.0034602 k( 206) = ( 0.1333333 0.3419542 0.6581470), wk = 0.0034602 k( 207) = ( 0.1416667 0.3303240 0.6724545), wk = 0.0034602 k( 208) = ( 0.1500000 0.3186938 0.6867621), wk = 0.0034602 k( 209) = ( 0.1583333 0.3070636 0.7010696), wk = 0.0034602 k( 210) = ( 0.1666667 0.2954334 0.7153772), wk = 0.0034602 k( 211) = ( 0.1750000 0.2838032 0.7296847), wk = 0.0034602 k( 212) = ( 0.1833333 0.2721730 0.7439922), wk = 0.0034602 k( 213) = ( 0.1916667 0.2605428 0.7582998), wk = 0.0034602 k( 214) = ( 0.2000000 0.2489126 0.7726073), wk = 0.0034602 k( 215) = ( 0.2083333 0.2372824 0.7869149), wk = 0.0034602 k( 216) = ( 0.2166667 0.2256522 0.8012224), wk = 0.0034602 k( 217) = ( 0.2250000 0.2140220 0.8155300), wk = 0.0034602 k( 218) = ( 0.2333333 0.2023919 0.8298375), wk = 0.0034602 k( 219) = ( 0.2416667 0.1907617 0.8441451), wk = 0.0034602 k( 220) = ( 0.2500000 0.1791315 0.8584526), wk = 0.0034602 k( 221) = ( 0.2500000 0.1791315 0.8584526), wk = 0.0034602 k( 222) = ( 0.2631579 0.1885594 0.8468542), wk = 0.0034602 k( 223) = ( 0.2763158 0.1979874 0.8352559), wk = 0.0034602 k( 224) = ( 0.2894737 0.2074154 0.8236575), wk = 0.0034602 k( 225) = ( 0.3026316 0.2168434 0.8120592), wk = 0.0034602 k( 226) = ( 0.3157895 0.2262713 0.8004608), wk = 0.0034602 k( 227) = ( 0.3289474 0.2356993 0.7888624), wk = 0.0034602 k( 228) = ( 0.3421053 0.2451273 0.7772641), wk = 0.0034602 k( 229) = ( 0.3552632 0.2545553 0.7656657), wk = 0.0034602 k( 230) = ( 0.3684211 0.2639832 0.7540674), wk = 0.0034602 k( 231) = ( 0.3815789 0.2734112 0.7424690), wk = 0.0034602 k( 232) = ( 0.3947368 0.2828392 0.7308707), wk = 0.0034602 k( 233) = ( 0.4078947 0.2922671 0.7192723), wk = 0.0034602 k( 234) = ( 0.4210526 0.3016951 0.7076739), wk = 0.0034602 k( 235) = ( 0.4342105 0.3111231 0.6960756), wk = 0.0034602 k( 236) = ( 0.4473684 0.3205511 0.6844772), wk = 0.0034602 k( 237) = ( 0.4605263 0.3299790 0.6728789), wk = 0.0034602 k( 238) = ( 0.4736842 0.3394070 0.6612805), wk = 0.0034602 k( 239) = ( 0.4868421 0.3488350 0.6496822), wk = 0.0034602 k( 240) = ( 0.5000000 0.3582630 0.6380838), wk = 0.0034602 k( 241) = ( 0.5000000 0.3582630 0.6380838), wk = 0.0034602 k( 242) = ( 0.5000000 0.3582630 0.6181437), wk = 0.0034602 k( 243) = ( 0.5000000 0.3582630 0.5982036), wk = 0.0034602 k( 244) = ( 0.5000000 0.3582630 0.5782634), wk = 0.0034602 k( 245) = ( 0.5000000 0.3582630 0.5583233), wk = 0.0034602 k( 246) = ( 0.5000000 0.3582630 0.5383832), wk = 0.0034602 k( 247) = ( 0.5000000 0.3582630 0.5184431), wk = 0.0034602 k( 248) = ( 0.5000000 0.3582630 0.4985030), wk = 0.0034602 k( 249) = ( 0.5000000 0.3582630 0.4785628), wk = 0.0034602 k( 250) = ( 0.5000000 0.3582630 0.4586227), wk = 0.0034602 k( 251) = ( 0.5000000 0.3582630 0.4386826), wk = 0.0034602 k( 252) = ( 0.5000000 0.3582630 0.4187425), wk = 0.0034602 k( 253) = ( 0.5000000 0.3582630 0.3988024), wk = 0.0034602 k( 254) = ( 0.5000000 0.3582630 0.3788623), wk = 0.0034602 k( 255) = ( 0.5000000 0.3582630 0.3589221), wk = 0.0034602 k( 256) = ( 0.5000000 0.3582630 0.3389820), wk = 0.0034602 k( 257) = ( 0.5000000 0.3582630 0.3190419), wk = 0.0034602 k( 258) = ( 0.5000000 0.3582630 0.2991018), wk = 0.0034602 k( 259) = ( 0.5000000 0.3582630 0.2791617), wk = 0.0034602 k( 260) = ( 0.5000000 0.3582630 0.2592215), wk = 0.0034602 k( 261) = ( 0.5000000 0.3582630 0.2392814), wk = 0.0034602 k( 262) = ( 0.5000000 0.3582630 0.2193413), wk = 0.0034602 k( 263) = ( 0.5000000 0.3582630 0.1994012), wk = 0.0034602 k( 264) = ( 0.5000000 0.3582630 0.1794611), wk = 0.0034602 k( 265) = ( 0.5000000 0.3582630 0.1595209), wk = 0.0034602 k( 266) = ( 0.5000000 0.3582630 0.1395808), wk = 0.0034602 k( 267) = ( 0.5000000 0.3582630 0.1196407), wk = 0.0034602 k( 268) = ( 0.5000000 0.3582630 0.0997006), wk = 0.0034602 k( 269) = ( 0.5000000 0.3582630 0.0797605), wk = 0.0034602 k( 270) = ( 0.5000000 0.3582630 0.0598204), wk = 0.0034602 k( 271) = ( 0.5000000 0.3582630 0.0398802), wk = 0.0034602 k( 272) = ( 0.5000000 0.3582630 0.0199401), wk = 0.0034602 k( 273) = ( 0.5000000 0.3582630 -0.0000000), wk = 0.0034602 k( 274) = ( 0.0000000 0.0000000 0.8584526), wk = 0.0034602 k( 275) = ( 0.0166667 0.0119421 0.8584526), wk = 0.0034602 k( 276) = ( 0.0333333 0.0238842 0.8584526), wk = 0.0034602 k( 277) = ( 0.0500000 0.0358263 0.8584526), wk = 0.0034602 k( 278) = ( 0.0666667 0.0477684 0.8584526), wk = 0.0034602 k( 279) = ( 0.0833333 0.0597105 0.8584526), wk = 0.0034602 k( 280) = ( 0.1000000 0.0716526 0.8584526), wk = 0.0034602 k( 281) = ( 0.1166667 0.0835947 0.8584526), wk = 0.0034602 k( 282) = ( 0.1333333 0.0955368 0.8584526), wk = 0.0034602 k( 283) = ( 0.1500000 0.1074789 0.8584526), wk = 0.0034602 k( 284) = ( 0.1666667 0.1194210 0.8584526), wk = 0.0034602 k( 285) = ( 0.1833333 0.1313631 0.8584526), wk = 0.0034602 k( 286) = ( 0.2000000 0.1433052 0.8584526), wk = 0.0034602 k( 287) = ( 0.2166667 0.1552473 0.8584526), wk = 0.0034602 k( 288) = ( 0.2333333 0.1671894 0.8584526), wk = 0.0034602 k( 289) = ( 0.2500000 0.1791315 0.8584526), wk = 0.0034602 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034602 k( 2) = ( 0.0000000 0.0000000 0.0119048), wk = 0.0034602 k( 3) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0034602 k( 4) = ( 0.0000000 0.0000000 0.0357143), wk = 0.0034602 k( 5) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0034602 k( 6) = ( 0.0000000 0.0000000 0.0595238), wk = 0.0034602 k( 7) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0034602 k( 8) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0034602 k( 9) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0034602 k( 10) = ( 0.0000000 0.0000000 0.1071429), wk = 0.0034602 k( 11) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0034602 k( 12) = ( 0.0000000 0.0000000 0.1309524), wk = 0.0034602 k( 13) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0034602 k( 14) = ( 0.0000000 0.0000000 0.1547619), wk = 0.0034602 k( 15) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0034602 k( 16) = ( 0.0000000 0.0000000 0.1785714), wk = 0.0034602 k( 17) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0034602 k( 18) = ( 0.0000000 0.0000000 0.2023810), wk = 0.0034602 k( 19) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0034602 k( 20) = ( 0.0000000 0.0000000 0.2261905), wk = 0.0034602 k( 21) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0034602 k( 22) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0034602 k( 23) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0034602 k( 24) = ( 0.0000000 0.0000000 0.2738095), wk = 0.0034602 k( 25) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0034602 k( 26) = ( 0.0000000 0.0000000 0.2976190), wk = 0.0034602 k( 27) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0034602 k( 28) = ( 0.0000000 0.0000000 0.3214286), wk = 0.0034602 k( 29) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0034602 k( 30) = ( 0.0000000 0.0000000 0.3452381), wk = 0.0034602 k( 31) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0034602 k( 32) = ( 0.0000000 0.0000000 0.3690476), wk = 0.0034602 k( 33) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0034602 k( 34) = ( 0.0000000 0.0000000 0.3928571), wk = 0.0034602 k( 35) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0034602 k( 36) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0034602 k( 37) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0034602 k( 38) = ( 0.0000000 0.0000000 0.4404762), wk = 0.0034602 k( 39) = ( 0.0000000 0.0000000 0.4523809), wk = 0.0034602 k( 40) = ( 0.0000000 0.0000000 0.4642857), wk = 0.0034602 k( 41) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0034602 k( 42) = ( 0.0000000 0.0000000 0.4880952), wk = 0.0034602 k( 43) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034602 k( 44) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034602 k( 45) = ( -0.0116684 0.0116684 0.5000000), wk = 0.0034602 k( 46) = ( -0.0233368 0.0233368 0.5000000), wk = 0.0034602 k( 47) = ( -0.0350052 0.0350052 0.5000000), wk = 0.0034602 k( 48) = ( -0.0466736 0.0466736 0.5000000), wk = 0.0034602 k( 49) = ( -0.0583420 0.0583420 0.5000000), wk = 0.0034602 k( 50) = ( -0.0700104 0.0700104 0.5000000), wk = 0.0034602 k( 51) = ( -0.0816788 0.0816788 0.5000000), wk = 0.0034602 k( 52) = ( -0.0933472 0.0933472 0.5000000), wk = 0.0034602 k( 53) = ( -0.1050155 0.1050155 0.5000000), wk = 0.0034602 k( 54) = ( -0.1166839 0.1166839 0.5000000), wk = 0.0034602 k( 55) = ( -0.1283523 0.1283523 0.5000000), wk = 0.0034602 k( 56) = ( -0.1283523 0.1283523 0.5000000), wk = 0.0034602 k( 57) = ( -0.1367989 0.1367989 0.4915535), wk = 0.0034602 k( 58) = ( -0.1452454 0.1452454 0.4831069), wk = 0.0034602 k( 59) = ( -0.1536919 0.1536919 0.4746604), wk = 0.0034602 k( 60) = ( -0.1621385 0.1621385 0.4662138), wk = 0.0034602 k( 61) = ( -0.1705850 0.1705850 0.4577673), wk = 0.0034602 k( 62) = ( -0.1790316 0.1790316 0.4493208), wk = 0.0034602 k( 63) = ( -0.1874781 0.1874781 0.4408742), wk = 0.0034602 k( 64) = ( -0.1959246 0.1959246 0.4324277), wk = 0.0034602 k( 65) = ( -0.2043712 0.2043712 0.4239812), wk = 0.0034602 k( 66) = ( -0.2128177 0.2128177 0.4155346), wk = 0.0034602 k( 67) = ( -0.2212643 0.2212643 0.4070881), wk = 0.0034602 k( 68) = ( -0.2297108 0.2297108 0.3986416), wk = 0.0034602 k( 69) = ( -0.2381573 0.2381573 0.3901950), wk = 0.0034602 k( 70) = ( -0.2466039 0.2466039 0.3817485), wk = 0.0034602 k( 71) = ( -0.2550504 0.2550504 0.3733019), wk = 0.0034602 k( 72) = ( -0.2634969 0.2634969 0.3648554), wk = 0.0034602 k( 73) = ( -0.2719435 0.2719435 0.3564089), wk = 0.0034602 k( 74) = ( -0.2803900 0.2803900 0.3479623), wk = 0.0034602 k( 75) = ( -0.2888366 0.2888366 0.3395158), wk = 0.0034602 k( 76) = ( -0.2972831 0.2972831 0.3310692), wk = 0.0034602 k( 77) = ( -0.3057296 0.3057296 0.3226227), wk = 0.0034602 k( 78) = ( -0.3141762 0.3141762 0.3141762), wk = 0.0034602 k( 79) = ( -0.3141762 0.3141762 0.3141762), wk = 0.0034602 k( 80) = ( -0.3059084 0.3059084 0.3059084), wk = 0.0034602 k( 81) = ( -0.2976406 0.2976406 0.2976406), wk = 0.0034602 k( 82) = ( -0.2893728 0.2893728 0.2893728), wk = 0.0034602 k( 83) = ( -0.2811050 0.2811050 0.2811050), wk = 0.0034602 k( 84) = ( -0.2728372 0.2728372 0.2728372), wk = 0.0034602 k( 85) = ( -0.2645694 0.2645694 0.2645694), wk = 0.0034602 k( 86) = ( -0.2563016 0.2563016 0.2563016), wk = 0.0034602 k( 87) = ( -0.2480338 0.2480338 0.2480338), wk = 0.0034602 k( 88) = ( -0.2397660 0.2397660 0.2397660), wk = 0.0034602 k( 89) = ( -0.2314982 0.2314982 0.2314982), wk = 0.0034602 k( 90) = ( -0.2232304 0.2232304 0.2232304), wk = 0.0034602 k( 91) = ( -0.2149626 0.2149626 0.2149626), wk = 0.0034602 k( 92) = ( -0.2066949 0.2066948 0.2066949), wk = 0.0034602 k( 93) = ( -0.1984271 0.1984271 0.1984271), wk = 0.0034602 k( 94) = ( -0.1901593 0.1901593 0.1901593), wk = 0.0034602 k( 95) = ( -0.1818915 0.1818915 0.1818915), wk = 0.0034602 k( 96) = ( -0.1736237 0.1736237 0.1736237), wk = 0.0034602 k( 97) = ( -0.1653559 0.1653559 0.1653559), wk = 0.0034602 k( 98) = ( -0.1570881 0.1570881 0.1570881), wk = 0.0034602 k( 99) = ( -0.1488203 0.1488203 0.1488203), wk = 0.0034602 k( 100) = ( -0.1405525 0.1405525 0.1405525), wk = 0.0034602 k( 101) = ( -0.1322847 0.1322847 0.1322847), wk = 0.0034602 k( 102) = ( -0.1240169 0.1240169 0.1240169), wk = 0.0034602 k( 103) = ( -0.1157491 0.1157491 0.1157491), wk = 0.0034602 k( 104) = ( -0.1074813 0.1074813 0.1074813), wk = 0.0034602 k( 105) = ( -0.0992135 0.0992135 0.0992135), wk = 0.0034602 k( 106) = ( -0.0909457 0.0909457 0.0909457), wk = 0.0034602 k( 107) = ( -0.0826779 0.0826779 0.0826779), wk = 0.0034602 k( 108) = ( -0.0744101 0.0744101 0.0744101), wk = 0.0034602 k( 109) = ( -0.0661424 0.0661424 0.0661424), wk = 0.0034602 k( 110) = ( -0.0578746 0.0578746 0.0578746), wk = 0.0034602 k( 111) = ( -0.0496068 0.0496068 0.0496068), wk = 0.0034602 k( 112) = ( -0.0413390 0.0413390 0.0413390), wk = 0.0034602 k( 113) = ( -0.0330712 0.0330712 0.0330712), wk = 0.0034602 k( 114) = ( -0.0248034 0.0248034 0.0248034), wk = 0.0034602 k( 115) = ( -0.0165356 0.0165356 0.0165356), wk = 0.0034602 k( 116) = ( -0.0082678 0.0082678 0.0082678), wk = 0.0034602 k( 117) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034602 k( 118) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034602 k( 119) = ( 0.0166667 0.0166667 -0.0166667), wk = 0.0034602 k( 120) = ( 0.0333333 0.0333333 -0.0333333), wk = 0.0034602 k( 121) = ( 0.0500000 0.0500000 -0.0500000), wk = 0.0034602 k( 122) = ( 0.0666667 0.0666667 -0.0666667), wk = 0.0034602 k( 123) = ( 0.0833333 0.0833333 -0.0833333), wk = 0.0034602 k( 124) = ( 0.1000000 0.1000000 -0.1000000), wk = 0.0034602 k( 125) = ( 0.1166667 0.1166667 -0.1166667), wk = 0.0034602 k( 126) = ( 0.1333333 0.1333333 -0.1333333), wk = 0.0034602 k( 127) = ( 0.1500000 0.1500000 -0.1500000), wk = 0.0034602 k( 128) = ( 0.1666667 0.1666667 -0.1666667), wk = 0.0034602 k( 129) = ( 0.1833333 0.1833333 -0.1833333), wk = 0.0034602 k( 130) = ( 0.2000000 0.2000000 -0.2000000), wk = 0.0034602 k( 131) = ( 0.2166667 0.2166667 -0.2166667), wk = 0.0034602 k( 132) = ( 0.2333333 0.2333333 -0.2333333), wk = 0.0034602 k( 133) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0034602 k( 134) = ( 0.2666667 0.2666667 -0.2666667), wk = 0.0034602 k( 135) = ( 0.2833333 0.2833333 -0.2833333), wk = 0.0034602 k( 136) = ( 0.3000000 0.3000000 -0.3000000), wk = 0.0034602 k( 137) = ( 0.3166667 0.3166667 -0.3166667), wk = 0.0034602 k( 138) = ( 0.3333333 0.3333333 -0.3333333), wk = 0.0034602 k( 139) = ( 0.3500000 0.3500000 -0.3500000), wk = 0.0034602 k( 140) = ( 0.3666667 0.3666667 -0.3666667), wk = 0.0034602 k( 141) = ( 0.3833333 0.3833333 -0.3833333), wk = 0.0034602 k( 142) = ( 0.4000000 0.4000000 -0.4000000), wk = 0.0034602 k( 143) = ( 0.4166667 0.4166667 -0.4166667), wk = 0.0034602 k( 144) = ( 0.4333333 0.4333333 -0.4333333), wk = 0.0034602 k( 145) = ( 0.4500000 0.4500000 -0.4500000), wk = 0.0034602 k( 146) = ( 0.4666667 0.4666667 -0.4666667), wk = 0.0034602 k( 147) = ( 0.4833333 0.4833333 -0.4833333), wk = 0.0034602 k( 148) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0034602 k( 149) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0034602 k( 150) = ( 0.4915535 0.5084465 -0.4915535), wk = 0.0034602 k( 151) = ( 0.4831069 0.5168931 -0.4831069), wk = 0.0034602 k( 152) = ( 0.4746604 0.5253396 -0.4746604), wk = 0.0034602 k( 153) = ( 0.4662138 0.5337861 -0.4662139), wk = 0.0034602 k( 154) = ( 0.4577673 0.5422327 -0.4577673), wk = 0.0034602 k( 155) = ( 0.4493208 0.5506792 -0.4493208), wk = 0.0034602 k( 156) = ( 0.4408742 0.5591258 -0.4408742), wk = 0.0034602 k( 157) = ( 0.4324277 0.5675723 -0.4324277), wk = 0.0034602 k( 158) = ( 0.4239812 0.5760188 -0.4239812), wk = 0.0034602 k( 159) = ( 0.4155346 0.5844654 -0.4155346), wk = 0.0034602 k( 160) = ( 0.4070881 0.5929119 -0.4070881), wk = 0.0034602 k( 161) = ( 0.3986416 0.6013584 -0.3986416), wk = 0.0034602 k( 162) = ( 0.3901950 0.6098050 -0.3901950), wk = 0.0034602 k( 163) = ( 0.3817485 0.6182515 -0.3817485), wk = 0.0034602 k( 164) = ( 0.3733019 0.6266981 -0.3733019), wk = 0.0034602 k( 165) = ( 0.3648554 0.6351446 -0.3648554), wk = 0.0034602 k( 166) = ( 0.3564089 0.6435911 -0.3564089), wk = 0.0034602 k( 167) = ( 0.3479623 0.6520377 -0.3479623), wk = 0.0034602 k( 168) = ( 0.3395158 0.6604842 -0.3395158), wk = 0.0034602 k( 169) = ( 0.3310692 0.6689308 -0.3310693), wk = 0.0034602 k( 170) = ( 0.3226227 0.6773773 -0.3226227), wk = 0.0034602 k( 171) = ( 0.3141762 0.6858238 -0.3141762), wk = 0.0034602 k( 172) = ( 0.3141762 0.6858238 -0.3141762), wk = 0.0034602 k( 173) = ( 0.2956952 0.6748930 -0.2956952), wk = 0.0034602 k( 174) = ( 0.2772143 0.6639622 -0.2772143), wk = 0.0034602 k( 175) = ( 0.2587333 0.6530314 -0.2587333), wk = 0.0034602 k( 176) = ( 0.2402524 0.6421006 -0.2402524), wk = 0.0034602 k( 177) = ( 0.2217714 0.6311698 -0.2217714), wk = 0.0034602 k( 178) = ( 0.2032905 0.6202389 -0.2032905), wk = 0.0034602 k( 179) = ( 0.1848095 0.6093081 -0.1848095), wk = 0.0034602 k( 180) = ( 0.1663286 0.5983773 -0.1663286), wk = 0.0034602 k( 181) = ( 0.1478476 0.5874465 -0.1478476), wk = 0.0034602 k( 182) = ( 0.1293667 0.5765157 -0.1293667), wk = 0.0034602 k( 183) = ( 0.1108857 0.5655849 -0.1108857), wk = 0.0034602 k( 184) = ( 0.0924048 0.5546541 -0.0924048), wk = 0.0034602 k( 185) = ( 0.0739238 0.5437232 -0.0739238), wk = 0.0034602 k( 186) = ( 0.0554429 0.5327924 -0.0554429), wk = 0.0034602 k( 187) = ( 0.0369619 0.5218616 -0.0369619), wk = 0.0034602 k( 188) = ( 0.0184809 0.5109308 -0.0184809), wk = 0.0034602 k( 189) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0034602 k( 190) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0034602 k( 191) = ( 0.0083333 0.4916667 0.0083333), wk = 0.0034602 k( 192) = ( 0.0166667 0.4833333 0.0166667), wk = 0.0034602 k( 193) = ( 0.0250000 0.4750000 0.0250000), wk = 0.0034602 k( 194) = ( 0.0333333 0.4666667 0.0333333), wk = 0.0034602 k( 195) = ( 0.0416667 0.4583333 0.0416667), wk = 0.0034602 k( 196) = ( 0.0500000 0.4500000 0.0500000), wk = 0.0034602 k( 197) = ( 0.0583333 0.4416667 0.0583333), wk = 0.0034602 k( 198) = ( 0.0666667 0.4333333 0.0666667), wk = 0.0034602 k( 199) = ( 0.0750000 0.4250000 0.0750000), wk = 0.0034602 k( 200) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0034602 k( 201) = ( 0.0916667 0.4083333 0.0916667), wk = 0.0034602 k( 202) = ( 0.1000000 0.4000000 0.1000000), wk = 0.0034602 k( 203) = ( 0.1083333 0.3916667 0.1083333), wk = 0.0034602 k( 204) = ( 0.1166667 0.3833333 0.1166667), wk = 0.0034602 k( 205) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0034602 k( 206) = ( 0.1333333 0.3666667 0.1333333), wk = 0.0034602 k( 207) = ( 0.1416667 0.3583333 0.1416667), wk = 0.0034602 k( 208) = ( 0.1500000 0.3500000 0.1500000), wk = 0.0034602 k( 209) = ( 0.1583333 0.3416667 0.1583333), wk = 0.0034602 k( 210) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0034602 k( 211) = ( 0.1750000 0.3250000 0.1750000), wk = 0.0034602 k( 212) = ( 0.1833333 0.3166667 0.1833333), wk = 0.0034602 k( 213) = ( 0.1916667 0.3083333 0.1916667), wk = 0.0034602 k( 214) = ( 0.2000000 0.3000000 0.2000000), wk = 0.0034602 k( 215) = ( 0.2083333 0.2916667 0.2083333), wk = 0.0034602 k( 216) = ( 0.2166667 0.2833333 0.2166667), wk = 0.0034602 k( 217) = ( 0.2250000 0.2750000 0.2250000), wk = 0.0034602 k( 218) = ( 0.2333333 0.2666667 0.2333333), wk = 0.0034602 k( 219) = ( 0.2416667 0.2583333 0.2416667), wk = 0.0034602 k( 220) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0034602 k( 221) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0034602 k( 222) = ( 0.2631579 0.2631579 0.2300867), wk = 0.0034602 k( 223) = ( 0.2763158 0.2763158 0.2101734), wk = 0.0034602 k( 224) = ( 0.2894737 0.2894737 0.1902602), wk = 0.0034602 k( 225) = ( 0.3026316 0.3026316 0.1703469), wk = 0.0034602 k( 226) = ( 0.3157895 0.3157895 0.1504336), wk = 0.0034602 k( 227) = ( 0.3289474 0.3289474 0.1305203), wk = 0.0034602 k( 228) = ( 0.3421053 0.3421053 0.1106070), wk = 0.0034602 k( 229) = ( 0.3552632 0.3552632 0.0906937), wk = 0.0034602 k( 230) = ( 0.3684211 0.3684211 0.0707805), wk = 0.0034602 k( 231) = ( 0.3815789 0.3815789 0.0508672), wk = 0.0034602 k( 232) = ( 0.3947368 0.3947368 0.0309539), wk = 0.0034602 k( 233) = ( 0.4078947 0.4078947 0.0110406), wk = 0.0034602 k( 234) = ( 0.4210526 0.4210526 -0.0088727), wk = 0.0034602 k( 235) = ( 0.4342105 0.4342105 -0.0287859), wk = 0.0034602 k( 236) = ( 0.4473684 0.4473684 -0.0486992), wk = 0.0034602 k( 237) = ( 0.4605263 0.4605263 -0.0686125), wk = 0.0034602 k( 238) = ( 0.4736842 0.4736842 -0.0885258), wk = 0.0034602 k( 239) = ( 0.4868421 0.4868421 -0.1084391), wk = 0.0034602 k( 240) = ( 0.5000000 0.5000000 -0.1283523), wk = 0.0034602 k( 241) = ( 0.5000000 0.5000000 -0.1283523), wk = 0.0034602 k( 242) = ( 0.5000000 0.5000000 -0.1399663), wk = 0.0034602 k( 243) = ( 0.5000000 0.5000000 -0.1515803), wk = 0.0034602 k( 244) = ( 0.5000000 0.5000000 -0.1631943), wk = 0.0034602 k( 245) = ( 0.5000000 0.5000000 -0.1748083), wk = 0.0034602 k( 246) = ( 0.5000000 0.5000000 -0.1864223), wk = 0.0034602 k( 247) = ( 0.5000000 0.5000000 -0.1980363), wk = 0.0034602 k( 248) = ( 0.5000000 0.5000000 -0.2096503), wk = 0.0034602 k( 249) = ( 0.5000000 0.5000000 -0.2212643), wk = 0.0034602 k( 250) = ( 0.5000000 0.5000000 -0.2328783), wk = 0.0034602 k( 251) = ( 0.5000000 0.5000000 -0.2444922), wk = 0.0034602 k( 252) = ( 0.5000000 0.5000000 -0.2561062), wk = 0.0034602 k( 253) = ( 0.5000000 0.5000000 -0.2677202), wk = 0.0034602 k( 254) = ( 0.5000000 0.5000000 -0.2793342), wk = 0.0034602 k( 255) = ( 0.5000000 0.5000000 -0.2909482), wk = 0.0034602 k( 256) = ( 0.5000000 0.5000000 -0.3025622), wk = 0.0034602 k( 257) = ( 0.5000000 0.5000000 -0.3141762), wk = 0.0034602 k( 258) = ( 0.5000000 0.5000000 -0.3257902), wk = 0.0034602 k( 259) = ( 0.5000000 0.5000000 -0.3374042), wk = 0.0034602 k( 260) = ( 0.5000000 0.5000000 -0.3490181), wk = 0.0034602 k( 261) = ( 0.5000000 0.5000000 -0.3606321), wk = 0.0034602 k( 262) = ( 0.5000000 0.5000000 -0.3722461), wk = 0.0034602 k( 263) = ( 0.5000000 0.5000000 -0.3838601), wk = 0.0034602 k( 264) = ( 0.5000000 0.5000000 -0.3954741), wk = 0.0034602 k( 265) = ( 0.5000000 0.5000000 -0.4070881), wk = 0.0034602 k( 266) = ( 0.5000000 0.5000000 -0.4187021), wk = 0.0034602 k( 267) = ( 0.5000000 0.5000000 -0.4303161), wk = 0.0034602 k( 268) = ( 0.5000000 0.5000000 -0.4419301), wk = 0.0034602 k( 269) = ( 0.5000000 0.5000000 -0.4535440), wk = 0.0034602 k( 270) = ( 0.5000000 0.5000000 -0.4651580), wk = 0.0034602 k( 271) = ( 0.5000000 0.5000000 -0.4767720), wk = 0.0034602 k( 272) = ( 0.5000000 0.5000000 -0.4883860), wk = 0.0034602 k( 273) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0034602 k( 274) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034602 k( 275) = ( 0.0166667 0.0166667 0.4833333), wk = 0.0034602 k( 276) = ( 0.0333333 0.0333333 0.4666667), wk = 0.0034602 k( 277) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0034602 k( 278) = ( 0.0666667 0.0666667 0.4333333), wk = 0.0034602 k( 279) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0034602 k( 280) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0034602 k( 281) = ( 0.1166667 0.1166667 0.3833333), wk = 0.0034602 k( 282) = ( 0.1333333 0.1333333 0.3666667), wk = 0.0034602 k( 283) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0034602 k( 284) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0034602 k( 285) = ( 0.1833333 0.1833333 0.3166667), wk = 0.0034602 k( 286) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0034602 k( 287) = ( 0.2166667 0.2166667 0.2833333), wk = 0.0034602 k( 288) = ( 0.2333333 0.2333333 0.2666667), wk = 0.0034602 k( 289) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0034602 Dense grid: 62165 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 42415 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.33 Mb ( 310, 70) NL pseudopotentials 0.60 Mb ( 155, 252) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.01 Mb ( 1725) G-vector shells 0.01 Mb ( 779) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.32 Mb ( 310, 280) Each subspace H/S matrix 0.07 Mb ( 70, 70) Each matrix 0.54 Mb ( 252, 2, 70) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./FeCu2GeS4.save/charge-density.dat Starting wfc are 94 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.2 secs Computing kpt #: 2 total cpu time spent up to now is 6.5 secs Computing kpt #: 3 total cpu time spent up to now is 7.6 secs Computing kpt #: 4 total cpu time spent up to now is 8.8 secs Computing kpt #: 5 total cpu time spent up to now is 10.0 secs Computing kpt #: 6 total cpu time spent up to now is 11.1 secs Computing kpt #: 7 total cpu time spent up to now is 12.3 secs Computing kpt #: 8 total cpu time spent up to now is 13.5 secs Computing kpt #: 9 total cpu time spent up to now is 14.7 secs Computing kpt #: 10 total cpu time spent up to now is 15.9 secs Computing kpt #: 11 total cpu time spent up to now is 17.1 secs Computing kpt #: 12 total cpu time spent up to now is 18.2 secs Computing kpt #: 13 total cpu time spent up to now is 19.4 secs Computing kpt #: 14 total cpu time spent up to now is 20.5 secs Computing kpt #: 15 total cpu time spent up to now is 21.6 secs Computing kpt #: 16 total cpu time spent up to now is 22.8 secs Computing kpt #: 17 total cpu time spent up to now is 23.9 secs Computing kpt #: 18 total cpu time spent up to now is 25.1 secs Computing kpt #: 19 total cpu time spent up to now is 26.2 secs Computing kpt #: 20 total cpu time spent up to now is 27.4 secs Computing kpt #: 21 total cpu time spent up to now is 28.5 secs Computing kpt #: 22 total cpu time spent up to now is 29.7 secs Computing kpt #: 23 total cpu time spent up to now is 30.9 secs Computing kpt #: 24 total cpu time spent up to now is 32.1 secs Computing kpt #: 25 total cpu time spent up to now is 33.3 secs Computing kpt #: 26 total cpu time spent up to now is 34.5 secs Computing kpt #: 27 total cpu time spent up to now is 35.6 secs Computing kpt #: 28 total cpu time spent up to now is 36.8 secs Computing kpt #: 29 total cpu time spent up to now is 38.1 secs Computing kpt #: 30 total cpu time spent up to now is 39.3 secs Computing kpt #: 31 total cpu time spent up to now is 40.4 secs Computing kpt #: 32 total cpu time spent up to now is 41.6 secs Computing kpt #: 33 total cpu time spent up to now is 42.7 secs Computing kpt #: 34 total cpu time spent up to now is 43.9 secs Computing kpt #: 35 total cpu time spent up to now is 45.0 secs Computing kpt #: 36 total cpu time spent up to now is 46.3 secs Computing kpt #: 37 total cpu time spent up to now is 47.4 secs Computing kpt #: 38 total cpu time spent up to now is 48.6 secs Computing kpt #: 39 total cpu time spent up to now is 50.0 secs Computing kpt #: 40 total cpu time spent up to now is 51.1 secs Computing kpt #: 41 total cpu time spent up to now is 52.2 secs Computing kpt #: 42 total cpu time spent up to now is 53.3 secs Computing kpt #: 43 total cpu time spent up to now is 54.5 secs Computing kpt #: 44 total cpu time spent up to now is 55.7 secs Computing kpt #: 45 total cpu time spent up to now is 56.9 secs Computing kpt #: 46 total cpu time spent up to now is 58.0 secs Computing kpt #: 47 total cpu time spent up to now is 59.2 secs Computing kpt #: 48 total cpu time spent up to now is 60.3 secs Computing kpt #: 49 total cpu time spent up to now is 61.4 secs Computing kpt #: 50 total cpu time spent up to now is 62.5 secs Computing kpt #: 51 total cpu time spent up to now is 63.6 secs Computing kpt #: 52 total cpu time spent up to now is 64.7 secs Computing kpt #: 53 total cpu time spent up to now is 65.9 secs Computing kpt #: 54 total cpu time spent up to now is 67.0 secs Computing kpt #: 55 total cpu time spent up to now is 68.1 secs Computing kpt #: 56 total cpu time spent up to now is 69.2 secs Computing kpt #: 57 total cpu time spent up to now is 70.3 secs Computing kpt #: 58 total cpu time spent up to now is 71.4 secs Computing kpt #: 59 total cpu time spent up to now is 72.5 secs Computing kpt #: 60 total cpu time spent up to now is 73.6 secs Computing kpt #: 61 total cpu time spent up to now is 74.8 secs Computing kpt #: 62 total cpu time spent up to now is 75.9 secs Computing kpt #: 63 total cpu time spent up to now is 77.0 secs Computing kpt #: 64 total cpu time spent up to now is 78.2 secs Computing kpt #: 65 total cpu time spent up to now is 79.3 secs Computing kpt #: 66 total cpu time spent up to now is 80.4 secs Computing kpt #: 67 total cpu time spent up to now is 81.5 secs Computing kpt #: 68 total cpu time spent up to now is 82.7 secs Computing kpt #: 69 total cpu time spent up to now is 83.8 secs Computing kpt #: 70 total cpu time spent up to now is 85.0 secs Computing kpt #: 71 total cpu time spent up to now is 86.1 secs Computing kpt #: 72 total cpu time spent up to now is 87.3 secs Computing kpt #: 73 total cpu time spent up to now is 88.4 secs Computing kpt #: 74 total cpu time spent up to now is 89.6 secs Computing kpt #: 75 total cpu time spent up to now is 90.7 secs Computing kpt #: 76 total cpu time spent up to now is 91.8 secs Computing kpt #: 77 total cpu time spent up to now is 93.0 secs Computing kpt #: 78 total cpu time spent up to now is 94.1 secs Computing kpt #: 79 total cpu time spent up to now is 95.3 secs Computing kpt #: 80 total cpu time spent up to now is 96.4 secs Computing kpt #: 81 total cpu time spent up to now is 97.5 secs Computing kpt #: 82 total cpu time spent up to now is 98.7 secs Computing kpt #: 83 total cpu time spent up to now is 99.8 secs Computing kpt #: 84 total cpu time spent up to now is 101.0 secs Computing kpt #: 85 total cpu time spent up to now is 102.1 secs Computing kpt #: 86 total cpu time spent up to now is 103.3 secs Computing kpt #: 87 total cpu time spent up to now is 104.5 secs Computing kpt #: 88 total cpu time spent up to now is 105.7 secs Computing kpt #: 89 total cpu time spent up to now is 106.9 secs Computing kpt #: 90 total cpu time spent up to now is 108.0 secs Computing kpt #: 91 total cpu time spent up to now is 109.1 secs Computing kpt #: 92 total cpu time spent up to now is 110.2 secs Computing kpt #: 93 total cpu time spent up to now is 111.4 secs Computing kpt #: 94 total cpu time spent up to now is 112.5 secs Computing kpt #: 95 total cpu time spent up to now is 113.6 secs Computing kpt #: 96 total cpu time spent up to now is 114.7 secs Computing kpt #: 97 total cpu time spent up to now is 115.8 secs Computing kpt #: 98 total cpu time spent up to now is 116.9 secs Computing kpt #: 99 total cpu time spent up to now is 118.0 secs Computing kpt #: 100 total cpu time spent up to now is 119.2 secs Computing kpt #: 101 total cpu time spent up to now is 120.3 secs Computing kpt #: 102 total cpu time spent up to now is 121.5 secs Computing kpt #: 103 total cpu time spent up to now is 122.6 secs Computing kpt #: 104 total cpu time spent up to now is 123.8 secs Computing kpt #: 105 total cpu time spent up to now is 125.0 secs Computing kpt #: 106 total cpu time spent up to now is 126.2 secs Computing kpt #: 107 total cpu time spent up to now is 127.5 secs Computing kpt #: 108 total cpu time spent up to now is 128.7 secs Computing kpt #: 109 total cpu time spent up to now is 130.0 secs Computing kpt #: 110 total cpu time spent up to now is 131.2 secs Computing kpt #: 111 total cpu time spent up to now is 132.4 secs Computing kpt #: 112 total cpu time spent up to now is 133.5 secs Computing kpt #: 113 total cpu time spent up to now is 134.7 secs Computing kpt #: 114 total cpu time spent up to now is 135.9 secs Computing kpt #: 115 total cpu time spent up to now is 137.0 secs Computing kpt #: 116 total cpu time spent up to now is 138.1 secs Computing kpt #: 117 total cpu time spent up to now is 139.3 secs Computing kpt #: 118 total cpu time spent up to now is 140.4 secs Computing kpt #: 119 total cpu time spent up to now is 141.5 secs Computing kpt #: 120 total cpu time spent up to now is 142.7 secs Computing kpt #: 121 total cpu time spent up to now is 143.9 secs Computing kpt #: 122 total cpu time spent up to now is 145.5 secs Computing kpt #: 123 total cpu time spent up to now is 146.6 secs Computing kpt #: 124 total cpu time spent up to now is 147.7 secs Computing kpt #: 125 total cpu time spent up to now is 148.9 secs Computing kpt #: 126 total cpu time spent up to now is 150.1 secs Computing kpt #: 127 total cpu time spent up to now is 151.3 secs Computing kpt #: 128 total cpu time spent up to now is 152.5 secs Computing kpt #: 129 total cpu time spent up to now is 153.7 secs Computing kpt #: 130 total cpu time spent up to now is 154.9 secs Computing kpt #: 131 total cpu time spent up to now is 156.1 secs Computing kpt #: 132 total cpu time spent up to now is 157.2 secs Computing kpt #: 133 total cpu time spent up to now is 158.5 secs Computing kpt #: 134 total cpu time spent up to now is 159.7 secs Computing kpt #: 135 total cpu time spent up to now is 161.0 secs Computing kpt #: 136 total cpu time spent up to now is 162.1 secs Computing kpt #: 137 total cpu time spent up to now is 163.3 secs Computing kpt #: 138 total cpu time spent up to now is 164.4 secs Computing kpt #: 139 total cpu time spent up to now is 165.5 secs Computing kpt #: 140 total cpu time spent up to now is 166.6 secs Computing kpt #: 141 total cpu time spent up to now is 167.7 secs Computing kpt #: 142 total cpu time spent up to now is 168.8 secs Computing kpt #: 143 total cpu time spent up to now is 169.9 secs Computing kpt #: 144 total cpu time spent up to now is 171.0 secs Computing kpt #: 145 total cpu time spent up to now is 172.1 secs Computing kpt #: 146 total cpu time spent up to now is 173.1 secs Computing kpt #: 147 total cpu time spent up to now is 174.2 secs Computing kpt #: 148 total cpu time spent up to now is 175.3 secs Computing kpt #: 149 total cpu time spent up to now is 176.4 secs Computing kpt #: 150 total cpu time spent up to now is 177.5 secs Computing kpt #: 151 total cpu time spent up to now is 178.7 secs Computing kpt #: 152 total cpu time spent up to now is 179.8 secs Computing kpt #: 153 total cpu time spent up to now is 180.8 secs Computing kpt #: 154 total cpu time spent up to now is 181.9 secs Computing kpt #: 155 total cpu time spent up to now is 183.0 secs Computing kpt #: 156 total cpu time spent up to now is 184.0 secs Computing kpt #: 157 total cpu time spent up to now is 185.1 secs Computing kpt #: 158 total cpu time spent up to now is 186.2 secs Computing kpt #: 159 total cpu time spent up to now is 187.3 secs Computing kpt #: 160 total cpu time spent up to now is 188.4 secs Computing kpt #: 161 total cpu time spent up to now is 189.5 secs Computing kpt #: 162 total cpu time spent up to now is 190.6 secs Computing kpt #: 163 total cpu time spent up to now is 191.7 secs Computing kpt #: 164 total cpu time spent up to now is 192.8 secs Computing kpt #: 165 total cpu time spent up to now is 193.9 secs Computing kpt #: 166 total cpu time spent up to now is 195.1 secs Computing kpt #: 167 total cpu time spent up to now is 196.2 secs Computing kpt #: 168 total cpu time spent up to now is 197.3 secs Computing kpt #: 169 total cpu time spent up to now is 198.5 secs Computing kpt #: 170 total cpu time spent up to now is 199.6 secs Computing kpt #: 171 total cpu time spent up to now is 200.7 secs Computing kpt #: 172 total cpu time spent up to now is 201.9 secs Computing kpt #: 173 total cpu time spent up to now is 203.0 secs Computing kpt #: 174 total cpu time spent up to now is 204.1 secs Computing kpt #: 175 total cpu time spent up to now is 205.2 secs Computing kpt #: 176 total cpu time spent up to now is 206.3 secs Computing kpt #: 177 total cpu time spent up to now is 207.5 secs Computing kpt #: 178 total cpu time spent up to now is 208.7 secs Computing kpt #: 179 total cpu time spent up to now is 209.9 secs Computing kpt #: 180 total cpu time spent up to now is 211.1 secs Computing kpt #: 181 total cpu time spent up to now is 212.2 secs Computing kpt #: 182 total cpu time spent up to now is 213.4 secs Computing kpt #: 183 total cpu time spent up to now is 214.5 secs Computing kpt #: 184 total cpu time spent up to now is 215.7 secs Computing kpt #: 185 total cpu time spent up to now is 216.9 secs Computing kpt #: 186 total cpu time spent up to now is 218.2 secs Computing kpt #: 187 total cpu time spent up to now is 219.3 secs Computing kpt #: 188 total cpu time spent up to now is 220.5 secs Computing kpt #: 189 total cpu time spent up to now is 221.7 secs Computing kpt #: 190 total cpu time spent up to now is 222.8 secs Computing kpt #: 191 total cpu time spent up to now is 224.0 secs Computing kpt #: 192 total cpu time spent up to now is 225.2 secs Computing kpt #: 193 total cpu time spent up to now is 226.4 secs Computing kpt #: 194 total cpu time spent up to now is 227.5 secs Computing kpt #: 195 total cpu time spent up to now is 228.7 secs Computing kpt #: 196 total cpu time spent up to now is 229.9 secs Computing kpt #: 197 total cpu time spent up to now is 231.1 secs Computing kpt #: 198 total cpu time spent up to now is 232.3 secs Computing kpt #: 199 total cpu time spent up to now is 233.4 secs Computing kpt #: 200 total cpu time spent up to now is 234.5 secs Computing kpt #: 201 total cpu time spent up to now is 235.7 secs Computing kpt #: 202 total cpu time spent up to now is 236.8 secs Computing kpt #: 203 total cpu time spent up to now is 237.9 secs Computing kpt #: 204 total cpu time spent up to now is 239.1 secs Computing kpt #: 205 total cpu time spent up to now is 240.2 secs Computing kpt #: 206 total cpu time spent up to now is 241.4 secs Computing kpt #: 207 total cpu time spent up to now is 242.5 secs Computing kpt #: 208 total cpu time spent up to now is 243.6 secs Computing kpt #: 209 total cpu time spent up to now is 244.7 secs Computing kpt #: 210 total cpu time spent up to now is 245.7 secs Computing kpt #: 211 total cpu time spent up to now is 246.9 secs Computing kpt #: 212 total cpu time spent up to now is 247.9 secs Computing kpt #: 213 total cpu time spent up to now is 249.0 secs Computing kpt #: 214 total cpu time spent up to now is 250.1 secs Computing kpt #: 215 total cpu time spent up to now is 251.2 secs Computing kpt #: 216 total cpu time spent up to now is 252.3 secs Computing kpt #: 217 total cpu time spent up to now is 253.4 secs Computing kpt #: 218 total cpu time spent up to now is 254.5 secs Computing kpt #: 219 total cpu time spent up to now is 255.5 secs Computing kpt #: 220 total cpu time spent up to now is 256.7 secs Computing kpt #: 221 total cpu time spent up to now is 257.7 secs Computing kpt #: 222 total cpu time spent up to now is 258.8 secs Computing kpt #: 223 total cpu time spent up to now is 259.9 secs Computing kpt #: 224 total cpu time spent up to now is 261.1 secs Computing kpt #: 225 total cpu time spent up to now is 262.2 secs Computing kpt #: 226 total cpu time spent up to now is 263.3 secs Computing kpt #: 227 total cpu time spent up to now is 264.5 secs Computing kpt #: 228 total cpu time spent up to now is 265.6 secs Computing kpt #: 229 total cpu time spent up to now is 266.7 secs Computing kpt #: 230 total cpu time spent up to now is 267.8 secs Computing kpt #: 231 total cpu time spent up to now is 269.0 secs Computing kpt #: 232 total cpu time spent up to now is 270.1 secs Computing kpt #: 233 total cpu time spent up to now is 271.3 secs Computing kpt #: 234 total cpu time spent up to now is 272.4 secs Computing kpt #: 235 total cpu time spent up to now is 273.5 secs Computing kpt #: 236 total cpu time spent up to now is 274.7 secs Computing kpt #: 237 total cpu time spent up to now is 275.8 secs Computing kpt #: 238 total cpu time spent up to now is 276.9 secs Computing kpt #: 239 total cpu time spent up to now is 277.9 secs Computing kpt #: 240 total cpu time spent up to now is 279.1 secs Computing kpt #: 241 total cpu time spent up to now is 280.2 secs Computing kpt #: 242 total cpu time spent up to now is 281.3 secs Computing kpt #: 243 total cpu time spent up to now is 282.5 secs Computing kpt #: 244 total cpu time spent up to now is 283.7 secs Computing kpt #: 245 total cpu time spent up to now is 284.7 secs Computing kpt #: 246 total cpu time spent up to now is 285.8 secs Computing kpt #: 247 total cpu time spent up to now is 286.9 secs Computing kpt #: 248 total cpu time spent up to now is 288.1 secs Computing kpt #: 249 total cpu time spent up to now is 289.1 secs Computing kpt #: 250 total cpu time spent up to now is 290.2 secs Computing kpt #: 251 total cpu time spent up to now is 291.3 secs Computing kpt #: 252 total cpu time spent up to now is 292.4 secs Computing kpt #: 253 total cpu time spent up to now is 293.6 secs Computing kpt #: 254 total cpu time spent up to now is 294.7 secs Computing kpt #: 255 total cpu time spent up to now is 295.8 secs Computing kpt #: 256 total cpu time spent up to now is 296.9 secs Computing kpt #: 257 total cpu time spent up to now is 298.1 secs Computing kpt #: 258 total cpu time spent up to now is 299.2 secs Computing kpt #: 259 total cpu time spent up to now is 300.3 secs Computing kpt #: 260 total cpu time spent up to now is 301.5 secs Computing kpt #: 261 total cpu time spent up to now is 302.5 secs Computing kpt #: 262 total cpu time spent up to now is 303.7 secs Computing kpt #: 263 total cpu time spent up to now is 304.7 secs Computing kpt #: 264 total cpu time spent up to now is 305.9 secs Computing kpt #: 265 total cpu time spent up to now is 307.0 secs Computing kpt #: 266 total cpu time spent up to now is 308.1 secs Computing kpt #: 267 total cpu time spent up to now is 309.1 secs Computing kpt #: 268 total cpu time spent up to now is 310.2 secs Computing kpt #: 269 total cpu time spent up to now is 311.3 secs Computing kpt #: 270 total cpu time spent up to now is 312.4 secs Computing kpt #: 271 total cpu time spent up to now is 313.5 secs Computing kpt #: 272 total cpu time spent up to now is 314.5 secs Computing kpt #: 273 total cpu time spent up to now is 315.7 secs Computing kpt #: 274 total cpu time spent up to now is 317.0 secs Computing kpt #: 275 total cpu time spent up to now is 318.1 secs Computing kpt #: 276 total cpu time spent up to now is 319.4 secs Computing kpt #: 277 total cpu time spent up to now is 320.5 secs Computing kpt #: 278 total cpu time spent up to now is 321.7 secs Computing kpt #: 279 total cpu time spent up to now is 322.9 secs Computing kpt #: 280 total cpu time spent up to now is 324.1 secs Computing kpt #: 281 total cpu time spent up to now is 325.2 secs Computing kpt #: 282 total cpu time spent up to now is 326.3 secs Computing kpt #: 283 total cpu time spent up to now is 327.5 secs Computing kpt #: 284 total cpu time spent up to now is 328.6 secs Computing kpt #: 285 total cpu time spent up to now is 329.7 secs Computing kpt #: 286 total cpu time spent up to now is 330.9 secs Computing kpt #: 287 total cpu time spent up to now is 332.0 secs Computing kpt #: 288 total cpu time spent up to now is 333.1 secs Computing kpt #: 289 total cpu time spent up to now is 334.1 secs ethr = 1.72E-08, avg # of iterations = 17.6 total cpu time spent up to now is 334.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5317 PWs) bands (ev): -8.1009 -8.1009 -6.2521 -6.2521 -6.2429 -6.2429 -6.2342 -6.2342 -1.9763 -1.9763 1.3282 1.3282 1.7248 1.7248 1.8930 1.8930 1.9233 1.9233 1.9620 1.9620 2.2440 2.2440 3.0187 3.0187 3.0348 3.0348 3.0655 3.0655 3.4551 3.4551 3.4609 3.4609 4.6415 4.6415 4.6899 4.6899 4.6975 4.6975 4.7670 4.7670 4.8800 4.8800 4.9351 4.9351 4.9601 4.9601 5.6441 5.6441 6.1407 6.1407 6.2015 6.2015 6.2952 6.2952 6.9276 6.9276 7.7282 7.7282 7.7499 7.7499 7.8549 7.8549 8.2270 8.2270 9.4344 9.4344 10.5956 10.5956 11.0714 11.0714 k = 0.0000 0.0000 0.0204 ( 5313 PWs) bands (ev): -8.1002 -8.1001 -6.2530 -6.2516 -6.2442 -6.2425 -6.2347 -6.2347 -1.9755 -1.9755 1.3273 1.3290 1.7191 1.7244 1.8654 1.8745 1.9320 1.9401 1.9694 1.9786 2.2461 2.2482 3.0172 3.0189 3.0338 3.0350 3.0644 3.0663 3.4536 3.4539 3.4588 3.4608 4.6301 4.6515 4.6786 4.6966 4.6972 4.7044 4.7645 4.7705 4.8693 4.8905 4.9266 4.9458 4.9617 4.9628 5.6423 5.6447 6.1381 6.1413 6.1969 6.2037 6.2949 6.2969 6.9270 6.9290 7.7178 7.7270 7.7456 7.7461 7.8526 7.8535 8.2352 8.2393 9.4374 9.4399 10.5973 10.5974 11.0710 11.0711 k = 0.0000 0.0000 0.0409 ( 5305 PWs) bands (ev): -8.0980 -8.0980 -6.2547 -6.2516 -6.2466 -6.2428 -6.2363 -6.2363 -1.9732 -1.9731 1.3261 1.3295 1.7087 1.7179 1.8265 1.8365 1.9433 1.9613 1.9936 2.0071 2.2546 2.2585 3.0143 3.0174 3.0323 3.0345 3.0631 3.0669 3.4483 3.4495 3.4552 3.4596 4.6184 4.6592 4.6683 4.6975 4.6975 4.7192 4.7629 4.7751 4.8591 4.8998 4.9220 4.9535 4.9656 4.9750 5.6395 5.6442 6.1331 6.1399 6.1903 6.2035 6.2960 6.3002 6.9274 6.9313 7.6912 7.7091 7.7409 7.7409 7.8468 7.8481 8.2621 8.2693 9.4489 9.4538 10.6025 10.6028 11.0700 11.0700 k = 0.0000 0.0000 0.0613 ( 5301 PWs) bands (ev): -8.0946 -8.0945 -6.2575 -6.2519 -6.2500 -6.2435 -6.2388 -6.2388 -1.9694 -1.9693 1.3244 1.3296 1.6960 1.7064 1.7849 1.7940 1.9583 1.9826 2.0227 2.0368 2.2691 2.2743 3.0093 3.0131 3.0314 3.0337 3.0619 3.0673 3.4388 3.4405 3.4516 3.4579 4.6072 4.6588 4.6642 4.6981 4.6985 4.7354 4.7621 4.7807 4.8502 4.9077 4.9215 4.9588 4.9714 4.9960 5.6357 5.6425 6.1253 6.1367 6.1824 6.2011 6.2983 6.3050 6.9286 6.9345 7.6514 7.6747 7.7376 7.7390 7.8374 7.8390 8.3027 8.3116 9.4685 9.4758 10.6110 10.6117 11.0683 11.0686 k = 0.0000 0.0000 0.0818 ( 5305 PWs) bands (ev): -8.0897 -8.0897 -6.2618 -6.2555 -6.2522 -6.2449 -6.2418 -6.2416 -1.9641 -1.9640 1.3221 1.3291 1.6828 1.6913 1.7430 1.7493 1.9769 2.0053 2.0516 2.0652 2.2890 2.2950 3.0014 3.0054 3.0315 3.0331 3.0609 3.0678 3.4256 3.4276 3.4476 3.4555 4.5971 4.6502 4.6670 4.6990 4.6998 4.7514 4.7618 4.7871 4.8433 4.9140 4.9254 4.9649 4.9793 5.0219 5.6306 5.6394 6.1147 6.1318 6.1740 6.1969 6.3016 6.3110 6.9308 6.9385 7.6044 7.6316 7.7345 7.7375 7.8245 7.8263 8.3518 8.3615 9.4961 9.5054 10.6223 10.6238 11.0661 11.0670 k = 0.0000 0.0000 0.1022 ( 5305 PWs) bands (ev): -8.0834 -8.0834 -6.2677 -6.2618 -6.2538 -6.2481 -6.2450 -6.2432 -1.9575 -1.9574 1.3188 1.3277 1.6700 1.6703 1.7035 1.7059 1.9977 2.0290 2.0798 2.0922 2.3132 2.3196 2.9904 2.9944 3.0324 3.0330 3.0602 3.0684 3.4094 3.4117 3.4431 3.4525 4.5884 4.6427 4.6681 4.7001 4.7014 4.7620 4.7653 4.7944 4.8388 4.9191 4.9339 4.9725 4.9898 5.0517 5.6244 5.6347 6.1010 6.1251 6.1654 6.1911 6.3060 6.3183 6.9338 6.9432 7.5537 7.5843 7.7311 7.7356 7.8082 7.8103 8.4054 8.4154 9.5310 9.5421 10.6361 10.6389 11.0637 11.0656 k = 0.0000 0.0000 0.1226 ( 5307 PWs) bands (ev): -8.0758 -8.0758 -6.2752 -6.2697 -6.2568 -6.2530 -6.2474 -6.2439 -1.9496 -1.9494 1.3142 1.3251 1.6348 1.6519 1.6648 1.6829 2.0194 2.0529 2.1073 2.1183 2.3407 2.3471 2.9761 2.9802 3.0334 3.0339 3.0597 3.0690 3.3907 3.3933 3.4380 3.4488 4.5811 4.6366 4.6683 4.7015 4.7034 4.7624 4.7756 4.8025 4.8373 4.9234 4.9462 4.9813 5.0040 5.0848 5.6170 5.6283 6.0849 6.1167 6.1569 6.1842 6.3114 6.3268 6.9377 6.9486 7.5015 7.5352 7.7269 7.7332 7.7887 7.7915 8.4608 8.4708 9.5726 9.5853 10.6517 10.6564 11.0612 11.0645 k = 0.0000 0.0000 0.1431 ( 5299 PWs) bands (ev): -8.0669 -8.0669 -6.2842 -6.2790 -6.2616 -6.2587 -6.2488 -6.2444 -1.9406 -1.9403 1.3082 1.3210 1.5909 1.6065 1.6550 1.6702 2.0413 2.0762 2.1348 2.1443 2.3704 2.3766 2.9589 2.9631 3.0342 3.0356 3.0592 3.0696 3.3704 3.3733 3.4323 3.4443 4.5752 4.6322 4.6678 4.7031 4.7060 4.7630 4.7818 4.8112 4.8388 4.9275 4.9604 4.9909 5.0236 5.1209 5.6084 5.6201 6.0670 6.1067 6.1485 6.1766 6.3178 6.3364 6.9425 6.9548 7.4495 7.4859 7.7214 7.7297 7.7665 7.7705 8.5161 8.5260 9.6204 9.6342 10.6685 10.6758 11.0586 11.0637 k = 0.0000 0.0000 0.1635 ( 5295 PWs) bands (ev): -8.0567 -8.0566 -6.2946 -6.2896 -6.2676 -6.2652 -6.2498 -6.2448 -1.9305 -1.9302 1.3009 1.3154 1.5443 1.5585 1.6502 1.6623 2.0629 2.0987 2.1627 2.1706 2.4015 2.4074 2.9388 2.9432 3.0352 3.0376 3.0588 3.0702 3.3491 3.3523 3.4262 3.4393 4.5704 4.6297 4.6670 4.7048 4.7090 4.7637 4.7846 4.8206 4.8427 4.9317 4.9745 5.0010 5.0499 5.1598 5.5986 5.6098 6.0480 6.0953 6.1400 6.1684 6.3253 6.3471 6.9480 6.9614 7.3984 7.4375 7.7125 7.7230 7.7442 7.7495 8.5700 8.5798 9.6734 9.6881 10.6858 10.6963 11.0558 11.0628 k = 0.0000 0.0000 0.1840 ( 5291 PWs) bands (ev): -8.0452 -8.0451 -6.3063 -6.3013 -6.2746 -6.2723 -6.2507 -6.2453 -1.9195 -1.9191 1.2924 1.3083 1.4968 1.5101 1.6483 1.6575 2.0836 2.1199 2.1913 2.1977 2.4331 2.4386 2.9161 2.9207 3.0365 3.0398 3.0585 3.0707 3.3277 3.3311 3.4196 3.4336 4.5665 4.6291 4.6662 4.7065 4.7125 4.7645 4.7851 4.8309 4.8479 4.9361 4.9875 5.0113 5.0827 5.2012 5.5875 5.5973 6.0285 6.0825 6.1313 6.1597 6.3338 6.3587 6.9543 6.9686 7.3490 7.3907 7.6962 7.7043 7.7309 7.7332 8.6214 8.6312 9.7309 9.7462 10.7028 10.7173 11.0521 11.0610 k = 0.0000 0.0000 0.2044 ( 5285 PWs) bands (ev): -8.0324 -8.0324 -6.3190 -6.3141 -6.2823 -6.2801 -6.2517 -6.2459 -1.9078 -1.9073 1.2829 1.3002 1.4491 1.4617 1.6485 1.6549 2.1035 2.1396 2.2210 2.2259 2.4648 2.4700 2.8910 2.8958 3.0380 3.0421 3.0579 3.0710 3.3070 3.3105 3.4127 3.4274 4.5635 4.6305 4.6657 4.7084 4.7166 4.7653 4.7842 4.8423 4.8538 4.9411 4.9995 5.0216 5.1210 5.2448 5.5754 5.5829 6.0090 6.0687 6.1222 6.1507 6.3433 6.3713 6.9612 6.9762 7.3016 7.3457 7.6709 7.6754 7.7231 7.7248 8.6697 8.6796 9.7921 9.8076 10.7192 10.7380 11.0470 11.0572 k = 0.0000 0.0000 0.2248 ( 5283 PWs) bands (ev): -8.0185 -8.0184 -6.3328 -6.3279 -6.2906 -6.2884 -6.2528 -6.2467 -1.8955 -1.8949 1.2731 1.2912 1.4014 1.4136 1.6499 1.6537 2.1225 2.1579 2.2517 2.2552 2.4963 2.5010 2.8637 2.8687 3.0395 3.0445 3.0572 3.0709 3.2878 3.2912 3.4055 3.4209 4.5612 4.6338 4.6656 4.7103 4.7211 4.7663 4.7825 4.8540 4.8608 4.9466 5.0109 5.0320 5.1635 5.2905 5.5624 5.5665 5.9896 6.0539 6.1128 6.1413 6.3539 6.3847 6.9687 6.9841 7.2567 7.3029 7.6406 7.6430 7.7159 7.7200 8.7142 8.7243 9.8562 9.8716 10.7347 10.7579 11.0400 11.0511 k = 0.0000 0.0000 0.2453 ( 5275 PWs) bands (ev): -8.0034 -8.0033 -6.3473 -6.3424 -6.2995 -6.2973 -6.2540 -6.2477 -1.8827 -1.8820 1.2631 1.2820 1.3540 1.3659 1.6516 1.6529 2.1409 2.1750 2.2836 2.2858 2.5272 2.5315 2.8345 2.8397 3.0408 3.0469 3.0565 3.0705 3.2706 3.2738 3.3981 3.4139 4.5597 4.6388 4.6660 4.7122 4.7261 4.7673 4.7805 4.8619 4.8731 4.9530 5.0220 5.0424 5.2095 5.3380 5.5484 5.5487 5.9704 6.0381 6.1032 6.1317 6.3656 6.3989 6.9768 6.9921 7.2145 7.2626 7.6076 7.6087 7.7097 7.7151 8.7548 8.7651 9.9225 9.9374 10.7492 10.7769 11.0307 11.0424 k = 0.0000 0.0000 0.2657 ( 5275 PWs) bands (ev): -7.9872 -7.9871 -6.3626 -6.3576 -6.3088 -6.3066 -6.2556 -6.2490 -1.8697 -1.8689 1.2532 1.2730 1.3070 1.3191 1.6513 1.6526 2.1589 2.1910 2.3166 2.3176 2.5573 2.5612 2.8038 2.8091 3.0417 3.0491 3.0559 3.0697 3.2560 3.2586 3.3905 3.4067 4.5589 4.6450 4.6669 4.7139 4.7315 4.7684 4.7781 4.8668 4.8892 4.9605 5.0332 5.0529 5.2581 5.3872 5.5291 5.5346 5.9512 6.0211 6.0932 6.1216 6.3782 6.4138 6.9852 7.0000 7.1755 7.2249 7.5732 7.5733 7.7037 7.7101 8.7911 8.8018 9.9901 10.0044 10.7630 10.7948 11.0193 11.0314 k = 0.0000 0.0000 0.2862 ( 5273 PWs) bands (ev): -7.9700 -7.9699 -6.3783 -6.3734 -6.3186 -6.3164 -6.2575 -6.2506 -1.8565 -1.8556 1.2425 1.2604 1.2648 1.2746 1.6480 1.6518 2.1768 2.2065 2.3504 2.3506 2.5866 2.5901 2.7722 2.7775 3.0416 3.0510 3.0557 3.0687 3.2442 3.2461 3.3829 3.3992 4.5588 4.6522 4.6683 4.7155 4.7372 4.7697 4.7756 4.8706 4.9074 4.9691 5.0448 5.0636 5.3087 5.4378 5.5089 5.5204 5.9316 6.0028 6.0829 6.1113 6.3918 6.4294 6.9941 7.0073 7.1402 7.1899 7.5374 7.5382 7.6977 7.7047 8.8231 8.8342 10.0584 10.0718 10.7765 10.8119 11.0058 11.0183 k = 0.0000 0.0000 0.3066 ( 5277 PWs) bands (ev): -7.9518 -7.9517 -6.3945 -6.3895 -6.3288 -6.3266 -6.2597 -6.2526 -1.8434 -1.8424 1.2149 1.2187 1.2451 1.2572 1.6421 1.6483 2.1949 2.2218 2.3842 2.3855 2.6148 2.6179 2.7403 2.7456 3.0405 3.0520 3.0564 3.0680 3.2353 3.2361 3.3753 3.3916 4.5593 4.6596 4.6702 4.7170 4.7432 4.7713 4.7729 4.8735 4.9268 4.9791 5.0572 5.0747 5.3608 5.4885 5.4890 5.5068 5.9114 5.9829 6.0724 6.1006 6.4062 6.4454 7.0031 7.0130 7.1096 7.1578 7.5016 7.5033 7.6917 7.6992 8.8507 8.8623 10.1267 10.1391 10.7898 10.8284 10.9904 11.0035 k = 0.0000 0.0000 0.3270 ( 5271 PWs) bands (ev): -7.9327 -7.9325 -6.4110 -6.4060 -6.3393 -6.3371 -6.2623 -6.2550 -1.8305 -1.8293 1.1701 1.1771 1.2357 1.2509 1.6331 1.6415 2.2131 2.2368 2.4187 2.4211 2.6414 2.6446 2.7095 2.7143 3.0383 3.0518 3.0578 3.0680 3.2287 3.2291 3.3676 3.3840 4.5605 4.6667 4.6727 4.7186 4.7496 4.7702 4.7734 4.8755 4.9470 4.9906 5.0711 5.0864 5.4139 5.4684 5.4924 5.5423 5.8900 5.9612 6.0618 6.0898 6.4215 6.4617 7.0122 7.0151 7.0861 7.1288 7.4665 7.4690 7.6857 7.6935 8.8741 8.8862 10.1945 10.2055 10.8034 10.8447 10.9732 10.9870 k = 0.0000 0.0000 0.3475 ( 5263 PWs) bands (ev): -7.9128 -7.9125 -6.4275 -6.4225 -6.3501 -6.3478 -6.2654 -6.2578 -1.8178 -1.8166 1.1262 1.1337 1.2304 1.2458 1.6207 1.6311 2.2309 2.2513 2.4537 2.4572 2.6617 2.6690 2.6857 2.6860 3.0354 3.0503 3.0597 3.0690 3.2236 3.2253 3.3601 3.3763 4.5623 4.6726 4.6756 4.7207 4.7562 4.7675 4.7760 4.8764 4.9673 5.0037 5.0871 5.0990 5.4471 5.4695 5.4794 5.5954 5.8669 5.9372 6.0510 6.0788 6.4374 6.4783 7.0098 7.0212 7.0733 7.1032 7.4327 7.4360 7.6796 7.6875 8.8933 8.9059 10.2610 10.2706 10.8172 10.8607 10.9546 10.9692 k = 0.0000 0.0000 0.3679 ( 5271 PWs) bands (ev): -7.8921 -7.8918 -6.4441 -6.4391 -6.3610 -6.3587 -6.2690 -6.2612 -1.8056 -1.8042 1.0834 1.0908 1.2271 1.2420 1.6052 1.6171 2.2470 2.2642 2.4890 2.4935 2.6480 2.6570 2.6961 2.6984 3.0320 3.0475 3.0618 3.0708 3.2205 3.2235 3.3527 3.3687 4.5646 4.6765 4.6789 4.7234 4.7619 4.7657 4.7791 4.8761 4.9869 5.0182 5.1061 5.1128 5.4291 5.4672 5.5232 5.6489 5.8420 5.9107 6.0401 6.0676 6.4539 6.4948 6.9971 7.0291 7.0714 7.0818 7.4008 7.4049 7.6735 7.6814 8.9085 8.9214 10.3257 10.3335 10.8307 10.8756 10.9355 10.9507 k = 0.0000 0.0000 0.3883 ( 5279 PWs) bands (ev): -7.8707 -7.8704 -6.4605 -6.4555 -6.3721 -6.3698 -6.2731 -6.2652 -1.7939 -1.7924 1.0418 1.0490 1.2252 1.2392 1.5869 1.5998 2.2595 2.2738 2.5244 2.5297 2.6281 2.6365 2.7193 2.7217 3.0282 3.0442 3.0641 3.0729 3.2191 3.2235 3.3454 3.3611 4.5674 4.6778 4.6824 4.7273 4.7608 4.7709 4.7831 4.8747 5.0049 5.0339 5.1285 5.1288 5.4114 5.4557 5.5776 5.7024 5.8148 5.8815 6.0294 6.0564 6.4707 6.5111 6.9823 7.0339 7.0667 7.0754 7.3711 7.3761 7.6675 7.6753 8.9197 8.9331 10.3879 10.3935 10.8424 10.8834 10.9224 10.9338 k = 0.0000 0.0000 0.4088 ( 5281 PWs) bands (ev): -7.8488 -7.8484 -6.4766 -6.4716 -6.3832 -6.3809 -6.2778 -6.2697 -1.7827 -1.7812 1.0014 1.0084 1.2243 1.2372 1.5668 1.5802 2.2659 2.2779 2.5597 2.5652 2.6154 2.6242 2.7417 2.7450 3.0241 3.0403 3.0663 3.0751 3.2191 3.2247 3.3384 3.3537 4.5707 4.6767 4.6862 4.7320 4.7578 4.7781 4.7878 4.8722 5.0210 5.0502 5.1468 5.1557 5.3950 5.4452 5.6317 5.7556 5.7854 5.8495 6.0188 6.0453 6.4878 6.5268 6.9690 7.0307 7.0630 7.0818 7.3442 7.3500 7.6616 7.6692 8.9271 8.9408 10.4468 10.4497 10.8466 10.8699 10.9244 10.9297 k = 0.0000 0.0000 0.4292 ( 5289 PWs) bands (ev): -7.8264 -7.8260 -6.4922 -6.4873 -6.3943 -6.3920 -6.2832 -6.2749 -1.7723 -1.7706 0.9623 0.9690 1.2238 1.2352 1.5461 1.5593 2.2641 2.2742 2.5945 2.5974 2.6128 2.6247 2.7629 2.7676 3.0197 3.0360 3.0686 3.0774 3.2202 3.2270 3.3316 3.3465 4.5743 4.6736 4.6901 4.7371 4.7547 4.7854 4.7933 4.8689 5.0351 5.0663 5.1682 5.1866 5.3798 5.4355 5.6844 5.7543 5.8061 5.8165 6.0087 6.0345 6.5047 6.5418 6.9588 7.0223 7.0680 7.0891 7.3203 7.3269 7.6559 7.6631 8.9307 8.9447 10.5011 10.5016 10.8359 10.8439 10.9307 10.9490 k = 0.0000 0.0000 0.4497 ( 5293 PWs) bands (ev): -7.8037 -7.8032 -6.5074 -6.5024 -6.4053 -6.4030 -6.2891 -6.2808 -1.7625 -1.7608 0.9246 0.9310 1.2230 1.2324 1.5262 1.5385 2.2531 2.2621 2.6185 2.6204 2.6293 2.6461 2.7832 2.7894 3.0151 3.0315 3.0708 3.0796 3.2222 3.2299 3.3251 3.3395 4.5783 4.6692 4.6941 4.7421 4.7515 4.7927 4.7994 4.8648 5.0476 5.0817 5.1934 5.2211 5.3658 5.4266 5.7149 5.7422 5.7765 5.8596 5.9993 6.0245 6.5213 6.5557 6.9524 7.0149 7.0755 7.0966 7.2997 7.3072 7.6506 7.6573 8.9306 8.9448 10.5464 10.5513 10.8127 10.8132 10.9509 10.9733 k = 0.0000 0.0000 0.4701 ( 5313 PWs) bands (ev): -7.7807 -7.7801 -6.5218 -6.5169 -6.4162 -6.4140 -6.2958 -6.2874 -1.7536 -1.7518 0.8884 0.8945 1.2206 1.2276 1.5088 1.5195 2.2340 2.2423 2.6372 2.6382 2.6624 2.6784 2.8024 2.8105 3.0103 3.0268 3.0729 3.0816 3.2248 3.2333 3.3188 3.3328 4.5824 4.6640 4.6980 4.7468 4.7481 4.7997 4.8062 4.8603 5.0585 5.0958 5.2225 5.2584 5.3529 5.4184 5.6826 5.7366 5.7890 5.9077 5.9914 6.0165 6.5373 6.5681 6.9501 7.0104 7.0835 7.1041 7.2825 7.2909 7.6455 7.6516 8.9268 8.9412 10.5845 10.5948 10.7792 10.7829 10.9801 11.0018 k = 0.0000 0.0000 0.4905 ( 5313 PWs) bands (ev): -7.7576 -7.7569 -6.5355 -6.5306 -6.4269 -6.4247 -6.3032 -6.2947 -1.7453 -1.7435 0.8537 0.8595 1.2156 1.2197 1.4957 1.5041 2.2090 2.2170 2.6607 2.6628 2.6946 2.7118 2.8205 2.8308 3.0056 3.0221 3.0749 3.0835 3.2279 3.2371 3.3129 3.3264 4.5866 4.6585 4.7019 4.7448 4.7512 4.8063 4.8137 4.8561 5.0684 5.1085 5.2552 5.2968 5.3419 5.4106 5.6468 5.6948 5.8348 5.9478 5.9864 6.0154 6.5523 6.5790 6.9522 7.0099 7.0915 7.1117 7.2688 7.2782 7.6409 7.6464 8.9194 8.9338 10.6138 10.6310 10.7426 10.7500 11.0161 11.0345 k = 0.0000 0.0000 0.5110 ( 5313 PWs) bands (ev): -7.7345 -7.7338 -6.5482 -6.5433 -6.4374 -6.4353 -6.3113 -6.3028 -1.7379 -1.7360 0.8206 0.8260 1.2066 1.2078 1.4881 1.4939 2.1803 2.1881 2.6878 2.6915 2.7255 2.7446 2.8378 2.8504 3.0012 3.0178 3.0768 3.0852 3.2312 3.2410 3.3073 3.3204 4.5908 4.6531 4.7055 4.7414 4.7551 4.8115 4.8215 4.8528 5.0771 5.1198 5.2911 5.3188 5.3493 5.4031 5.6108 5.6520 5.8734 5.9657 5.9876 6.0354 6.5660 6.5881 6.9586 7.0134 7.0994 7.1193 7.2583 7.2689 7.6368 7.6415 8.9082 8.9225 10.6312 10.6565 10.7067 10.7181 11.0577 11.0715 k = 0.0000 0.0000 0.5314 ( 5305 PWs) bands (ev): -7.7115 -7.7108 -6.5599 -6.5551 -6.4475 -6.4455 -6.3201 -6.3116 -1.7311 -1.7293 0.7891 0.7943 1.1914 1.1931 1.4866 1.4897 2.1497 2.1575 2.7162 2.7218 2.7548 2.7763 2.8541 2.8695 2.9979 3.0145 3.0785 3.0868 3.2348 3.2450 3.3021 3.3146 4.5947 4.6482 4.7090 4.7380 4.7588 4.8145 4.8297 4.8517 5.0847 5.1296 5.3093 5.3293 5.3891 5.3958 5.5760 5.6091 5.8984 5.9640 6.0013 6.0734 6.5781 6.5955 6.9691 7.0214 7.1072 7.1270 7.2511 7.2630 7.6332 7.6371 8.8932 8.9074 10.6265 10.6462 10.6966 10.6983 11.1035 11.1119 k = 0.0000 0.0000 0.5519 ( 5298 PWs) bands (ev): -7.6889 -7.6881 -6.5704 -6.5656 -6.4573 -6.4554 -6.3296 -6.3211 -1.7251 -1.7233 0.7593 0.7641 1.1712 1.1753 1.4909 1.4917 2.1188 2.1264 2.7435 2.7508 2.7823 2.8065 2.8697 2.8880 2.9968 3.0131 3.0802 3.0881 3.2384 3.2489 3.2972 3.3092 4.5980 4.6443 4.7122 4.7345 4.7623 4.8144 4.8380 4.8536 5.0908 5.1379 5.2951 5.3665 5.3904 5.4335 5.5438 5.5675 5.9077 5.9569 6.0292 6.1150 6.5883 6.6010 6.9834 7.0339 7.1148 7.1352 7.2467 7.2602 7.6302 7.6332 8.8745 8.8884 10.5953 10.6042 10.6963 10.7091 11.1522 11.1547 k = 0.0000 0.0000 0.5723 ( 5294 PWs) bands (ev): -7.6667 -7.6659 -6.5797 -6.5750 -6.4668 -6.4649 -6.3398 -6.3314 -1.7198 -1.7180 0.7313 0.7358 1.1481 1.1539 1.4990 1.4998 2.0886 2.0962 2.7672 2.7758 2.8077 2.8349 2.8847 2.9061 2.9994 3.0150 3.0819 3.0893 3.2421 3.2526 3.2927 3.3042 4.6005 4.6418 4.7149 4.7311 4.7656 4.8119 4.8464 4.8581 5.0950 5.1443 5.2789 5.3719 5.4161 5.4785 5.5156 5.5292 5.9078 5.9487 6.0646 6.1558 6.5966 6.6048 7.0008 7.0508 7.1226 7.1440 7.2448 7.2604 7.6276 7.6298 8.8519 8.8654 10.5517 10.5562 10.6992 10.7193 11.1982 11.2020 k = 0.0000 0.0000 0.5927 ( 5294 PWs) bands (ev): -7.6452 -7.6444 -6.5876 -6.5829 -6.4757 -6.4739 -6.3507 -6.3424 -1.7152 -1.7134 0.7050 0.7092 1.1233 1.1301 1.5102 1.5122 2.0602 2.0677 2.7849 2.7940 2.8309 2.8609 2.8994 2.9237 3.0076 3.0219 3.0835 3.0904 3.2456 3.2562 3.2886 3.2995 4.6019 4.6410 4.7171 4.7278 4.7688 4.8080 4.8548 4.8640 5.0964 5.1482 5.2614 5.3587 5.4562 5.4909 5.4979 5.5248 5.9046 5.9406 6.1017 6.1942 6.6028 6.6073 7.0208 7.0720 7.1304 7.1536 7.2453 7.2634 7.6256 7.6269 8.8256 8.8386 10.5029 10.5053 10.7009 10.7253 11.2403 11.2509 k = 0.0000 0.0000 0.6132 ( 5300 PWs) bands (ev): -7.6244 -7.6236 -6.5941 -6.5895 -6.4842 -6.4825 -6.3622 -6.3541 -1.7112 -1.7094 0.6805 0.6844 1.0978 1.1052 1.5240 1.5267 2.0345 2.0418 2.7949 2.8036 2.8518 2.8841 2.9140 2.9408 3.0223 3.0347 3.0854 3.0914 3.2489 3.2595 3.2848 3.2951 4.6023 4.6421 4.7184 4.7249 4.7721 4.8037 4.8631 4.8705 5.0937 5.1489 5.2443 5.3404 5.4664 5.4723 5.5052 5.5692 5.9006 5.9331 6.1377 6.2296 6.6073 6.6085 7.0425 7.0970 7.1386 7.1645 7.2479 7.2692 7.6241 7.6246 8.7957 8.8079 10.4514 10.4527 10.7003 10.7273 11.2791 11.2967 k = 0.0000 0.0000 0.6336 ( 5302 PWs) bands (ev): -7.6046 -7.6038 -6.5992 -6.5946 -6.4922 -6.4906 -6.3743 -6.3663 -1.7077 -1.7060 0.6579 0.6615 1.0724 1.0799 1.5389 1.5420 2.0122 2.0194 2.7970 2.8047 2.8705 2.9037 2.9291 2.9574 3.0423 3.0530 3.0879 3.0926 3.2521 3.2625 3.2813 3.2912 4.6021 4.6446 4.7177 4.7233 4.7754 4.7996 4.8713 4.8772 5.0855 5.1452 5.2298 5.3191 5.4506 5.4581 5.5460 5.6121 5.8973 5.9266 6.1714 6.2615 6.6088 6.6101 7.0650 7.1250 7.1473 7.1767 7.2527 7.2780 7.6228 7.6231 8.7622 8.7737 10.3984 10.3990 10.6974 10.7258 11.3130 11.3373 k = 0.0000 0.0000 0.6541 ( 5308 PWs) bands (ev): -7.5859 -7.5851 -6.6027 -6.5981 -6.4996 -6.4981 -6.3869 -6.3791 -1.7047 -1.7031 0.6372 0.6404 1.0478 1.0552 1.5537 1.5568 1.9943 2.0012 2.7923 2.7988 2.8869 2.9190 2.9454 2.9733 3.0636 3.0740 3.0934 3.0954 3.2551 3.2653 3.2783 3.2875 4.6019 4.6481 4.7151 4.7229 4.7787 4.7959 4.8792 4.8837 5.0711 5.1354 5.2197 5.2982 5.4396 5.4478 5.5871 5.6522 5.8958 5.9215 6.2022 6.2895 6.6084 6.6116 7.0870 7.1518 7.1596 7.1902 7.2600 7.2903 7.6214 7.6224 8.7257 8.7361 10.3450 10.3450 10.6927 10.7213 11.3413 11.3709 k = 0.0000 0.0000 0.6745 ( 5306 PWs) bands (ev): -7.5685 -7.5676 -6.6046 -6.6001 -6.5063 -6.5050 -6.3999 -6.3923 -1.7022 -1.7007 0.6184 0.6212 1.0246 1.0316 1.5671 1.5701 1.9813 1.9878 2.7824 2.7879 2.9014 2.9306 2.9623 2.9882 3.0772 3.0873 3.1081 3.1085 3.2578 3.2677 3.2756 3.2842 4.6020 4.6523 4.7117 4.7224 4.7823 4.7931 4.8868 4.8898 5.0515 5.1189 5.2144 5.2811 5.4327 5.4405 5.6261 5.6883 5.8971 5.9183 6.2298 6.3134 6.6076 6.6120 7.1077 7.1635 7.1874 7.2046 7.2710 7.3066 7.6204 7.6220 8.6865 8.6959 10.2917 10.2921 10.6865 10.7145 11.3643 11.3972 k = 0.0000 0.0000 0.6949 ( 5322 PWs) bands (ev): -7.5524 -7.5516 -6.6050 -6.6005 -6.5125 -6.5112 -6.4131 -6.4058 -1.7000 -1.6987 0.6015 0.6040 1.0031 1.0096 1.5782 1.5810 1.9736 1.9797 2.7689 2.7736 2.9140 2.9396 2.9786 3.0019 3.0821 3.0903 3.1317 3.1325 3.2602 3.2699 3.2733 3.2812 4.6029 4.6567 4.7079 4.7211 4.7860 4.7914 4.8939 4.8952 5.0290 5.0961 5.2127 5.2689 5.4285 5.4355 5.6619 5.7186 5.9022 5.9175 6.2537 6.3327 6.6064 6.6115 7.1265 7.1727 7.2145 7.2191 7.2879 7.3272 7.6198 7.6218 8.6453 8.6535 10.2399 10.2406 10.6793 10.7061 11.3830 11.4169 k = 0.0000 0.0000 0.7154 ( 5324 PWs) bands (ev): -7.5380 -7.5372 -6.6040 -6.5995 -6.5180 -6.5169 -6.4264 -6.4194 -1.6983 -1.6971 0.5865 0.5888 0.9835 0.9894 1.5866 1.5890 1.9713 1.9768 2.7532 2.7573 2.9249 2.9469 2.9936 3.0141 3.0843 3.0914 3.1563 3.1580 3.2623 3.2713 3.2717 3.2785 4.6047 4.6612 4.7038 4.7186 4.7899 4.7911 4.8998 4.9005 5.0060 5.0693 5.2136 5.2610 5.4261 5.4321 5.6933 5.7420 5.9120 5.9198 6.2743 6.3478 6.6052 6.6105 7.1432 7.1813 7.2329 7.2355 7.3131 7.3519 7.6194 7.6219 8.6030 8.6099 10.1908 10.1917 10.6718 10.6965 11.3985 11.4314 k = 0.0000 0.0000 0.7358 ( 5332 PWs) bands (ev): -7.5251 -7.5245 -6.6015 -6.5971 -6.5228 -6.5218 -6.4396 -6.4330 -1.6968 -1.6957 0.5736 0.5755 0.9663 0.9715 1.5920 1.5940 1.9736 1.9785 2.7365 2.7401 2.9343 2.9528 3.0070 3.0249 3.0858 3.0921 3.1795 3.1823 3.2640 3.2697 3.2731 3.2762 4.6075 4.6657 4.6989 4.7151 4.7924 4.7940 4.9031 4.9066 4.9844 5.0406 5.2159 5.2558 5.4247 5.4299 5.7193 5.7581 5.9257 5.9260 6.2917 6.3585 6.6039 6.6091 7.1579 7.1892 7.2455 7.2503 7.3451 7.3797 7.6193 7.6220 8.5606 8.5662 10.1454 10.1464 10.6644 10.6865 11.4116 11.4420 k = 0.0000 0.0000 0.7563 ( 5332 PWs) bands (ev): -7.5141 -7.5135 -6.5978 -6.5935 -6.5269 -6.5260 -6.4524 -6.4462 -1.6956 -1.6947 0.5626 0.5642 0.9515 0.9559 1.5949 1.5965 1.9796 1.9838 2.7199 2.7230 2.9422 2.9575 3.0186 3.0338 3.0871 3.0926 3.2003 3.2043 3.2652 3.2686 3.2735 3.2749 4.6115 4.6702 4.6932 4.7110 4.7953 4.7982 4.9048 4.9119 4.9660 5.0123 5.2191 5.2520 5.4242 5.4285 5.7394 5.7681 5.9352 5.9424 6.3061 6.3650 6.6028 6.6076 7.1706 7.1960 7.2567 7.2615 7.3799 7.4086 7.6195 7.6222 8.5197 8.5240 10.1047 10.1057 10.6576 10.6766 11.4229 11.4496 k = 0.0000 0.0000 0.7767 ( 5334 PWs) bands (ev): -7.5049 -7.5044 -6.5932 -6.5891 -6.5302 -6.5295 -6.4643 -6.4588 -1.6947 -1.6939 0.5536 0.5549 0.9393 0.9429 1.5959 1.5971 1.9877 1.9911 2.7044 2.7070 2.9489 2.9610 3.0283 3.0407 3.0884 3.0931 3.2182 3.2233 3.2654 3.2683 3.2720 3.2752 4.6167 4.6746 4.6861 4.7066 4.7995 4.8026 4.9044 4.9163 4.9520 4.9856 5.2226 5.2490 5.4241 5.4276 5.7538 5.7737 5.9472 5.9588 6.3182 6.3679 6.6019 6.6060 7.1814 7.2014 7.2664 7.2704 7.4139 7.4366 7.6198 7.6224 8.4819 8.4850 10.0698 10.0707 10.6518 10.6674 11.4327 11.4549 k = 0.0000 0.0000 0.7971 ( 5320 PWs) bands (ev): -7.4977 -7.4973 -6.5880 -6.5844 -6.5328 -6.5322 -6.4749 -6.4703 -1.6939 -1.6934 0.5467 0.5476 0.9298 0.9325 1.5958 1.5966 1.9963 1.9989 2.6911 2.6931 2.9543 2.9633 3.0362 3.0457 3.0897 3.0934 3.2329 3.2390 3.2647 3.2686 3.2705 3.2754 4.6232 4.6777 4.6789 4.7025 4.8047 4.8069 4.9021 4.9196 4.9432 4.9619 5.2264 5.2462 5.4244 5.4270 5.7635 5.7765 5.9603 5.9727 6.3285 6.3676 6.6014 6.6046 7.1904 7.2052 7.2745 7.2775 7.4446 7.4614 7.6203 7.6225 8.4491 8.4513 10.0416 10.0424 10.6474 10.6593 11.4411 11.4583 k = 0.0000 0.0000 0.8176 ( 5324 PWs) bands (ev): -7.4925 -7.4922 -6.5829 -6.5801 -6.5346 -6.5342 -6.4834 -6.4799 -1.6934 -1.6930 0.5418 0.5424 0.9231 0.9249 1.5952 1.5957 2.0039 2.0057 2.6808 2.6822 2.9586 2.9646 3.0422 3.0487 3.0909 3.0935 3.2441 3.2512 3.2636 3.2691 3.2691 3.2748 4.6308 4.6683 4.6830 4.6985 4.8097 4.8107 4.8997 4.9202 4.9383 4.9434 5.2301 5.2433 5.4248 5.4265 5.7698 5.7775 5.9724 5.9826 6.3376 6.3645 6.6011 6.6033 7.1974 7.2072 7.2807 7.2827 7.4694 7.4804 7.6209 7.6226 8.4236 8.4249 10.0209 10.0214 10.6446 10.6527 11.4480 11.4597 k = 0.0000 0.0000 0.8380 ( 5324 PWs) bands (ev): -7.4893 -7.4892 -6.5789 -6.5773 -6.5357 -6.5355 -6.4887 -6.4868 -1.6930 -1.6929 0.5389 0.5392 0.9193 0.9202 1.5946 1.5949 2.0092 2.0101 2.6744 2.6752 2.9617 2.9647 3.0464 3.0497 3.0920 3.0933 3.2523 3.2591 3.2624 3.2678 3.2698 3.2733 4.6393 4.6585 4.6870 4.6946 4.8134 4.8136 4.9002 4.9142 4.9350 4.9357 5.2337 5.2403 5.4253 5.4261 5.7737 5.7773 5.9818 5.9876 6.3457 6.3595 6.6011 6.6022 7.2027 7.2075 7.2848 7.2858 7.4863 7.4918 7.6216 7.6225 8.4074 8.4080 10.0082 10.0085 10.6437 10.6478 11.4535 11.4594 k = 0.0000 0.0000 0.8585 ( 5320 PWs) bands (ev): -7.4882 -7.4882 -6.5768 -6.5768 -6.5360 -6.5360 -6.4900 -6.4900 -1.6929 -1.6929 0.5380 0.5380 0.9183 0.9183 1.5945 1.5945 2.0114 2.0114 2.6725 2.6725 2.9638 2.9638 3.0489 3.0489 3.0928 3.0928 3.2576 3.2576 3.2656 3.2656 3.2713 3.2713 4.6487 4.6487 4.6908 4.6908 4.8147 4.8147 4.9054 4.9054 4.9344 4.9344 5.2371 5.2371 5.4257 5.4257 5.7760 5.7760 5.9872 5.9872 6.3531 6.3531 6.6015 6.6015 7.2060 7.2060 7.2865 7.2865 7.4939 7.4939 7.6221 7.6221 8.4020 8.4020 10.0041 10.0041 10.6448 10.6448 11.4573 11.4573 k = 0.0000 0.0000 0.8585 ( 5320 PWs) bands (ev): -7.4882 -7.4882 -6.5768 -6.5768 -6.5360 -6.5360 -6.4900 -6.4900 -1.6929 -1.6929 0.5380 0.5380 0.9183 0.9183 1.5945 1.5945 2.0114 2.0114 2.6725 2.6725 2.9638 2.9638 3.0489 3.0489 3.0928 3.0928 3.2576 3.2576 3.2656 3.2656 3.2713 3.2713 4.6487 4.6487 4.6908 4.6908 4.8147 4.8147 4.9054 4.9054 4.9344 4.9344 5.2371 5.2371 5.4257 5.4257 5.7760 5.7760 5.9872 5.9872 6.3531 6.3531 6.6015 6.6015 7.2060 7.2060 7.2865 7.2865 7.4939 7.4939 7.6221 7.6221 8.4020 8.4020 10.0041 10.0041 10.6448 10.6448 11.4573 11.4573 k =-0.0117 0.0163 0.8585 ( 5320 PWs) bands (ev): -7.4883 -7.4883 -6.5765 -6.5763 -6.5368 -6.5361 -6.4903 -6.4897 -1.6922 -1.6921 0.5392 0.5395 0.9193 0.9197 1.5944 1.5947 2.0110 2.0119 2.6719 2.6735 2.9625 2.9646 3.0481 3.0493 3.0920 3.0931 3.2469 3.2500 3.2639 3.2670 3.2786 3.2794 4.6428 4.6531 4.6858 4.6962 4.8132 4.8153 4.9022 4.9074 4.9335 4.9365 5.2308 5.2451 5.4237 5.4267 5.7727 5.7781 5.9837 5.9863 6.3510 6.3537 6.6040 6.6044 7.2048 7.2062 7.2842 7.2862 7.4938 7.4941 7.6190 7.6201 8.4035 8.4035 10.0042 10.0062 10.6474 10.6513 11.4567 11.4568 k =-0.0233 0.0326 0.8585 ( 5322 PWs) bands (ev): -7.4888 -7.4888 -6.5753 -6.5751 -6.5387 -6.5373 -6.4908 -6.4896 -1.6900 -1.6898 0.5432 0.5436 0.9226 0.9236 1.5942 1.5948 2.0106 2.0125 2.6715 2.6747 2.9607 2.9650 3.0468 3.0492 3.0907 3.0928 3.2322 3.2325 3.2660 3.2678 3.2869 3.2907 4.6355 4.6561 4.6813 4.7016 4.8110 4.8148 4.8986 4.9073 4.9342 4.9393 5.2264 5.2548 5.4206 5.4267 5.7679 5.7787 5.9760 5.9812 6.3473 6.3527 6.6115 6.6123 7.2022 7.2053 7.2793 7.2835 7.4937 7.4943 7.6111 7.6130 8.4082 8.4082 10.0067 10.0106 10.6590 10.6666 11.4548 11.4551 k =-0.0350 0.0489 0.8585 ( 5328 PWs) bands (ev): -7.4895 -7.4895 -6.5735 -6.5730 -6.5415 -6.5395 -6.4913 -6.4896 -1.6864 -1.6862 0.5498 0.5504 0.9284 0.9298 1.5939 1.5948 2.0104 2.0133 2.6715 2.6763 2.9583 2.9648 3.0451 3.0484 3.0891 3.0918 3.2130 3.2149 3.2665 3.2717 3.2940 3.3000 4.6270 4.6579 4.6774 4.7066 4.8081 4.8129 4.8951 4.9051 4.9366 4.9427 5.2238 5.2660 5.4164 5.4256 5.7617 5.7781 5.9646 5.9724 6.3422 6.3501 6.6236 6.6245 7.1981 7.2032 7.2721 7.2789 7.4933 7.4948 7.5989 7.6009 8.4159 8.4159 10.0116 10.0171 10.6790 10.6901 11.4513 11.4519 k =-0.0467 0.0651 0.8585 ( 5322 PWs) bands (ev): -7.4905 -7.4905 -6.5708 -6.5702 -6.5453 -6.5427 -6.4919 -6.4897 -1.6815 -1.6812 0.5590 0.5598 0.9366 0.9385 1.5936 1.5948 2.0103 2.0141 2.6718 2.6781 2.9553 2.9640 3.0429 3.0470 3.0875 3.0904 3.1918 3.1958 3.2681 3.2759 3.2994 3.3073 4.6179 4.6587 4.6738 4.7112 4.8049 4.8100 4.8918 4.9012 4.9397 4.9464 5.2231 5.2786 5.4112 5.4236 5.7540 5.7763 5.9502 5.9605 6.3359 6.3461 6.6393 6.6403 7.1920 7.1997 7.2635 7.2729 7.4921 7.4953 7.5834 7.5843 8.4265 8.4267 10.0190 10.0258 10.7064 10.7206 11.4457 11.4467 k =-0.0583 0.0814 0.8585 ( 5308 PWs) bands (ev): -7.4918 -7.4918 -6.5675 -6.5666 -6.5499 -6.5469 -6.4924 -6.4898 -1.6753 -1.6749 0.5708 0.5718 0.9472 0.9496 1.5932 1.5947 2.0102 2.0151 2.6723 2.6802 2.9513 2.9624 3.0402 3.0448 3.0861 3.0885 3.1692 3.1753 3.2708 3.2807 3.3030 3.3128 4.6085 4.6585 4.6705 4.7153 4.8014 4.8061 4.8886 4.8960 4.9431 4.9503 5.2244 5.2927 5.4050 5.4206 5.7448 5.7732 5.9336 5.9462 6.3286 6.3409 6.6576 6.6585 7.1834 7.1939 7.2544 7.2662 7.4895 7.4958 7.5638 7.5659 8.4399 8.4404 10.0287 10.0364 10.7400 10.7567 11.4373 11.4388 k =-0.0700 0.0977 0.8585 ( 5312 PWs) bands (ev): -7.4935 -7.4935 -6.5639 -6.5623 -6.5550 -6.5521 -6.4928 -6.4899 -1.6679 -1.6675 0.5851 0.5862 0.9603 0.9631 1.5925 1.5943 2.0103 2.0161 2.6732 2.6824 2.9461 2.9597 3.0369 3.0416 3.0849 3.0864 3.1458 3.1540 3.2741 3.2857 3.3050 3.3164 4.5992 4.6575 4.6671 4.7187 4.7975 4.8013 4.8853 4.8898 4.9462 4.9543 5.2277 5.3079 5.3978 5.4167 5.7340 5.7689 5.9155 5.9303 6.3206 6.3346 6.6773 6.6779 7.1719 7.1848 7.2462 7.2593 7.4843 7.4961 7.5402 7.5484 8.4561 8.4569 10.0407 10.0489 10.7779 10.7967 11.4253 11.4276 k =-0.0817 0.1140 0.8585 ( 5316 PWs) bands (ev): -7.4956 -7.4955 -6.5640 -6.5587 -6.5568 -6.5564 -6.4930 -6.4898 -1.6596 -1.6591 0.6018 0.6031 0.9757 0.9790 1.5916 1.5936 2.0104 2.0172 2.6743 2.6848 2.9390 2.9553 3.0330 3.0372 3.0839 3.0842 3.1228 3.1327 3.2782 3.2911 3.3054 3.3184 4.5903 4.6556 4.6636 4.7218 4.7934 4.7960 4.8817 4.8828 4.9489 4.9582 5.2329 5.3242 5.3897 5.4120 5.7217 5.7634 5.8965 5.9135 6.3121 6.3275 6.6974 6.6976 7.1575 7.1718 7.2399 7.2522 7.4747 7.4958 7.5145 7.5335 8.4750 8.4762 10.0546 10.0629 10.8183 10.8386 11.4090 11.4123 k =-0.0933 0.1303 0.8585 ( 5312 PWs) bands (ev): -7.4981 -7.4980 -6.5705 -6.5654 -6.5516 -6.5513 -6.4930 -6.4896 -1.6504 -1.6499 0.6209 0.6223 0.9936 0.9974 1.5904 1.5926 2.0105 2.0184 2.6757 2.6874 2.9293 2.9484 3.0284 3.0312 3.0820 3.0828 3.1020 3.1126 3.2828 3.2967 3.3045 3.3188 4.5821 4.6529 4.6599 4.7245 4.7892 4.7903 4.8751 4.8779 4.9512 4.9618 5.2399 5.3415 5.3807 5.4065 5.7079 5.7567 5.8772 5.8963 6.3033 6.3198 6.7166 6.7169 7.1404 7.1551 7.2354 7.2449 7.4602 7.4847 7.4977 7.5229 8.4965 8.4981 10.0701 10.0780 10.8589 10.8803 11.3877 11.3923 k =-0.1050 0.1466 0.8585 ( 5312 PWs) bands (ev): -7.5010 -7.5009 -6.5785 -6.5733 -6.5454 -6.5449 -6.4927 -6.4891 -1.6405 -1.6401 0.6423 0.6437 1.0139 1.0181 1.5886 1.5910 2.0107 2.0197 2.6773 2.6900 2.9160 2.9377 3.0232 3.0235 3.0774 3.0788 3.0893 3.0956 3.2878 3.3014 3.3034 3.3179 4.5748 4.6494 4.6558 4.7272 4.7845 4.7847 4.8669 4.8737 4.9529 4.9649 5.2487 5.3595 5.3709 5.4005 5.6926 5.7490 5.8580 5.8791 6.2946 6.3118 6.7342 6.7349 7.1210 7.1353 7.2320 7.2366 7.4426 7.4576 7.4963 7.5160 8.5206 8.5226 10.0865 10.0937 10.8977 10.9196 11.3608 11.3669 k =-0.1167 0.1628 0.8585 ( 5306 PWs) bands (ev): -7.5044 -7.5043 -6.5873 -6.5820 -6.5385 -6.5378 -6.4919 -6.4882 -1.6302 -1.6298 0.6658 0.6673 1.0365 1.0413 1.5862 1.5888 2.0110 2.0210 2.6790 2.6927 2.8984 2.9216 3.0143 3.0178 3.0668 3.0718 3.0856 3.0872 3.2933 3.2990 3.3087 3.3159 4.5688 4.6453 4.6513 4.7300 4.7786 4.7801 4.8583 4.8692 4.9541 4.9673 5.2591 5.3604 5.3785 5.3940 5.6759 5.7402 5.8393 5.8622 6.2861 6.3036 6.7497 6.7508 7.0995 7.1132 7.2265 7.2285 7.4251 7.4307 7.4951 7.5110 8.5473 8.5497 10.1033 10.1094 10.9322 10.9540 11.3281 11.3358 k =-0.1284 0.1791 0.8585 ( 5302 PWs) bands (ev): -7.5083 -7.5081 -6.5969 -6.5914 -6.5308 -6.5301 -6.4907 -6.4868 -1.6196 -1.6192 0.6914 0.6929 1.0614 1.0667 1.5832 1.5859 2.0114 2.0225 2.6807 2.6952 2.8761 2.8993 3.0054 3.0125 3.0585 3.0617 3.0825 3.0877 3.2952 3.2988 3.3132 3.3148 4.5639 4.6406 4.6463 4.7326 4.7728 4.7753 4.8494 4.8644 4.9548 4.9691 5.2704 5.3494 5.3874 5.3980 5.6579 5.7304 5.8213 5.8459 6.2780 6.2955 6.7625 6.7639 7.0766 7.0896 7.2138 7.2233 7.4064 7.4099 7.4935 7.5067 8.5765 8.5792 10.1195 10.1241 10.9607 10.9815 11.2892 11.2987 k =-0.1284 0.1791 0.8585 ( 5302 PWs) bands (ev): -7.5083 -7.5081 -6.5969 -6.5914 -6.5308 -6.5301 -6.4907 -6.4868 -1.6196 -1.6192 0.6914 0.6929 1.0614 1.0667 1.5832 1.5859 2.0114 2.0225 2.6807 2.6952 2.8761 2.8993 3.0054 3.0125 3.0585 3.0617 3.0825 3.0877 3.2952 3.2988 3.3132 3.3148 4.5639 4.6406 4.6463 4.7326 4.7728 4.7753 4.8494 4.8644 4.9548 4.9691 5.2704 5.3494 5.3874 5.3980 5.6579 5.7304 5.8213 5.8459 6.2780 6.2955 6.7625 6.7639 7.0766 7.0896 7.2138 7.2233 7.4064 7.4099 7.4935 7.5067 8.5765 8.5792 10.1195 10.1241 10.9607 10.9815 11.2892 11.2987 k =-0.1368 0.1909 0.8440 ( 5304 PWs) bands (ev): -7.5117 -7.5116 -6.6040 -6.5985 -6.5291 -6.5260 -6.4867 -6.4817 -1.6120 -1.6116 0.7116 0.7131 1.0816 1.0873 1.5808 1.5837 2.0106 2.0223 2.6828 2.6978 2.8570 2.8794 2.9989 3.0087 3.0538 3.0546 3.0818 3.0886 3.2922 3.3019 3.3113 3.3188 4.5610 4.6361 4.6430 4.7345 4.7679 4.7723 4.8432 4.8604 4.9534 4.9735 5.2786 5.3413 5.3822 5.4130 5.6444 5.7224 5.8085 5.8338 6.2710 6.2895 6.7690 6.7721 7.0583 7.0707 7.2026 7.2178 7.3916 7.4012 7.4901 7.5024 8.6014 8.6041 10.1317 10.1349 10.9755 10.9978 11.2540 11.2693 k =-0.1452 0.2027 0.8294 ( 5304 PWs) bands (ev): -7.5160 -7.5158 -6.6110 -6.6054 -6.5321 -6.5274 -6.4768 -6.4706 -1.6043 -1.6039 0.7336 0.7350 1.1044 1.1106 1.5788 1.5818 2.0075 2.0198 2.6861 2.7015 2.8356 2.8568 2.9919 3.0042 3.0475 3.0493 3.0817 3.0898 3.2893 3.3030 3.3103 3.3219 4.5589 4.6309 4.6398 4.7364 4.7619 4.7706 4.8377 4.8557 4.9509 4.9827 5.2855 5.3336 5.3775 5.4280 5.6307 5.7135 5.7960 5.8211 6.2617 6.2831 6.7729 6.7791 7.0376 7.0496 7.1895 7.2100 7.3801 7.3950 7.4831 7.4962 8.6315 8.6343 10.1450 10.1465 10.9819 11.0127 11.2109 11.2397 k =-0.1537 0.2145 0.8149 ( 5301 PWs) bands (ev): -7.5210 -7.5207 -6.6180 -6.6123 -6.5371 -6.5320 -6.4631 -6.4563 -1.5969 -1.5963 0.7572 0.7586 1.1298 1.1365 1.5772 1.5803 2.0020 2.0148 2.6900 2.7056 2.8127 2.8322 2.9850 2.9988 3.0406 3.0449 3.0822 3.0912 3.2867 3.3020 3.3107 3.3241 4.5575 4.6258 4.6358 4.7380 4.7549 4.7699 4.8328 4.8505 4.9493 4.9943 5.2902 5.3267 5.3742 5.4425 5.6171 5.7036 5.7840 5.8079 6.2505 6.2759 6.7744 6.7843 7.0149 7.0265 7.1749 7.1995 7.3728 7.3917 7.4732 7.4883 8.6660 8.6688 10.1577 10.1582 10.9770 11.0235 11.1653 11.2126 k =-0.1621 0.2263 0.8004 ( 5303 PWs) bands (ev): -7.5266 -7.5262 -6.6248 -6.6191 -6.5430 -6.5378 -6.4476 -6.4405 -1.5895 -1.5889 0.7824 0.7837 1.1576 1.1649 1.5760 1.5792 1.9942 2.0075 2.6931 2.7087 2.7894 2.8069 2.9779 2.9924 3.0337 3.0404 3.0829 3.0928 3.2844 3.3001 3.3114 3.3257 4.5568 4.6207 4.6310 4.7391 4.7474 4.7698 4.8284 4.8452 4.9495 5.0076 5.2918 5.3211 5.3731 5.4559 5.6041 5.6928 5.7728 5.7945 6.2376 6.2675 6.7737 6.7876 6.9905 7.0017 7.1587 7.1861 7.3701 7.3912 7.4614 7.4790 8.7040 8.7066 10.1676 10.1702 10.9586 11.0206 11.1289 11.1925 k =-0.1706 0.2381 0.7859 ( 5310 PWs) bands (ev): -7.5326 -7.5322 -6.6314 -6.6257 -6.5492 -6.5441 -6.4313 -6.4239 -1.5824 -1.5816 0.8090 0.8103 1.1880 1.1959 1.5753 1.5785 1.9844 1.9979 2.6928 2.7074 2.7689 2.7830 2.9705 2.9848 3.0268 3.0360 3.0839 3.0948 3.2826 3.2982 3.3119 3.3268 4.5570 4.6158 4.6257 4.7365 4.7425 4.7699 4.8243 4.8400 4.9516 5.0221 5.2905 5.3165 5.3746 5.4675 5.5922 5.6814 5.7625 5.7810 6.2233 6.2579 6.7707 6.7890 6.9647 6.9756 7.1416 7.1702 7.3714 7.3933 7.4484 7.4688 8.7444 8.7469 10.1750 10.1799 10.9272 10.9898 11.1179 11.1820 k =-0.1790 0.2499 0.7714 ( 5304 PWs) bands (ev): -7.5389 -7.5384 -6.6378 -6.6321 -6.5554 -6.5505 -6.4146 -6.4070 -1.5756 -1.5746 0.8368 0.8381 1.2207 1.2292 1.5750 1.5782 1.9727 1.9864 2.6841 2.6960 2.7567 2.7652 2.9624 2.9763 3.0202 3.0320 3.0851 3.0973 3.2814 3.2964 3.3122 3.3276 4.5580 4.6106 4.6202 4.7281 4.7428 4.7699 4.8205 4.8353 4.9560 5.0373 5.2875 5.3125 5.3782 5.4763 5.5826 5.6696 5.7533 5.7677 6.2079 6.2472 6.7657 6.7885 6.9381 6.9486 7.1240 7.1527 7.3761 7.3971 7.4357 7.4582 8.7863 8.7887 10.1790 10.1863 10.8862 10.9394 11.1263 11.1802 k =-0.1875 0.2616 0.7569 ( 5299 PWs) bands (ev): -7.5454 -7.5448 -6.6440 -6.6382 -6.5614 -6.5568 -6.3977 -6.3900 -1.5690 -1.5678 0.8658 0.8670 1.2556 1.2649 1.5751 1.5784 1.9594 1.9732 2.6633 2.6732 2.7527 2.7581 2.9533 2.9668 3.0139 3.0284 3.0866 3.1004 3.2808 3.2950 3.3122 3.3281 4.5598 4.6049 4.6149 4.7186 4.7438 4.7694 4.8169 4.8310 4.9625 5.0529 5.2842 5.3088 5.3832 5.4807 5.5766 5.6576 5.7450 5.7548 6.1916 6.2356 6.7589 6.7862 6.9109 6.9212 7.1063 7.1341 7.3822 7.4000 7.4259 7.4482 8.8289 8.8310 10.1788 10.1884 10.8403 10.8833 11.1422 11.1849 k =-0.1959 0.2734 0.7424 ( 5296 PWs) bands (ev): -7.5519 -7.5513 -6.6499 -6.6442 -6.5673 -6.5629 -6.3811 -6.3731 -1.5627 -1.5614 0.8957 0.8969 1.2926 1.3027 1.5756 1.5788 1.9447 1.9586 2.6337 2.6428 2.7523 2.7585 2.9429 2.9563 3.0085 3.0253 3.0883 3.1040 3.2808 3.2939 3.3122 3.3285 4.5623 4.5983 4.6102 4.7087 4.7448 4.7683 4.8137 4.8272 4.9708 5.0682 5.2816 5.3058 5.3884 5.4795 5.5752 5.6459 5.7371 5.7426 6.1746 6.2233 6.7504 6.7820 6.8838 6.8936 7.0890 7.1153 7.3854 7.3987 7.4243 7.4410 8.8711 8.8730 10.1738 10.1855 10.7934 10.8274 11.1611 11.1944 k =-0.2044 0.2852 0.7279 ( 5301 PWs) bands (ev): -7.5585 -7.5578 -6.6555 -6.6498 -6.5729 -6.5688 -6.3648 -6.3567 -1.5567 -1.5553 0.9263 0.9275 1.3316 1.3425 1.5763 1.5796 1.9288 1.9427 2.5993 2.6080 2.7535 2.7607 2.9314 2.9448 3.0040 3.0228 3.0905 3.1083 3.2814 3.2933 3.3121 3.3288 4.5653 4.5911 4.6058 4.6990 4.7459 4.7664 4.8107 4.8240 4.9806 5.0830 5.2802 5.3040 5.3933 5.4731 5.5780 5.6347 5.7277 5.7330 6.1573 6.2104 6.7405 6.7761 6.8571 6.8664 7.0724 7.0968 7.3778 7.3978 7.4282 7.4416 8.9123 8.9138 10.1639 10.1774 10.7482 10.7747 11.1818 11.2078 k =-0.2128 0.2970 0.7134 ( 5298 PWs) bands (ev): -7.5649 -7.5642 -6.6609 -6.6552 -6.5783 -6.5744 -6.3490 -6.3407 -1.5512 -1.5495 0.9574 0.9586 1.3722 1.3842 1.5774 1.5807 1.9120 1.9259 2.5618 2.5704 2.7550 2.7627 2.9188 2.9321 3.0005 3.0209 3.0932 3.1130 3.2825 3.2931 3.3120 3.3291 4.5688 4.5835 4.6019 4.6896 4.7471 4.7638 4.8082 4.8214 4.9915 5.0968 5.2801 5.3040 5.3973 5.4633 5.5834 5.6245 5.7165 5.7264 6.1400 6.1974 6.7294 6.7684 6.8317 6.8399 7.0569 7.0791 7.3653 7.3927 7.4361 7.4503 8.9516 8.9528 10.1490 10.1640 10.7066 10.7265 11.2036 11.2248 k =-0.2213 0.3088 0.6989 ( 5300 PWs) bands (ev): -7.5711 -7.5704 -6.6659 -6.6602 -6.5833 -6.5796 -6.3339 -6.3255 -1.5460 -1.5442 0.9887 0.9901 1.4141 1.4273 1.5787 1.5821 1.8947 1.9086 2.5221 2.5305 2.7559 2.7640 2.9054 2.9185 2.9981 3.0195 3.0964 3.1182 3.2841 3.2934 3.3121 3.3295 4.5721 4.5759 4.5983 4.6808 4.7483 4.7606 4.8062 4.8193 5.0030 5.1093 5.2810 5.3060 5.4001 5.4519 5.5895 5.6155 5.7053 5.7206 6.1230 6.1845 6.7173 6.7586 6.8084 6.8146 7.0427 7.0623 7.3520 7.3836 7.4478 7.4621 8.9883 8.9892 10.1298 10.1457 10.6695 10.6840 11.2263 11.2453 k =-0.2297 0.3206 0.6844 ( 5297 PWs) bands (ev): -7.5770 -7.5763 -6.6705 -6.6648 -6.5879 -6.5846 -6.3196 -6.3111 -1.5411 -1.5392 1.0201 1.0217 1.4565 1.4714 1.5807 1.5845 1.8770 1.8910 2.4804 2.4889 2.7560 2.7647 2.8915 2.9043 2.9964 3.0187 3.1000 3.1237 3.2860 3.2941 3.3123 3.3299 4.5678 4.5754 4.5956 4.6730 4.7493 4.7572 4.8045 4.8176 5.0149 5.1204 5.2823 5.3099 5.4017 5.4410 5.5948 5.6082 5.6947 5.7152 6.1068 6.1721 6.7044 6.7460 6.7883 6.7908 7.0298 7.0468 7.3389 7.3732 7.4612 7.4750 9.0219 9.0226 10.1073 10.1235 10.6370 10.6475 11.2499 11.2690 k =-0.2382 0.3324 0.6699 ( 5293 PWs) bands (ev): -7.5826 -7.5818 -6.6748 -6.6691 -6.5922 -6.5891 -6.3063 -6.2976 -1.5368 -1.5347 1.0511 1.0530 1.4978 1.5147 1.5846 1.5892 1.8594 1.8735 2.4369 2.4457 2.7554 2.7647 2.8774 2.8897 2.9952 3.0181 3.1038 3.1293 3.2882 3.2952 3.3126 3.3304 4.5603 4.5763 4.5948 4.6662 4.7489 4.7548 4.8032 4.8164 5.0269 5.1300 5.2834 5.3147 5.4021 5.4328 5.5972 5.6039 5.6848 5.7096 6.0919 6.1605 6.6909 6.7303 6.7686 6.7725 7.0184 7.0328 7.3264 7.3626 7.4751 7.4884 9.0519 9.0525 10.0828 10.0988 10.6088 10.6174 11.2746 11.2953 k =-0.2466 0.3442 0.6554 ( 5288 PWs) bands (ev): -7.5877 -7.5869 -6.6787 -6.6730 -6.5960 -6.5933 -6.2940 -6.2853 -1.5328 -1.5306 1.0814 1.0837 1.5329 1.5501 1.5969 1.6008 1.8423 1.8566 2.3919 2.4009 2.7543 2.7644 2.8632 2.8750 2.9944 3.0179 3.1078 3.1349 3.2904 3.2967 3.3131 3.3309 4.5532 4.5745 4.5968 4.6607 4.7455 4.7550 4.8021 4.8155 5.0390 5.1386 5.2832 5.3185 5.4013 5.4301 5.5944 5.6036 5.6761 5.7037 6.0785 6.1500 6.6770 6.7127 6.7489 6.7598 7.0084 7.0204 7.3146 7.3522 7.4889 7.5016 9.0779 9.0787 10.0575 10.0728 10.5842 10.5932 11.3007 11.3235 k =-0.2551 0.3560 0.6409 ( 5292 PWs) bands (ev): -7.5924 -7.5916 -6.6822 -6.6765 -6.5994 -6.5970 -6.2830 -6.2741 -1.5293 -1.5270 1.1107 1.1134 1.5529 1.5644 1.6272 1.6310 1.8263 1.8409 2.3454 2.3547 2.7531 2.7640 2.8493 2.8605 2.9938 3.0178 3.1117 3.1402 3.2926 3.2986 3.3136 3.3314 4.5465 4.5707 4.6005 4.6565 4.7409 4.7562 4.8012 4.8149 5.0510 5.1462 5.2806 5.3196 5.4011 5.4342 5.5905 5.6027 5.6688 5.6971 6.0670 6.1409 6.6630 6.6945 6.7317 6.7495 6.9999 7.0095 7.3039 7.3424 7.5022 7.5144 9.0998 9.1009 10.0330 10.0471 10.5632 10.5739 11.3280 11.3530 k =-0.2635 0.3677 0.6264 ( 5298 PWs) bands (ev): -7.5965 -7.5957 -6.6852 -6.6796 -6.6024 -6.6002 -6.2732 -6.2643 -1.5262 -1.5238 1.1384 1.1416 1.5598 1.5669 1.6664 1.6756 1.8123 1.8277 2.2976 2.3071 2.7521 2.7639 2.8360 2.8465 2.9934 3.0179 3.1153 3.1451 3.2946 3.3007 3.3143 3.3319 4.5404 4.5663 4.6047 4.6535 4.7359 4.7577 4.8003 4.8145 5.0630 5.1534 5.2748 5.3171 5.4041 5.4439 5.5863 5.5994 5.6631 5.6898 6.0575 6.1332 6.6495 6.6769 6.7171 6.7407 6.9927 7.0002 7.2941 7.3334 7.5144 7.5262 9.1178 9.1190 10.0104 10.0230 10.5459 10.5584 11.3558 11.3830 k =-0.2719 0.3795 0.6119 ( 5304 PWs) bands (ev): -7.6001 -7.5993 -6.6878 -6.6822 -6.6050 -6.6031 -6.2648 -6.2558 -1.5236 -1.5211 1.1639 1.1677 1.5612 1.5661 1.7078 1.7207 1.8031 1.8192 2.2487 2.2584 2.7515 2.7642 2.8234 2.8333 2.9930 3.0180 3.1186 3.1494 3.2964 3.3028 3.3150 3.3322 4.5351 4.5619 4.6088 4.6516 4.7310 4.7591 4.7996 4.8142 5.0749 5.1603 5.2659 5.3114 5.4114 5.4575 5.5809 5.5946 5.6589 5.6816 6.0501 6.1271 6.6370 6.6608 6.7050 6.7332 6.9868 6.9926 7.2856 7.3254 7.5254 7.5369 9.1319 9.1334 9.9905 10.0014 10.5318 10.5461 11.3834 11.4125 k =-0.2804 0.3913 0.5974 ( 5303 PWs) bands (ev): -7.6031 -7.6022 -6.6899 -6.6843 -6.6070 -6.6054 -6.2578 -6.2487 -1.5215 -1.5189 1.1866 1.1909 1.5603 1.5638 1.7413 1.7534 1.8099 1.8228 2.1988 2.2086 2.7516 2.7653 2.8118 2.8210 2.9927 3.0182 3.1214 3.1530 3.2980 3.3048 3.3158 3.3326 4.5306 4.5578 4.6124 4.6509 4.7262 4.7605 4.7991 4.8140 5.0864 5.1670 5.2549 5.3038 5.4222 5.4731 5.5730 5.5897 5.6560 5.6730 6.0447 6.1224 6.6260 6.6468 6.6953 6.7270 6.9820 6.9865 7.2785 7.3187 7.5349 7.5461 9.1426 9.1443 9.9740 9.9829 10.5207 10.5365 11.4096 11.4403 k =-0.2888 0.4031 0.5829 ( 5309 PWs) bands (ev): -7.6054 -7.6046 -6.6916 -6.6860 -6.6086 -6.6073 -6.2524 -6.2432 -1.5198 -1.5172 1.2057 1.2104 1.5582 1.5610 1.7542 1.7609 1.8462 1.8494 2.1482 2.1580 2.7524 2.7672 2.8016 2.8099 2.9925 3.0183 3.1237 3.1559 3.2993 3.3064 3.3166 3.3328 4.5270 4.5544 4.6152 4.6510 4.7220 4.7617 4.7986 4.8139 5.0973 5.1736 5.2431 5.2957 5.4350 5.4891 5.5629 5.5851 5.6540 5.6646 6.0410 6.1191 6.6169 6.6352 6.6879 6.7221 6.9785 6.9819 7.2729 7.3132 7.5425 7.5536 9.1502 9.1520 9.9612 9.9681 10.5123 10.5293 11.4329 11.4650 k =-0.2973 0.4149 0.5684 ( 5315 PWs) bands (ev): -7.6071 -7.6062 -6.6928 -6.6872 -6.6098 -6.6086 -6.2484 -6.2392 -1.5186 -1.5159 1.2202 1.2254 1.5559 1.5583 1.7531 1.7602 1.8916 1.8948 2.0973 2.1069 2.7539 2.7701 2.7933 2.8001 2.9923 3.0184 3.1254 3.1580 3.3003 3.3075 3.3172 3.3329 4.5244 4.5518 4.6171 4.6517 4.7186 4.7625 4.7981 4.8139 5.1067 5.1795 5.2320 5.2886 5.4478 5.5038 5.5524 5.5804 5.6526 5.6573 6.0386 6.1169 6.6103 6.6265 6.6826 6.7184 6.9760 6.9787 7.2687 7.3092 7.5481 7.5590 9.1553 9.1572 9.9523 9.9573 10.5065 10.5242 11.4516 11.4847 k =-0.3057 0.4267 0.5539 ( 5311 PWs) bands (ev): -7.6081 -7.6072 -6.6936 -6.6880 -6.6104 -6.6094 -6.2460 -6.2368 -1.5179 -1.5152 1.2293 1.2348 1.5541 1.5564 1.7505 1.7585 1.9393 1.9446 2.0470 2.0563 2.7556 2.7736 2.7877 2.7922 2.9922 3.0185 3.1264 3.1593 3.3010 3.3082 3.3177 3.3330 4.5229 4.5502 4.6182 4.6524 4.7164 4.7631 4.7979 4.8139 5.1133 5.1841 5.2236 5.2837 5.4583 5.5143 5.5443 5.5758 5.6513 5.6528 6.0373 6.1157 6.6063 6.6212 6.6795 6.7163 6.9745 6.9768 7.2662 7.3067 7.5516 7.5624 9.1582 9.1601 9.9473 9.9504 10.5030 10.5212 11.4638 11.4977 k =-0.3142 0.4385 0.5394 ( 5295 PWs) bands (ev): -7.6084 -7.6076 -6.6938 -6.6882 -6.6107 -6.6097 -6.2452 -6.2360 -1.5177 -1.5149 1.2324 1.2381 1.5534 1.5557 1.7494 1.7577 1.9786 1.9787 2.0101 2.0189 2.7564 2.7758 2.7861 2.7880 2.9922 3.0186 3.1267 3.1598 3.3012 3.3085 3.3179 3.3331 4.5224 4.5497 4.6186 4.6528 4.7156 4.7633 4.7979 4.8139 5.1157 5.1860 5.2203 5.2819 5.4625 5.5180 5.5415 5.5737 5.6502 5.6520 6.0369 6.1153 6.6050 6.6194 6.6786 6.7156 6.9741 6.9763 7.2654 7.3059 7.5527 7.5635 9.1591 9.1610 9.9458 9.9480 10.5019 10.5202 11.4681 11.5022 k =-0.3142 0.4385 0.5394 ( 5295 PWs) bands (ev): -7.6084 -7.6076 -6.6938 -6.6882 -6.6107 -6.6097 -6.2452 -6.2360 -1.5177 -1.5149 1.2324 1.2381 1.5534 1.5557 1.7494 1.7577 1.9786 1.9787 2.0101 2.0189 2.7564 2.7758 2.7861 2.7880 2.9922 3.0186 3.1267 3.1598 3.3012 3.3085 3.3179 3.3331 4.5224 4.5497 4.6186 4.6528 4.7156 4.7633 4.7979 4.8139 5.1157 5.1860 5.2203 5.2819 5.4625 5.5180 5.5415 5.5737 5.6502 5.6520 6.0369 6.1153 6.6050 6.6194 6.6786 6.7156 6.9741 6.9763 7.2654 7.3059 7.5527 7.5635 9.1591 9.1610 9.9458 9.9480 10.5019 10.5202 11.4681 11.5022 k =-0.3059 0.4269 0.5252 ( 5299 PWs) bands (ev): -7.6088 -7.6080 -6.6782 -6.6723 -6.6239 -6.6227 -6.2446 -6.2352 -1.5186 -1.5159 1.2104 1.2144 1.5503 1.5538 1.7691 1.7792 1.9608 1.9627 2.0246 2.0330 2.7303 2.7485 2.7780 2.7790 3.0014 3.0243 3.1278 3.1585 3.2947 3.2997 3.3084 3.3237 4.5244 4.5521 4.6153 4.6687 4.7153 4.7689 4.8008 4.8281 5.1182 5.1960 5.2330 5.2665 5.4861 5.5018 5.5366 5.5905 5.6441 5.6512 6.0221 6.1030 6.6230 6.6314 6.6855 6.7269 6.9713 6.9752 7.2633 7.3009 7.5542 7.5657 9.1536 9.1559 9.9682 9.9707 10.5307 10.5467 11.5777 11.6056 k =-0.2976 0.4154 0.5110 ( 5283 PWs) bands (ev): -7.6110 -7.6102 -6.6623 -6.6561 -6.6347 -6.6333 -6.2441 -6.2345 -1.5210 -1.5183 1.1900 1.1926 1.5414 1.5456 1.7968 1.8080 1.9426 1.9456 2.0413 2.0500 2.7032 2.7208 2.7664 2.7694 3.0101 3.0300 3.1296 3.1571 3.2890 3.2910 3.3000 3.3153 4.5270 4.5547 4.6117 4.6843 4.7145 4.7748 4.8044 4.8416 5.1165 5.2067 5.2441 5.2480 5.4855 5.5083 5.5372 5.6118 5.6400 5.6509 6.0069 6.0901 6.6409 6.6422 6.6923 6.7379 6.9701 6.9757 7.2595 7.2931 7.5545 7.5663 9.1495 9.1524 9.9920 9.9946 10.5552 10.5692 11.6770 11.6970 k =-0.2894 0.4039 0.4968 ( 5291 PWs) bands (ev): -7.6152 -7.6144 -6.6477 -6.6431 -6.6399 -6.6397 -6.2436 -6.2338 -1.5250 -1.5223 1.1715 1.1726 1.5292 1.5336 1.8299 1.8414 1.9245 1.9280 2.0601 2.0693 2.6755 2.6926 2.7535 2.7580 3.0174 3.0351 3.1320 3.1552 3.2817 3.2830 3.2936 3.3088 4.5302 4.5575 4.6081 4.6991 4.7133 4.7810 4.8084 4.8541 5.1106 5.2177 5.2243 5.2565 5.4728 5.5214 5.5498 5.6284 5.6375 5.6560 5.9913 6.0766 6.6515 6.6579 6.6989 6.7484 6.9707 6.9776 7.2541 7.2829 7.5534 7.5653 9.1472 9.1505 10.0168 10.0195 10.5762 10.5887 11.7558 11.7661 k =-0.2811 0.3923 0.4826 ( 5287 PWs) bands (ev): -7.6213 -7.6206 -6.6488 -6.6482 -6.6286 -6.6231 -6.2431 -6.2332 -1.5305 -1.5279 1.1545 1.1549 1.5154 1.5200 1.8657 1.8755 1.9089 1.9109 2.0811 2.0907 2.6474 2.6642 2.7396 2.7452 3.0232 3.0394 3.1348 3.1528 3.2716 3.2757 3.2895 3.3055 4.5340 4.5607 4.6046 4.7118 4.7130 4.7874 4.8130 4.8652 5.1008 5.1995 5.2288 5.2671 5.4650 5.5261 5.5717 5.6313 5.6375 5.6743 5.9756 6.0625 6.6592 6.6735 6.7059 6.7584 6.9733 6.9814 7.2476 7.2706 7.5509 7.5628 9.1466 9.1504 10.0427 10.0453 10.5944 10.6058 11.8027 11.8032 k =-0.2728 0.3808 0.4684 ( 5289 PWs) bands (ev): -7.6295 -7.6289 -6.6518 -6.6507 -6.6122 -6.6063 -6.2427 -6.2327 -1.5376 -1.5350 1.1383 1.1402 1.5011 1.5058 1.8812 1.8865 1.9108 1.9239 2.1042 2.1143 2.6190 2.6357 2.7252 2.7313 3.0274 3.0428 3.1375 3.1497 3.2609 3.2665 3.2878 3.3055 4.5381 4.5642 4.6012 4.7100 4.7260 4.7941 4.8181 4.8746 5.0876 5.1733 5.2399 5.2772 5.4620 5.5286 5.5929 5.6272 5.6422 5.6982 5.9602 6.0480 6.6649 6.6861 6.7145 6.7678 6.9778 6.9870 7.2404 7.2566 7.5470 7.5588 9.1478 9.1521 10.0692 10.0717 10.6108 10.6215 11.8071 11.8141 k =-0.2646 0.3692 0.4542 ( 5293 PWs) bands (ev): -7.6397 -7.6391 -6.6521 -6.6508 -6.5956 -6.5895 -6.2424 -6.2322 -1.5461 -1.5436 1.1242 1.1275 1.4869 1.4918 1.8643 1.8709 1.9484 1.9627 2.1293 2.1398 2.5906 2.6072 2.7105 2.7168 3.0302 3.0454 3.1396 3.1461 3.2499 3.2560 3.2883 3.3083 4.5426 4.5680 4.5981 4.7079 4.7379 4.8009 4.8235 4.8823 5.0718 5.1466 5.2508 5.2868 5.4636 5.5296 5.6080 5.6203 5.6554 5.7221 5.9458 6.0332 6.6683 6.6938 6.7263 6.7766 6.9844 6.9945 7.2333 7.2415 7.5420 7.5534 9.1508 9.1555 10.0963 10.0985 10.6262 10.6365 11.7839 11.7955 k =-0.2563 0.3577 0.4400 ( 5297 PWs) bands (ev): -7.6517 -7.6512 -6.6498 -6.6484 -6.5788 -6.5726 -6.2421 -6.2318 -1.5561 -1.5536 1.1121 1.1168 1.4734 1.4784 1.8458 1.8526 1.9894 2.0040 2.1564 2.1673 2.5624 2.5790 2.6955 2.7017 3.0318 3.0472 3.1407 3.1419 3.2385 3.2445 3.2909 3.3129 4.5472 4.5720 4.5953 4.7055 4.7489 4.8076 4.8292 4.8880 5.0544 5.1198 5.2614 5.2960 5.4691 5.5283 5.6117 5.6177 5.6758 5.7437 5.9334 6.0183 6.6688 6.6968 6.7405 6.7850 6.9931 7.0038 7.2262 7.2267 7.5359 7.5470 9.1553 9.1606 10.1237 10.1256 10.6413 10.6515 11.7406 11.7549 k =-0.2480 0.3462 0.4259 ( 5305 PWs) bands (ev): -7.6656 -7.6652 -6.6449 -6.6433 -6.5620 -6.5556 -6.2418 -6.2315 -1.5675 -1.5651 1.1021 1.1083 1.4608 1.4660 1.8270 1.8340 2.0310 2.0459 2.1852 2.1965 2.5345 2.5513 2.6804 2.6863 3.0326 3.0484 3.1373 3.1407 3.2268 3.2325 3.2954 3.3189 4.5517 4.5763 4.5930 4.7030 4.7587 4.8143 4.8351 4.8916 5.0362 5.0934 5.2716 5.3049 5.4776 5.5238 5.6017 5.6265 5.6986 5.7603 5.9250 6.0039 6.6662 6.6962 6.7559 6.7933 7.0039 7.0151 7.2114 7.2212 7.5292 7.5399 9.1613 9.1670 10.1512 10.1526 10.6568 10.6671 11.6821 11.6980 k =-0.2398 0.3346 0.4117 ( 5301 PWs) bands (ev): -7.6811 -7.6807 -6.6376 -6.6360 -6.5452 -6.5387 -6.2416 -6.2313 -1.5801 -1.5778 1.0943 1.1018 1.4494 1.4549 1.8082 1.8153 2.0725 2.0878 2.2157 2.2274 2.5075 2.5244 2.6652 2.6706 3.0326 3.0490 3.1323 3.1397 3.2149 3.2200 3.3014 3.3258 4.5558 4.5807 4.5914 4.7004 4.7674 4.8210 4.8410 4.8927 5.0185 5.0679 5.2813 5.3135 5.4881 5.5159 5.5907 5.6367 5.7203 5.7692 5.9234 5.9905 6.6601 6.6925 6.7716 6.8016 7.0167 7.0282 7.1979 7.2173 7.5221 7.5324 9.1683 9.1744 10.1785 10.1795 10.6732 10.6838 11.6117 11.6286 k =-0.2315 0.3231 0.3975 ( 5285 PWs) bands (ev): -7.6980 -7.6976 -6.6281 -6.6264 -6.5285 -6.5219 -6.2415 -6.2312 -1.5940 -1.5917 1.0887 1.0976 1.4393 1.4451 1.7895 1.7968 2.1133 2.1289 2.2476 2.2595 2.4817 2.4990 2.6501 2.6548 3.0323 3.0493 3.1272 3.1377 3.2028 3.2072 3.3086 3.3332 4.5590 4.5854 4.5911 4.6976 4.7750 4.8276 4.8468 4.8911 5.0021 5.0434 5.2906 5.3218 5.4990 5.5048 5.5800 5.6488 5.7388 5.7684 5.9300 5.9791 6.6506 6.6858 6.7873 6.8103 7.0316 7.0432 7.1865 7.2153 7.5150 7.5251 9.1759 9.1824 10.2054 10.2060 10.6909 10.7019 11.5317 11.5493 k =-0.2232 0.3115 0.3833 ( 5285 PWs) bands (ev): -7.7161 -7.7158 -6.6166 -6.6148 -6.5119 -6.5053 -6.2414 -6.2311 -1.6089 -1.6068 1.0852 1.0954 1.4306 1.4368 1.7709 1.7783 2.1525 2.1683 2.2802 2.2923 2.4584 2.4759 2.6349 2.6388 3.0316 3.0492 3.1220 3.1351 3.1906 3.1941 3.3165 3.3408 4.5609 4.5901 4.5924 4.6946 4.7812 4.8338 4.8520 4.8868 4.9876 5.0202 5.2993 5.3298 5.4905 5.5066 5.5725 5.6626 5.7520 5.7587 5.9439 5.9712 6.6379 6.6762 6.8026 6.8193 7.0485 7.0597 7.1778 7.2153 7.5084 7.5183 9.1836 9.1905 10.2318 10.2319 10.7100 10.7216 11.4441 11.4622 k =-0.2150 0.3000 0.3691 ( 5283 PWs) bands (ev): -7.7352 -7.7350 -6.6033 -6.6015 -6.4954 -6.4888 -6.2413 -6.2311 -1.6248 -1.6228 1.0839 1.0954 1.4235 1.4301 1.7527 1.7601 2.1888 2.2046 2.3127 2.3241 2.4400 2.4573 2.6197 2.6228 3.0308 3.0489 3.1167 3.1319 3.1785 3.1810 3.3248 3.3485 4.5612 4.5948 4.5955 4.6917 4.7861 4.8399 4.8559 4.8805 4.9756 4.9985 5.3073 5.3374 5.4735 5.5053 5.5736 5.6780 5.7430 5.7582 5.9621 5.9682 6.6222 6.6636 6.8176 6.8288 7.0673 7.0777 7.1725 7.2173 7.5026 7.5126 9.1909 9.1981 10.2573 10.2577 10.7307 10.7430 11.3506 11.3690 k =-0.2067 0.2885 0.3549 ( 5285 PWs) bands (ev): -7.7551 -7.7549 -6.5885 -6.5866 -6.4792 -6.4726 -6.2413 -6.2312 -1.6415 -1.6396 1.0848 1.0976 1.4180 1.4251 1.7347 1.7422 2.2199 2.2354 2.3430 2.3509 2.4323 2.4470 2.6044 2.6066 3.0299 3.0486 3.1115 3.1284 3.1666 3.1679 3.3334 3.3561 4.5602 4.5993 4.5999 4.6885 4.7895 4.8456 4.8559 4.8752 4.9658 4.9785 5.3144 5.3446 5.4540 5.4934 5.5844 5.6945 5.7239 5.7567 5.9707 5.9825 6.6043 6.6485 6.8321 6.8385 7.0881 7.0968 7.1711 7.2212 7.4982 7.5083 9.1970 9.2045 10.2821 10.2828 10.7529 10.7661 11.2528 11.2711 k =-0.1984 0.2769 0.3407 ( 5289 PWs) bands (ev): -7.7756 -7.7755 -6.5724 -6.5704 -6.4632 -6.4566 -6.2414 -6.2314 -1.6590 -1.6572 1.0878 1.1019 1.4142 1.4218 1.7172 1.7247 2.2416 2.2564 2.3678 2.3684 2.4440 2.4515 2.5890 2.5904 3.0289 3.0481 3.1064 3.1246 3.1551 3.1553 3.3419 3.3635 4.5586 4.6037 4.6053 4.6855 4.7913 4.8485 4.8509 4.8749 4.9578 4.9602 5.3203 5.3511 5.4323 5.4751 5.6001 5.7037 5.7116 5.7484 5.9781 6.0034 6.5847 6.6312 6.8461 6.8486 7.1109 7.1160 7.1744 7.2267 7.4955 7.5060 9.2010 9.2088 10.3063 10.3074 10.7762 10.7908 11.1521 11.1697 k =-0.1902 0.2654 0.3265 ( 5281 PWs) bands (ev): -7.7965 -7.7964 -6.5551 -6.5532 -6.4475 -6.4409 -6.2415 -6.2317 -1.6770 -1.6754 1.0930 1.1083 1.4122 1.4204 1.7002 1.7077 2.2492 2.2634 2.3816 2.3902 2.4722 2.4726 2.5735 2.5742 3.0280 3.0476 3.1014 3.1207 3.1435 3.1446 3.3503 3.3706 4.5565 4.6078 4.6114 4.6826 4.7916 4.8368 4.8558 4.8775 4.9439 4.9510 5.3248 5.3563 5.4090 5.4532 5.6152 5.6862 5.7231 5.7408 5.9891 6.0239 6.5640 6.6122 6.8589 6.8596 7.1341 7.1356 7.1836 7.2337 7.4950 7.5059 9.2023 9.2103 10.3301 10.3315 10.7997 10.8169 11.0505 11.0660 k =-0.1819 0.2539 0.3123 ( 5269 PWs) bands (ev): -7.8176 -7.8174 -6.5370 -6.5350 -6.4322 -6.4256 -6.2417 -6.2319 -1.6955 -1.6940 1.1002 1.1168 1.4119 1.4207 1.6839 1.6913 2.2429 2.2573 2.4008 2.4132 2.5032 2.5072 2.5579 2.5588 3.0271 3.0471 3.0965 3.1168 3.1328 3.1354 3.3584 3.3775 4.5543 4.6115 4.6178 4.6799 4.7902 4.8239 4.8601 4.8804 4.9296 4.9447 5.3270 5.3585 5.3859 5.4292 5.6207 5.6804 5.7102 5.7548 6.0021 6.0435 6.5427 6.5920 6.8694 6.8724 7.1496 7.1621 7.1997 7.2420 7.4968 7.5083 9.2000 9.2082 10.3538 10.3553 10.8195 10.8441 10.9525 10.9609 k =-0.1736 0.2423 0.2981 ( 5263 PWs) bands (ev): -7.8386 -7.8385 -6.5182 -6.5162 -6.4173 -6.4108 -6.2419 -6.2323 -1.7143 -1.7129 1.1094 1.1271 1.4135 1.4229 1.6683 1.6756 2.2281 2.2431 2.4240 2.4376 2.5265 2.5359 2.5505 2.5550 3.0263 3.0467 3.0919 3.1126 3.1239 3.1282 3.3663 3.3840 4.5521 4.6146 4.6244 4.6776 4.7874 4.8110 4.8637 4.8830 4.9173 4.9387 5.3258 5.3472 5.3730 5.4042 5.6105 5.6899 5.6926 5.7748 6.0157 6.0619 6.5215 6.5712 6.8798 6.8844 7.1630 7.1902 7.2221 7.2516 7.5013 7.5133 9.1932 9.2015 10.3775 10.3789 10.8038 10.8546 10.8728 10.8907 k =-0.1654 0.2308 0.2839 ( 5267 PWs) bands (ev): -7.8596 -7.8595 -6.4989 -6.4970 -6.4028 -6.3963 -6.2421 -6.2327 -1.7333 -1.7320 1.1205 1.1394 1.4168 1.4270 1.6535 1.6609 2.2090 2.2249 2.4475 2.4609 2.5167 2.5227 2.5851 2.5855 3.0256 3.0463 3.0875 3.1084 3.1173 3.1237 3.3739 3.3901 4.5499 4.6167 4.6311 4.6760 4.7831 4.7984 4.8665 4.8849 4.9071 4.9327 5.3198 5.3214 5.3709 5.3792 5.5942 5.6684 5.7143 5.7963 6.0293 6.0787 6.5005 6.5500 6.8900 6.8957 7.1760 7.2198 7.2485 7.2623 7.5085 7.5211 9.1812 9.1897 10.4015 10.4025 10.7183 10.7498 10.8998 10.9007 k =-0.1571 0.2192 0.2697 ( 5277 PWs) bands (ev): -7.8802 -7.8801 -6.4794 -6.4775 -6.3887 -6.3823 -6.2423 -6.2332 -1.7523 -1.7512 1.1333 1.1533 1.4221 1.4329 1.6399 1.6471 2.1882 2.2049 2.4687 2.4799 2.5009 2.5054 2.6229 2.6232 3.0250 3.0460 3.0833 3.1042 3.1139 3.1224 3.3810 3.3960 4.5479 4.6179 4.6379 4.6751 4.7778 4.7867 4.8680 4.8860 4.8988 4.9266 5.2921 5.3070 5.3555 5.3681 5.5788 5.6478 5.7394 5.8186 6.0423 6.0942 6.4801 6.5289 6.8999 6.9059 7.1897 7.2502 7.2747 7.2777 7.5185 7.5316 9.1633 9.1719 10.4257 10.4261 10.6197 10.6456 10.9241 10.9290 k =-0.1488 0.2077 0.2555 ( 5269 PWs) bands (ev): -7.9004 -7.9004 -6.4597 -6.4579 -6.3751 -6.3689 -6.2426 -6.2337 -1.7713 -1.7702 1.1478 1.1687 1.4291 1.4407 1.6274 1.6346 2.1667 2.1843 2.4766 2.4833 2.4899 2.5015 2.6601 2.6613 3.0246 3.0457 3.0793 3.1003 3.1146 3.1249 3.3879 3.4015 4.5464 4.6182 4.6446 4.6751 4.7716 4.7759 4.8683 4.8864 4.8925 4.9204 5.2617 5.2870 5.3333 5.3620 5.5669 5.6296 5.7664 5.8417 6.0545 6.1081 6.4605 6.5082 6.9095 6.9151 7.2048 7.2782 7.2921 7.3086 7.5314 7.5448 9.1392 9.1480 10.4432 10.4503 10.5267 10.5441 10.9505 10.9569 k =-0.1406 0.1962 0.2413 ( 5273 PWs) bands (ev): -7.9201 -7.9200 -6.4402 -6.4384 -6.3621 -6.3560 -6.2429 -6.2342 -1.7900 -1.7891 1.1636 1.1854 1.4379 1.4504 1.6166 1.6236 2.1453 2.1637 2.4573 2.4666 2.4996 2.5118 2.6962 2.6985 3.0242 3.0454 3.0755 3.0967 3.1199 3.1317 3.3945 3.4067 4.5451 4.6175 4.6513 4.6760 4.7649 4.7659 4.8670 4.8859 4.8880 4.9140 5.2307 5.2618 5.3107 5.3511 5.5595 5.6151 5.7943 5.8654 6.0658 6.1205 6.4419 6.4881 6.9183 6.9232 7.2216 7.2970 7.3209 7.3408 7.5467 7.5604 9.1086 9.1175 10.4018 10.4341 10.4860 10.4947 10.9769 10.9839 k =-0.1323 0.1846 0.2271 ( 5277 PWs) bands (ev): -7.9391 -7.9391 -6.4208 -6.4191 -6.3496 -6.3437 -6.2432 -6.2348 -1.8084 -1.8076 1.1804 1.2031 1.4485 1.4619 1.6075 1.6142 2.1242 2.1435 2.4358 2.4460 2.5065 2.5171 2.7308 2.7345 3.0240 3.0452 3.0720 3.0934 3.1302 3.1432 3.4007 3.4117 4.5443 4.6162 4.6580 4.6776 4.7569 4.7581 4.8642 4.8843 4.8849 4.9077 5.1996 5.2340 5.2861 5.3352 5.5564 5.6049 5.8230 5.8896 6.0762 6.1316 6.4244 6.4687 6.9264 6.9301 7.2403 7.3133 7.3543 7.3738 7.5646 7.5782 9.0716 9.0807 10.3108 10.3396 10.5094 10.5154 11.0021 11.0093 k =-0.1240 0.1731 0.2129 ( 5281 PWs) bands (ev): -7.9574 -7.9574 -6.4019 -6.4002 -6.3378 -6.3319 -6.2435 -6.2353 -1.8263 -1.8256 1.1981 1.2213 1.4608 1.4751 1.6006 1.6070 2.1037 2.1239 2.4129 2.4240 2.5075 2.5165 2.7638 2.7690 3.0238 3.0448 3.0688 3.0904 3.1455 3.1593 3.4067 3.4165 4.5441 4.6145 4.6647 4.6799 4.7488 4.7513 4.8604 4.8816 4.8823 4.9016 5.1688 5.2051 5.2592 5.3146 5.5571 5.5992 5.8519 5.9141 6.0857 6.1415 6.4079 6.4501 6.9335 6.9356 7.2610 7.3306 7.3888 7.4073 7.5845 7.5980 9.0284 9.0376 10.2177 10.2446 10.5367 10.5414 11.0254 11.0327 k =-0.1157 0.1615 0.1987 ( 5281 PWs) bands (ev): -7.9748 -7.9748 -6.3834 -6.3819 -6.3265 -6.3209 -6.2438 -6.2359 -1.8437 -1.8430 1.2160 1.2396 1.4748 1.4900 1.5964 1.6022 2.0840 2.1052 2.3886 2.4006 2.5027 2.5101 2.7953 2.8016 3.0237 3.0444 3.0659 3.0875 3.1654 3.1798 3.4123 3.4210 4.5445 4.6127 4.6713 4.6825 4.7415 4.7446 4.8562 4.8777 4.8796 4.8960 5.1388 5.1761 5.2305 5.2900 5.5605 5.5973 5.8811 5.9388 6.0944 6.1502 6.3927 6.4324 6.9396 6.9398 7.2839 7.3497 7.4237 7.4409 7.6063 7.6193 8.9795 8.9889 10.1270 10.1525 10.5642 10.5680 11.0462 11.0534 k =-0.1075 0.1500 0.1845 ( 5291 PWs) bands (ev): -7.9914 -7.9913 -6.3656 -6.3643 -6.3159 -6.3105 -6.2441 -6.2365 -1.8604 -1.8598 1.2338 1.2573 1.4903 1.5065 1.5954 1.6004 2.0651 2.0873 2.3628 2.3758 2.4925 2.4982 2.8250 2.8323 3.0236 3.0439 3.0634 3.0847 3.1890 3.2038 3.4178 3.4254 4.5455 4.6112 4.6778 4.6853 4.7349 4.7384 4.8516 4.8722 4.8765 4.8911 5.1100 5.1477 5.2007 5.2624 5.5660 5.5984 5.9100 5.9635 6.1024 6.1579 6.3785 6.4156 6.9426 6.9443 7.3091 7.3707 7.4584 7.4743 7.6294 7.6418 8.9255 8.9352 10.0399 10.0642 10.5905 10.5935 11.0634 11.0705 k =-0.0992 0.1385 0.1703 ( 5283 PWs) bands (ev): -8.0069 -8.0069 -6.3487 -6.3474 -6.3060 -6.3008 -6.2443 -6.2370 -1.8762 -1.8757 1.2509 1.2739 1.5073 1.5243 1.5981 1.6020 2.0471 2.0704 2.3356 2.3494 2.4777 2.4817 2.8530 2.8611 3.0237 3.0432 3.0614 3.0822 3.2154 3.2303 3.4229 3.4296 4.5475 4.6102 4.6842 4.6882 4.7290 4.7327 4.8468 4.8655 4.8726 4.8870 5.0829 5.1203 5.1706 5.2331 5.5728 5.6016 5.9387 5.9880 6.1099 6.1648 6.3656 6.3998 6.9442 6.9478 7.3367 7.3940 7.4927 7.5072 7.6536 7.6652 8.8672 8.8771 9.9569 9.9800 10.6143 10.6166 11.0753 11.0824 k =-0.0909 0.1269 0.1561 ( 5281 PWs) bands (ev): -8.0214 -8.0214 -6.3326 -6.3316 -6.2967 -6.2918 -6.2446 -6.2375 -1.8912 -1.8908 1.2667 1.2887 1.5257 1.5433 1.6050 1.6077 2.0302 2.0546 2.3069 2.3215 2.4590 2.4615 2.8792 2.8877 3.0238 3.0424 3.0598 3.0798 3.2437 3.2583 3.4279 3.4336 4.5502 4.6099 4.6905 4.6910 4.7236 4.7277 4.8417 4.8576 4.8678 4.8835 5.0577 5.0943 5.1406 5.2029 5.5805 5.6062 5.9666 6.0121 6.1170 6.1709 6.3537 6.3850 6.9447 6.9500 7.3666 7.4197 7.5262 7.5392 7.6783 7.6888 8.8054 8.8155 9.8786 9.9004 10.6342 10.6357 11.0794 11.0857 k =-0.0827 0.1154 0.1420 ( 5281 PWs) bands (ev): -8.0348 -8.0348 -6.3175 -6.3168 -6.2882 -6.2835 -6.2447 -6.2380 -1.9052 -1.9049 1.2808 1.3012 1.5455 1.5633 1.6164 1.6178 2.0143 2.0398 2.2767 2.2920 2.4373 2.4382 2.9036 2.9122 3.0239 3.0413 3.0587 3.0776 3.2728 3.2870 3.4325 3.4374 4.5539 4.6105 4.6935 4.6964 4.7187 4.7234 4.8360 4.8488 4.8624 4.8805 5.0350 5.0702 5.1113 5.1725 5.5886 5.6116 5.9936 6.0354 6.1237 6.1764 6.3430 6.3712 6.9441 6.9508 7.3989 7.4478 7.5584 7.5700 7.7030 7.7125 8.7409 8.7512 9.8053 9.8258 10.6485 10.6493 11.0748 11.0789 k =-0.0744 0.1038 0.1278 ( 5291 PWs) bands (ev): -8.0471 -8.0471 -6.3036 -6.3032 -6.2803 -6.2761 -6.2448 -6.2384 -1.9182 -1.9179 1.2927 1.3111 1.5664 1.5840 1.6325 1.6326 1.9995 2.0261 2.2451 2.2610 2.4129 2.4135 2.9259 2.9344 3.0242 3.0401 3.0579 3.0755 3.3018 3.3153 3.4369 3.4409 4.5585 4.6122 4.6956 4.7015 4.7140 4.7203 4.8293 4.8392 4.8566 4.8784 5.0153 5.0482 5.0829 5.1424 5.5967 5.6173 6.0192 6.0576 6.1303 6.1813 6.3333 6.3584 6.9427 6.9505 7.4335 7.4784 7.5890 7.5994 7.7272 7.7356 8.6746 8.6852 9.7375 9.7565 10.6562 10.6565 11.0668 11.0686 k =-0.0661 0.0923 0.1136 ( 5299 PWs) bands (ev): -8.0582 -8.0582 -6.2911 -6.2910 -6.2730 -6.2694 -6.2447 -6.2388 -1.9300 -1.9297 1.3024 1.3185 1.5881 1.6054 1.6519 1.6531 1.9858 2.0134 2.2121 2.2284 2.3863 2.3883 2.9460 2.9543 3.0245 3.0389 3.0577 3.0737 3.3300 3.3426 3.4409 3.4443 4.5642 4.6150 4.6972 4.7047 4.7096 4.7195 4.8207 4.8289 4.8515 4.8772 4.9986 5.0285 5.0558 5.1132 5.6047 5.6229 6.0432 6.0782 6.1369 6.1858 6.3248 6.3466 6.9406 6.9491 7.4702 7.5112 7.6177 7.6269 7.7505 7.7579 8.6075 8.6183 9.6757 9.6930 10.6570 10.6571 11.0608 11.0612 k =-0.0579 0.0808 0.0994 ( 5307 PWs) bands (ev): -8.0681 -8.0681 -6.2805 -6.2797 -6.2663 -6.2637 -6.2444 -6.2390 -1.9406 -1.9404 1.3099 1.3236 1.6104 1.6271 1.6753 1.6777 1.9734 2.0017 2.1779 2.1945 2.3595 2.3627 2.9638 2.9717 3.0250 3.0376 3.0577 3.0720 3.3565 3.3681 3.4447 3.4474 4.5709 4.6191 4.6981 4.7049 4.7052 4.7217 4.8100 4.8183 4.8479 4.8772 4.9851 5.0110 5.0304 5.0852 5.6122 5.6283 6.0651 6.0966 6.1440 6.1899 6.3174 6.3360 6.9380 6.9467 7.5088 7.5461 7.6441 7.6523 7.7724 7.7787 8.5406 8.5516 9.6200 9.6356 10.6519 10.6522 11.0584 11.0587 k =-0.0496 0.0692 0.0852 ( 5297 PWs) bands (ev): -8.0767 -8.0767 -6.2718 -6.2699 -6.2600 -6.2589 -6.2438 -6.2391 -1.9499 -1.9497 1.3155 1.3269 1.6327 1.6490 1.7020 1.7059 1.9622 1.9909 2.1425 2.1593 2.3332 2.3374 2.9793 2.9865 3.0258 3.0365 3.0583 3.0707 3.3810 3.3912 3.4480 3.4501 4.5787 4.6245 4.6980 4.7011 4.7036 4.7255 4.7976 4.8077 4.8462 4.8786 4.9745 4.9951 5.0076 5.0587 5.6193 5.6331 6.0845 6.1119 6.1521 6.1937 6.3110 6.3264 6.9353 6.9438 7.5487 7.5825 7.6680 7.6753 7.7926 7.7978 8.4751 8.4860 9.5711 9.5848 10.6428 10.6431 11.0592 11.0597 k =-0.0413 0.0577 0.0710 ( 5293 PWs) bands (ev): -8.0840 -8.0840 -6.2651 -6.2617 -6.2554 -6.2541 -6.2425 -6.2389 -1.9578 -1.9577 1.3196 1.3287 1.6544 1.6701 1.7316 1.7371 1.9525 1.9808 2.1062 2.1230 2.3085 2.3133 2.9922 2.9986 3.0268 3.0355 3.0591 3.0694 3.4027 3.4114 3.4511 3.4526 4.5875 4.6312 4.6941 4.6994 4.7018 4.7286 4.7847 4.7976 4.8465 4.8813 4.9664 4.9779 4.9902 5.0339 5.6257 5.6372 6.1013 6.1236 6.1614 6.1972 6.3057 6.3180 6.9327 6.9406 7.5892 7.6195 7.6889 7.6956 7.8104 7.8146 8.4122 8.4230 9.5291 9.5408 10.6317 10.6320 11.0619 11.0624 k =-0.0331 0.0462 0.0568 ( 5291 PWs) bands (ev): -8.0901 -8.0901 -6.2602 -6.2552 -6.2529 -6.2490 -6.2406 -6.2384 -1.9644 -1.9643 1.3225 1.3296 1.6747 1.6896 1.7635 1.7706 1.9445 1.9712 2.0694 2.0860 2.2864 2.2914 3.0024 3.0079 3.0282 3.0348 3.0602 3.0685 3.4213 3.4282 3.4537 3.4546 4.5972 4.6391 4.6879 4.6987 4.7001 4.7293 4.7732 4.7886 4.8490 4.8855 4.9590 4.9605 4.9790 5.0111 5.6312 5.6406 6.1150 6.1317 6.1716 6.2003 6.3014 6.3107 6.9303 6.9372 7.6290 7.6557 7.7066 7.7130 7.8256 7.8289 8.3539 8.3642 9.4945 9.5040 10.6203 10.6205 11.0651 11.0655 k =-0.0248 0.0346 0.0426 ( 5291 PWs) bands (ev): -8.0948 -8.0948 -6.2568 -6.2523 -6.2497 -6.2452 -6.2383 -6.2375 -1.9696 -1.9695 1.3246 1.3298 1.6930 1.7060 1.7973 1.8057 1.9384 1.9619 2.0326 2.0487 2.2679 2.2726 3.0097 3.0141 3.0300 3.0347 3.0616 3.0677 3.4363 3.4412 3.4561 3.4563 4.6078 4.6476 4.6808 4.6981 4.6987 4.7251 4.7659 4.7811 4.8537 4.8904 4.9416 4.9560 4.9709 4.9905 5.6359 5.6430 6.1256 6.1370 6.1815 6.2027 6.2981 6.3048 6.9285 6.9340 7.6660 7.6888 7.7211 7.7273 7.8378 7.8403 8.3024 8.3117 9.4675 9.4747 10.6102 10.6103 11.0679 11.0681 k =-0.0165 0.0231 0.0284 ( 5307 PWs) bands (ev): -8.0981 -8.0981 -6.2545 -6.2517 -6.2464 -6.2432 -6.2362 -6.2360 -1.9733 -1.9732 1.3261 1.3295 1.7081 1.7180 1.8323 1.8414 1.9342 1.9522 1.9972 2.0121 2.2542 2.2578 3.0145 3.0176 3.0320 3.0349 3.0631 3.0670 3.4473 3.4498 3.4577 3.4584 4.6189 4.6539 4.6756 4.6975 4.6976 4.7156 4.7636 4.7751 4.8607 4.8936 4.9292 4.9520 4.9652 4.9733 5.6396 5.6443 6.1332 6.1400 6.1902 6.2040 6.2959 6.3001 6.9273 6.9312 7.6972 7.7146 7.7332 7.7385 7.8469 7.8486 8.2614 8.2686 9.4483 9.4532 10.6023 10.6023 11.0699 11.0700 k =-0.0083 0.0115 0.0142 ( 5313 PWs) bands (ev): -8.1002 -8.1002 -6.2530 -6.2517 -6.2441 -6.2425 -6.2347 -6.2347 -1.9755 -1.9755 1.3273 1.3289 1.7191 1.7245 1.8670 1.8756 1.9303 1.9385 1.9694 1.9794 2.2460 2.2480 3.0173 3.0189 3.0338 3.0351 3.0644 3.0663 3.4535 3.4540 3.4593 3.4605 4.6303 4.6511 4.6794 4.6966 4.6972 4.7037 4.7645 4.7704 4.8697 4.8898 4.9275 4.9453 4.9615 4.9627 5.6424 5.6447 6.1382 6.1413 6.1970 6.2038 6.2949 6.2969 6.9270 6.9290 7.7186 7.7274 7.7444 7.7467 7.8527 7.8536 8.2349 8.2390 9.4373 9.4398 10.5973 10.5973 11.0710 11.0711 k = 0.0000 0.0000 0.0000 ( 5317 PWs) bands (ev): -8.1009 -8.1009 -6.2521 -6.2521 -6.2429 -6.2429 -6.2342 -6.2342 -1.9763 -1.9763 1.3282 1.3282 1.7248 1.7248 1.8930 1.8930 1.9233 1.9233 1.9620 1.9620 2.2440 2.2440 3.0187 3.0187 3.0348 3.0348 3.0655 3.0655 3.4551 3.4551 3.4609 3.4609 4.6415 4.6415 4.6899 4.6899 4.6975 4.6975 4.7670 4.7670 4.8800 4.8800 4.9351 4.9351 4.9601 4.9601 5.6441 5.6441 6.1407 6.1407 6.2015 6.2015 6.2952 6.2952 6.9276 6.9276 7.7282 7.7282 7.7499 7.7499 7.8549 7.8549 8.2270 8.2270 9.4344 9.4344 10.5956 10.5956 11.0714 11.0714 k = 0.0000 0.0000 0.0000 ( 5317 PWs) bands (ev): -8.1009 -8.1009 -6.2521 -6.2521 -6.2429 -6.2429 -6.2342 -6.2342 -1.9763 -1.9763 1.3282 1.3282 1.7248 1.7248 1.8930 1.8930 1.9233 1.9233 1.9620 1.9620 2.2440 2.2440 3.0187 3.0187 3.0348 3.0348 3.0655 3.0655 3.4551 3.4551 3.4609 3.4609 4.6415 4.6415 4.6899 4.6899 4.6975 4.6975 4.7670 4.7670 4.8800 4.8800 4.9351 4.9351 4.9601 4.9601 5.6441 5.6441 6.1407 6.1407 6.2015 6.2015 6.2952 6.2952 6.9276 6.9276 7.7282 7.7282 7.7499 7.7499 7.8549 7.8549 8.2270 8.2270 9.4344 9.4344 10.5956 10.5956 11.0714 11.0714 k = 0.0167 0.0119-0.0000 ( 5305 PWs) bands (ev): -8.1001 -8.1001 -6.2534 -6.2534 -6.2432 -6.2432 -6.2342 -6.2342 -1.9752 -1.9752 1.3280 1.3280 1.7267 1.7267 1.8860 1.8860 1.9239 1.9239 1.9623 1.9623 2.2517 2.2517 3.0188 3.0188 3.0346 3.0346 3.0644 3.0644 3.4552 3.4552 3.4611 3.4611 4.6419 4.6419 4.6897 4.6897 4.6975 4.6975 4.7665 4.7665 4.8807 4.8807 4.9352 4.9352 4.9609 4.9609 5.6430 5.6430 6.1410 6.1410 6.2018 6.2018 6.2952 6.2952 6.9269 6.9269 7.7261 7.7261 7.7476 7.7476 7.8449 7.8449 8.2407 8.2407 9.4351 9.4351 10.5954 10.5954 11.0684 11.0684 k = 0.0333 0.0239-0.0000 ( 5305 PWs) bands (ev): -8.0980 -8.0980 -6.2574 -6.2574 -6.2437 -6.2437 -6.2343 -6.2343 -1.9721 -1.9721 1.3274 1.3274 1.7323 1.7323 1.8666 1.8666 1.9252 1.9252 1.9631 1.9631 2.2734 2.2734 3.0189 3.0189 3.0333 3.0333 3.0612 3.0612 3.4556 3.4556 3.4617 3.4617 4.6427 4.6427 4.6891 4.6891 4.6974 4.6974 4.7653 4.7653 4.8828 4.8828 4.9354 4.9354 4.9633 4.9633 5.6398 5.6398 6.1418 6.1418 6.2025 6.2025 6.2953 6.2953 6.9251 6.9251 7.7194 7.7194 7.7406 7.7406 7.8188 7.8188 8.2778 8.2778 9.4370 9.4370 10.5950 10.5950 11.0595 11.0595 k = 0.0500 0.0358-0.0000 ( 5301 PWs) bands (ev): -8.0944 -8.0944 -6.2645 -6.2645 -6.2443 -6.2443 -6.2346 -6.2346 -1.9670 -1.9670 1.3265 1.3265 1.7414 1.7414 1.8384 1.8384 1.9274 1.9274 1.9649 1.9649 2.3051 2.3051 3.0189 3.0189 3.0304 3.0304 3.0568 3.0568 3.4562 3.4562 3.4625 3.4625 4.6441 4.6441 4.6878 4.6878 4.6974 4.6974 4.7638 4.7638 4.8859 4.8859 4.9357 4.9357 4.9669 4.9669 5.6346 5.6346 6.1431 6.1431 6.2038 6.2038 6.2955 6.2955 6.9220 6.9220 7.7085 7.7085 7.7284 7.7284 7.7845 7.7845 8.3310 8.3310 9.4403 9.4403 10.5942 10.5942 11.0442 11.0442 k = 0.0667 0.0478-0.0000 ( 5313 PWs) bands (ev): -8.0893 -8.0893 -6.2746 -6.2746 -6.2447 -6.2447 -6.2349 -6.2349 -1.9599 -1.9599 1.3257 1.3257 1.7532 1.7532 1.8054 1.8054 1.9304 1.9304 1.9676 1.9676 2.3435 2.3435 3.0182 3.0182 3.0250 3.0250 3.0527 3.0527 3.4570 3.4570 3.4637 3.4637 4.6460 4.6460 4.6854 4.6854 4.6974 4.6974 4.7625 4.7625 4.8901 4.8901 4.9362 4.9362 4.9715 4.9715 5.6277 5.6277 6.1449 6.1449 6.2055 6.2055 6.2958 6.2958 6.9176 6.9176 7.6934 7.6934 7.7098 7.7098 7.7491 7.7491 8.3941 8.3941 9.4449 9.4449 10.5930 10.5930 11.0222 11.0222 k = 0.0833 0.0597-0.0000 ( 5321 PWs) bands (ev): -8.0829 -8.0829 -6.2876 -6.2876 -6.2452 -6.2452 -6.2353 -6.2353 -1.9510 -1.9510 1.3252 1.3252 1.7578 1.7578 1.7794 1.7794 1.9341 1.9341 1.9711 1.9711 2.3861 2.3861 3.0110 3.0110 3.0217 3.0217 3.0504 3.0504 3.4581 3.4581 3.4652 3.4652 4.6485 4.6485 4.6819 4.6819 4.6974 4.6974 4.7619 4.7619 4.8952 4.8952 4.9369 4.9369 4.9768 4.9768 5.6193 5.6193 6.1470 6.1470 6.2077 6.2077 6.2961 6.2961 6.9120 6.9120 7.6737 7.6737 7.6836 7.6836 7.7183 7.7183 8.4635 8.4635 9.4508 9.4508 10.5912 10.5912 10.9932 10.9932 k = 0.1000 0.0717-0.0000 ( 5321 PWs) bands (ev): -8.0751 -8.0751 -6.3033 -6.3033 -6.2456 -6.2456 -6.2358 -6.2358 -1.9404 -1.9404 1.3252 1.3252 1.7255 1.7255 1.7916 1.7916 1.9386 1.9386 1.9753 1.9753 2.4312 2.4312 2.9961 2.9961 3.0218 3.0218 3.0496 3.0496 3.4594 3.4594 3.4670 3.4670 4.6514 4.6514 4.6770 4.6770 4.6973 4.6973 4.7625 4.7625 4.9011 4.9011 4.9377 4.9377 4.9824 4.9824 5.6098 5.6098 6.1496 6.1496 6.2103 6.2103 6.2965 6.2965 6.9051 6.9051 7.6461 7.6461 7.6558 7.6558 7.6917 7.6917 8.5367 8.5367 9.4581 9.4581 10.5887 10.5887 10.9569 10.9569 k = 0.1167 0.0836-0.0000 ( 5321 PWs) bands (ev): -8.0659 -8.0659 -6.3216 -6.3216 -6.2461 -6.2461 -6.2364 -6.2364 -1.9283 -1.9283 1.3262 1.3262 1.6869 1.6869 1.8120 1.8120 1.9437 1.9437 1.9803 1.9803 2.4778 2.4778 2.9770 2.9770 3.0224 3.0224 3.0498 3.0498 3.4609 3.4609 3.4691 3.4691 4.6548 4.6548 4.6707 4.6707 4.6973 4.6973 4.7644 4.7644 4.9075 4.9075 4.9388 4.9388 4.9882 4.9882 5.5998 5.5998 6.1525 6.1525 6.2131 6.2131 6.2969 6.2969 6.8970 6.8970 7.6128 7.6128 7.6296 7.6296 7.6656 7.6656 8.6121 8.6121 9.4668 9.4668 10.5855 10.5855 10.9133 10.9133 k = 0.1333 0.0955-0.0000 ( 5317 PWs) bands (ev): -8.0554 -8.0554 -6.3423 -6.3423 -6.2466 -6.2466 -6.2370 -6.2370 -1.9148 -1.9148 1.3284 1.3284 1.6479 1.6479 1.8350 1.8350 1.9495 1.9495 1.9859 1.9859 2.5251 2.5251 2.9544 2.9544 3.0234 3.0234 3.0507 3.0507 3.4626 3.4626 3.4714 3.4714 4.6580 4.6580 4.6638 4.6638 4.6974 4.6974 4.7676 4.7676 4.9140 4.9140 4.9401 4.9401 4.9942 4.9942 5.5896 5.5896 6.1556 6.1556 6.2161 6.2161 6.2974 6.2974 6.8876 6.8876 7.5802 7.5802 7.6018 7.6018 7.6385 7.6385 8.6882 8.6882 9.4769 9.4769 10.5818 10.5818 10.8629 10.8629 k = 0.1500 0.1075-0.0000 ( 5305 PWs) bands (ev): -8.0436 -8.0436 -6.3652 -6.3652 -6.2471 -6.2471 -6.2377 -6.2377 -1.9001 -1.9001 1.3320 1.3320 1.6093 1.6093 1.8599 1.8599 1.9559 1.9559 1.9921 1.9921 2.5725 2.5725 2.9287 2.9287 3.0245 3.0245 3.0520 3.0520 3.4644 3.4644 3.4738 3.4738 4.6530 4.6530 4.6643 4.6643 4.6974 4.6974 4.7719 4.7719 4.9200 4.9200 4.9415 4.9415 5.0005 5.0005 5.5799 5.5799 6.1589 6.1589 6.2194 6.2194 6.2980 6.2980 6.8770 6.8770 7.5499 7.5499 7.5721 7.5721 7.6101 7.6101 8.7639 8.7639 9.4884 9.4884 10.5777 10.5777 10.8063 10.8063 k = 0.1667 0.1194-0.0000 ( 5293 PWs) bands (ev): -8.0305 -8.0305 -6.3901 -6.3901 -6.2477 -6.2477 -6.2384 -6.2384 -1.8845 -1.8845 1.3374 1.3374 1.5716 1.5716 1.8864 1.8864 1.9629 1.9629 1.9988 1.9988 2.6197 2.6197 2.9001 2.9001 3.0259 3.0259 3.0537 3.0537 3.4664 3.4664 3.4765 3.4765 4.6434 4.6434 4.6689 4.6689 4.6975 4.6975 4.7771 4.7771 4.9250 4.9250 4.9431 4.9431 5.0079 5.0079 5.5710 5.5710 6.1620 6.1620 6.2224 6.2224 6.2986 6.2986 6.8652 6.8652 7.5222 7.5222 7.5409 7.5409 7.5808 7.5808 8.8379 8.8379 9.5013 9.5013 10.5739 10.5739 10.7445 10.7445 k = 0.1833 0.1314-0.0000 ( 5273 PWs) bands (ev): -8.0163 -8.0163 -6.4168 -6.4168 -6.2483 -6.2483 -6.2392 -6.2392 -1.8681 -1.8681 1.3446 1.3446 1.5349 1.5349 1.9139 1.9139 1.9704 1.9704 2.0060 2.0060 2.6662 2.6662 2.8689 2.8689 3.0274 3.0274 3.0557 3.0557 3.4686 3.4686 3.4793 3.4793 4.6325 4.6325 4.6742 4.6742 4.6976 4.6976 4.7826 4.7826 4.9281 4.9281 4.9448 4.9448 5.0172 5.0172 5.5633 5.5633 6.1648 6.1648 6.2253 6.2253 6.2993 6.2993 6.8521 6.8521 7.4966 7.4966 7.5090 7.5091 7.5513 7.5513 8.9091 8.9091 9.5156 9.5156 10.5708 10.5708 10.6788 10.6788 k = 0.2000 0.1433-0.0000 ( 5281 PWs) bands (ev): -8.0010 -8.0010 -6.4451 -6.4451 -6.2489 -6.2489 -6.2401 -6.2401 -1.8511 -1.8511 1.3539 1.3539 1.4994 1.4994 1.9419 1.9419 1.9786 1.9786 2.0137 2.0137 2.7116 2.7116 2.8353 2.8353 3.0292 3.0292 3.0580 3.0580 3.4708 3.4708 3.4822 3.4822 4.6207 4.6207 4.6795 4.6795 4.6979 4.6979 4.7882 4.7882 4.9288 4.9288 4.9461 4.9461 5.0288 5.0288 5.5573 5.5573 6.1673 6.1673 6.2278 6.2278 6.3000 6.3000 6.8378 6.8378 7.4712 7.4712 7.4782 7.4782 7.5224 7.5224 8.9765 8.9765 9.5311 9.5311 10.5675 10.5675 10.6122 10.6122 k = 0.2167 0.1552-0.0000 ( 5281 PWs) bands (ev): -7.9846 -7.9846 -6.4748 -6.4748 -6.2495 -6.2495 -6.2409 -6.2409 -1.8338 -1.8338 1.3654 1.3654 1.4654 1.4654 1.9683 1.9683 1.9889 1.9889 2.0221 2.0221 2.7558 2.7558 2.7994 2.7994 3.0310 3.0310 3.0606 3.0606 3.4732 3.4732 3.4852 3.4852 4.6080 4.6080 4.6851 4.6851 4.6982 4.6982 4.7934 4.7934 4.9271 4.9271 4.9479 4.9479 5.0434 5.0434 5.5529 5.5529 6.1692 6.1692 6.2298 6.2298 6.3007 6.3007 6.8223 6.8223 7.4410 7.4410 7.4527 7.4527 7.4959 7.4959 9.0388 9.0388 9.5478 9.5478 10.5316 10.5316 10.5735 10.5735 k = 0.2333 0.1672-0.0000 ( 5281 PWs) bands (ev): -7.9672 -7.9672 -6.5055 -6.5055 -6.2501 -6.2501 -6.2418 -6.2418 -1.8164 -1.8164 1.3791 1.3791 1.4331 1.4331 1.9868 1.9868 2.0063 2.0063 2.0320 2.0320 2.7612 2.7612 2.7987 2.7987 3.0331 3.0331 3.0633 3.0633 3.4755 3.4755 3.4882 3.4882 4.5944 4.5944 4.6904 4.6904 4.6992 4.6992 4.7976 4.7976 4.9236 4.9236 4.9500 4.9500 5.0607 5.0607 5.5503 5.5503 6.1705 6.1705 6.2311 6.2311 6.3014 6.3014 6.8057 6.8057 7.4091 7.4091 7.4283 7.4283 7.4736 7.4736 9.0951 9.0951 9.5654 9.5654 10.4618 10.4619 10.5014 10.5014 k = 0.2500 0.1791-0.0000 ( 5281 PWs) bands (ev): -7.9490 -7.9490 -6.5372 -6.5372 -6.2508 -6.2508 -6.2428 -6.2428 -1.7990 -1.7990 1.3929 1.3929 1.4048 1.4048 1.9973 1.9973 2.0261 2.0261 2.0477 2.0477 2.7214 2.7214 2.8396 2.8396 3.0353 3.0353 3.0663 3.0663 3.4779 3.4779 3.4913 3.4913 4.5797 4.5797 4.6942 4.6942 4.7018 4.7018 4.8003 4.8003 4.9195 4.9195 4.9526 4.9526 5.0805 5.0805 5.5494 5.5494 6.1709 6.1709 6.2317 6.2317 6.3022 6.3022 6.7879 6.7879 7.3779 7.3779 7.4026 7.4026 7.4564 7.4564 9.1447 9.1447 9.5837 9.5837 10.3899 10.3899 10.4259 10.4259 k = 0.2667 0.1911-0.0000 ( 5269 PWs) bands (ev): -7.9301 -7.9301 -6.5694 -6.5694 -6.2514 -6.2514 -6.2437 -6.2437 -1.7820 -1.7820 1.3718 1.3718 1.4155 1.4155 2.0059 2.0059 2.0384 2.0384 2.0724 2.0724 2.6802 2.6802 2.8786 2.8786 3.0377 3.0377 3.0695 3.0695 3.4803 3.4803 3.4943 3.4943 4.5639 4.5639 4.6959 4.6959 4.7068 4.7068 4.8007 4.8007 4.9164 4.9164 4.9555 4.9555 5.1023 5.1023 5.5500 5.5500 6.1704 6.1704 6.2314 6.2314 6.3031 6.3031 6.7693 6.7693 7.3479 7.3479 7.3761 7.3761 7.4437 7.4437 9.1871 9.1871 9.6026 9.6026 10.3185 10.3185 10.3515 10.3515 k = 0.2833 0.2030-0.0000 ( 5270 PWs) bands (ev): -7.9106 -7.9106 -6.6020 -6.6020 -6.2520 -6.2520 -6.2446 -6.2446 -1.7653 -1.7653 1.3447 1.3447 1.4366 1.4366 2.0139 2.0139 2.0474 2.0474 2.0999 2.0999 2.6379 2.6379 2.9153 2.9153 3.0402 3.0402 3.0729 3.0729 3.4827 3.4827 3.4973 3.4973 4.5470 4.5470 4.6965 4.6965 4.7127 4.7127 4.7983 4.7983 4.9151 4.9151 4.9586 4.9586 5.1260 5.1260 5.5518 5.5518 6.1687 6.1687 6.2301 6.2301 6.3039 6.3039 6.7497 6.7497 7.3197 7.3197 7.3499 7.3499 7.4344 7.4344 9.2221 9.2221 9.6218 9.6218 10.2487 10.2487 10.2791 10.2791 k = 0.3000 0.2150-0.0000 ( 5286 PWs) bands (ev): -7.8906 -7.8906 -6.6346 -6.6346 -6.2526 -6.2526 -6.2455 -6.2455 -1.7493 -1.7493 1.3192 1.3192 1.4604 1.4604 2.0215 2.0215 2.0553 2.0553 2.1270 2.1270 2.5952 2.5952 2.9497 2.9497 3.0428 3.0428 3.0764 3.0764 3.4850 3.4850 3.5002 3.5002 4.5288 4.5288 4.6968 4.6968 4.7189 4.7189 4.7933 4.7933 4.9163 4.9163 4.9621 4.9621 5.1509 5.1509 5.5545 5.5545 6.1658 6.1658 6.2276 6.2276 6.3047 6.3047 6.7294 6.7294 7.2936 7.2936 7.3249 7.3249 7.4276 7.4276 9.2500 9.2500 9.6412 9.6412 10.1813 10.1813 10.2093 10.2093 k = 0.3167 0.2269-0.0000 ( 5318 PWs) bands (ev): -7.8704 -7.8704 -6.6669 -6.6669 -6.2532 -6.2532 -6.2464 -6.2464 -1.7341 -1.7341 1.2955 1.2955 1.4869 1.4869 2.0287 2.0287 2.0626 2.0626 2.1522 2.1522 2.5527 2.5527 2.9815 2.9815 3.0454 3.0454 3.0800 3.0800 3.4872 3.4872 3.5030 3.5030 4.5096 4.5096 4.6970 4.6970 4.7249 4.7249 4.7863 4.7863 4.9196 4.9196 4.9657 4.9657 5.1770 5.1770 5.5580 5.5580 6.1618 6.1618 6.2242 6.2242 6.3055 6.3055 6.7085 6.7085 7.2698 7.2698 7.3016 7.3016 7.4229 7.4229 9.2711 9.2711 9.6607 9.6607 10.1169 10.1169 10.1427 10.1427 k = 0.3333 0.2388-0.0000 ( 5318 PWs) bands (ev): -7.8502 -7.8502 -6.6986 -6.6986 -6.2538 -6.2538 -6.2472 -6.2472 -1.7198 -1.7198 1.2738 1.2738 1.5159 1.5159 2.0355 2.0355 2.0695 2.0695 2.1740 2.1740 2.5118 2.5118 3.0104 3.0104 3.0481 3.0481 3.0840 3.0840 3.4893 3.4893 3.5056 3.5056 4.4897 4.4897 4.6972 4.6972 4.7308 4.7308 4.7783 4.7783 4.9248 4.9248 4.9696 4.9696 5.2037 5.2037 5.5619 5.5619 6.1567 6.1567 6.2198 6.2198 6.3064 6.3064 6.6874 6.6874 7.2486 7.2486 7.2804 7.2804 7.4197 7.4197 9.2863 9.2863 9.6802 9.6802 10.0563 10.0563 10.0800 10.0800 k = 0.3500 0.2508-0.0000 ( 5314 PWs) bands (ev): -7.8302 -7.8302 -6.7293 -6.7293 -6.2543 -6.2543 -6.2480 -6.2480 -1.7065 -1.7065 1.2540 1.2540 1.5473 1.5473 2.0418 2.0418 2.0758 2.0758 2.1901 2.1901 2.4745 2.4745 3.0357 3.0357 3.0513 3.0513 3.0884 3.0884 3.4913 3.4913 3.5082 3.5082 4.4693 4.4693 4.6974 4.6974 4.7365 4.7365 4.7701 4.7701 4.9311 4.9311 4.9737 4.9737 5.2305 5.2305 5.5660 5.5660 6.1507 6.1507 6.2145 6.2145 6.3073 6.3073 6.6663 6.6663 7.2301 7.2301 7.2616 7.2616 7.4178 7.4178 9.2964 9.2964 9.6994 9.6994 10.0000 10.0000 10.0216 10.0216 k = 0.3667 0.2627-0.0000 ( 5322 PWs) bands (ev): -7.8107 -7.8107 -6.7586 -6.7586 -6.2547 -6.2547 -6.2487 -6.2487 -1.6944 -1.6944 1.2362 1.2362 1.5811 1.5811 2.0474 2.0474 2.0816 2.0816 2.1975 2.1975 2.4436 2.4436 3.0508 3.0508 3.0604 3.0605 3.0940 3.0940 3.4931 3.4931 3.5105 3.5105 4.4489 4.4489 4.6976 4.6976 4.7417 4.7417 4.7621 4.7621 4.9380 4.9380 4.9778 4.9778 5.2570 5.2570 5.5701 5.5701 6.1439 6.1439 6.2086 6.2086 6.3081 6.3081 6.6455 6.6455 7.2142 7.2142 7.2451 7.2451 7.4169 7.4169 9.3023 9.3023 9.7181 9.7181 9.9486 9.9486 9.9679 9.9679 k = 0.3833 0.2747-0.0000 ( 5318 PWs) bands (ev): -7.7920 -7.7920 -6.7861 -6.7861 -6.2552 -6.2552 -6.2494 -6.2494 -1.6835 -1.6835 1.2204 1.2204 1.6171 1.6171 2.0524 2.0524 2.0868 2.0868 2.1928 2.1928 2.4226 2.4226 3.0543 3.0543 3.0753 3.0753 3.1024 3.1024 3.4948 3.4948 3.5127 3.5127 4.4291 4.4291 4.6979 4.6979 4.7466 4.7466 4.7547 4.7547 4.9452 4.9452 4.9819 4.9819 5.2826 5.2826 5.5740 5.5740 6.1368 6.1368 6.2023 6.2023 6.3090 6.3090 6.6254 6.6254 7.2009 7.2009 7.2310 7.2310 7.4166 7.4166 9.3052 9.3052 9.7355 9.7355 9.9029 9.9029 9.9195 9.9195 k = 0.4000 0.2866-0.0000 ( 5318 PWs) bands (ev): -7.7746 -7.7746 -6.8114 -6.8114 -6.2555 -6.2555 -6.2500 -6.2500 -1.6739 -1.6739 1.2067 1.2067 1.6553 1.6553 2.0565 2.0565 2.0914 2.0914 2.1744 2.1744 2.4129 2.4129 3.0566 3.0566 3.0844 3.0844 3.1145 3.1145 3.4963 3.4963 3.5145 3.5145 4.4103 4.4103 4.6983 4.6983 4.7480 4.7480 4.7510 4.7510 4.9520 4.9520 4.9857 4.9857 5.3066 5.3066 5.5777 5.5777 6.1295 6.1295 6.1959 6.1959 6.3097 6.3097 6.6065 6.6065 7.1900 7.1900 7.2192 7.2192 7.4169 7.4169 9.3058 9.3058 9.7505 9.7505 9.8638 9.8638 9.8767 9.8767 k = 0.4167 0.2986-0.0000 ( 5314 PWs) bands (ev): -7.7588 -7.7588 -6.8339 -6.8339 -6.2558 -6.2558 -6.2505 -6.2505 -1.6657 -1.6657 1.1951 1.1951 1.6953 1.6953 2.0593 2.0593 2.0952 2.0952 2.1452 2.1452 2.4121 2.4121 3.0586 3.0586 3.0895 3.0895 3.1275 3.1275 3.4977 3.4977 3.5162 3.5162 4.3933 4.3933 4.6986 4.6986 4.7426 4.7426 4.7545 4.7545 4.9583 4.9583 4.9893 4.9893 5.3284 5.3284 5.5810 5.5810 6.1226 6.1226 6.1898 6.1898 6.3104 6.3104 6.5893 6.5893 7.1812 7.1812 7.2096 7.2096 7.4175 7.4175 9.3050 9.3050 9.7607 9.7607 9.8337 9.8337 9.8401 9.8401 k = 0.4333 0.3105-0.0000 ( 5306 PWs) bands (ev): -7.7451 -7.7451 -6.8532 -6.8532 -6.2561 -6.2561 -6.2510 -6.2510 -1.6589 -1.6589 1.1855 1.1855 1.7372 1.7372 2.0589 2.0589 2.0973 2.0973 2.1116 2.1116 2.4163 2.4163 3.0603 3.0603 3.0927 3.0927 3.1392 3.1392 3.4987 3.4987 3.5176 3.5176 4.3784 4.3784 4.6989 4.6989 4.7381 4.7381 4.7576 4.7576 4.9638 4.9638 4.9926 4.9926 5.3474 5.3474 5.5838 5.5838 6.1162 6.1162 6.1842 6.1842 6.3110 6.3110 6.5742 6.5742 7.1745 7.1745 7.2020 7.2020 7.4182 7.4182 9.3034 9.3034 9.7609 9.7609 9.8087 9.8087 9.8185 9.8185 k = 0.4500 0.3224-0.0000 ( 5306 PWs) bands (ev): -7.7338 -7.7338 -6.8689 -6.8689 -6.2563 -6.2563 -6.2513 -6.2513 -1.6536 -1.6536 1.1781 1.1781 1.7806 1.7806 2.0446 2.0446 2.0832 2.0832 2.1023 2.1023 2.4221 2.4221 3.0616 3.0616 3.0950 3.0950 3.1487 3.1487 3.4996 3.4996 3.5187 3.5187 4.3663 4.3663 4.6992 4.6992 4.7345 4.7345 4.7600 4.7600 4.9683 4.9683 4.9952 4.9952 5.3630 5.3630 5.5860 5.5860 6.1109 6.1109 6.1795 6.1795 6.3115 6.3115 6.5618 6.5618 7.1696 7.1696 7.1963 7.1963 7.4188 7.4188 9.3017 9.3017 9.7506 9.7506 9.7848 9.7848 9.8166 9.8166 k = 0.4667 0.3344-0.0000 ( 5294 PWs) bands (ev): -7.7254 -7.7254 -6.8805 -6.8805 -6.2564 -6.2564 -6.2516 -6.2516 -1.6498 -1.6498 1.1728 1.1728 1.8253 1.8253 2.0075 2.0075 2.0772 2.0772 2.1037 2.1037 2.4273 2.4273 3.0626 3.0626 3.0965 3.0965 3.1556 3.1556 3.5002 3.5002 3.5195 3.5195 4.3574 4.3574 4.6994 4.6994 4.7319 4.7319 4.7618 4.7618 4.9718 4.9718 4.9973 4.9973 5.3746 5.3746 5.5876 5.5876 6.1068 6.1068 6.1759 6.1759 6.3118 6.3118 6.5527 6.5527 7.1662 7.1662 7.1923 7.1923 7.4194 7.4194 9.3002 9.3002 9.7387 9.7387 9.7674 9.7674 9.8203 9.8203 k = 0.4833 0.3463-0.0000 ( 5286 PWs) bands (ev): -7.7203 -7.7203 -6.8875 -6.8875 -6.2565 -6.2565 -6.2518 -6.2518 -1.6475 -1.6475 1.1696 1.1696 1.8709 1.8709 1.9632 1.9632 2.0764 2.0764 2.1048 2.1048 2.4309 2.4309 3.0631 3.0631 3.0974 3.0974 3.1598 3.1598 3.5006 3.5006 3.5199 3.5199 4.3519 4.3519 4.6996 4.6996 4.7304 4.7304 4.7629 4.7629 4.9739 4.9739 4.9985 4.9985 5.3818 5.3818 5.5886 5.5886 6.1043 6.1043 6.1736 6.1736 6.3121 6.3121 6.5470 6.5470 7.1643 7.1643 7.1900 7.1900 7.4198 7.4198 9.2992 9.2992 9.7304 9.7304 9.7569 9.7569 9.8236 9.8236 k = 0.5000 0.3583-0.0000 ( 5290 PWs) bands (ev): -7.7185 -7.7185 -6.8899 -6.8899 -6.2565 -6.2565 -6.2518 -6.2518 -1.6467 -1.6467 1.1685 1.1685 1.9146 1.9146 1.9197 1.9197 2.0764 2.0764 2.1051 2.1051 2.4322 2.4322 3.0633 3.0633 3.0977 3.0977 3.1612 3.1612 3.5007 3.5007 3.5201 3.5201 4.3500 4.3500 4.6997 4.6997 4.7299 4.7299 4.7633 4.7633 4.9745 4.9745 4.9989 4.9989 5.3842 5.3842 5.5889 5.5889 6.1034 6.1034 6.1729 6.1729 6.3122 6.3122 6.5450 6.5450 7.1636 7.1636 7.1892 7.1892 7.4200 7.4200 9.2988 9.2988 9.7275 9.7275 9.7534 9.7534 9.8249 9.8249 k = 0.5000 0.3583-0.0000 ( 5290 PWs) bands (ev): -7.7185 -7.7185 -6.8899 -6.8899 -6.2565 -6.2565 -6.2518 -6.2518 -1.6467 -1.6467 1.1685 1.1685 1.9146 1.9146 1.9197 1.9197 2.0764 2.0764 2.1051 2.1051 2.4322 2.4322 3.0633 3.0633 3.0977 3.0977 3.1612 3.1612 3.5007 3.5007 3.5201 3.5201 4.3500 4.3500 4.6997 4.6997 4.7299 4.7299 4.7633 4.7633 4.9745 4.9745 4.9989 4.9989 5.3842 5.3842 5.5889 5.5889 6.1034 6.1034 6.1729 6.1729 6.3122 6.3122 6.5450 6.5450 7.1636 7.1636 7.1892 7.1892 7.4200 7.4200 9.2988 9.2988 9.7275 9.7275 9.7534 9.7534 9.8249 9.8249 k = 0.4916 0.3701 0.0145 ( 5304 PWs) bands (ev): -7.7181 -7.7181 -6.8896 -6.8893 -6.2573 -6.2570 -6.2524 -6.2522 -1.6462 -1.6460 1.1694 1.1698 1.9060 1.9136 1.9150 1.9209 2.0688 2.0852 2.1063 2.1077 2.4333 2.4345 3.0616 3.0641 3.0967 3.0976 3.1588 3.1635 3.4999 3.5002 3.5192 3.5195 4.3491 4.3528 4.6994 4.7002 4.7253 4.7345 4.7440 4.7815 4.9625 4.9756 4.9897 5.0212 5.3804 5.3866 5.5874 5.5907 6.1003 6.1053 6.1718 6.1727 6.3126 6.3140 6.5454 6.5456 7.1616 7.1632 7.1864 7.1905 7.4195 7.4233 9.2981 9.2988 9.7168 9.7359 9.7518 9.7538 9.8241 9.8440 k = 0.4831 0.3818 0.0290 ( 5304 PWs) bands (ev): -7.7169 -7.7168 -6.8884 -6.8878 -6.2600 -6.2597 -6.2534 -6.2527 -1.6444 -1.6440 1.1724 1.1733 1.8835 1.9084 1.9121 1.9153 2.0655 2.0872 2.1096 2.1183 2.4382 2.4404 3.0588 3.0638 3.0948 3.0964 3.1565 3.1658 3.4977 3.4983 3.5168 3.5174 4.3502 4.3576 4.6994 4.7010 4.7201 4.7251 4.7392 4.7984 4.9410 4.9759 4.9929 5.0461 5.3757 5.3880 5.5863 5.5928 6.0959 6.1052 6.1694 6.1719 6.3152 6.3182 6.5469 6.5472 7.1576 7.1589 7.1841 7.1898 7.4222 7.4294 9.2967 9.2981 9.7078 9.7406 9.7483 9.7550 9.8434 9.8749 k = 0.4747 0.3936 0.0435 ( 5308 PWs) bands (ev): -7.7149 -7.7146 -6.8862 -6.8854 -6.2653 -6.2651 -6.2540 -6.2526 -1.6413 -1.6408 1.1776 1.1789 1.8556 1.8855 1.9101 1.9148 2.0632 2.0834 2.1153 2.1327 2.4469 2.4496 3.0550 3.0626 3.0919 3.0940 3.1543 3.1679 3.4943 3.4951 3.5130 3.5139 4.3533 4.3642 4.6992 4.7020 4.7042 4.7172 4.7439 4.8126 4.9200 4.9775 4.9994 5.0710 5.3702 5.3883 5.5854 5.5953 6.0898 6.1021 6.1662 6.1714 6.3200 6.3246 6.5492 6.5497 7.1500 7.1519 7.1838 7.1878 7.4275 7.4373 9.2947 9.2966 9.7036 9.7427 9.7479 9.7576 9.8766 9.9140 k = 0.4662 0.4054 0.0580 ( 5306 PWs) bands (ev): -7.7120 -7.7117 -6.8831 -6.8820 -6.2732 -6.2730 -6.2542 -6.2522 -1.6371 -1.6364 1.1850 1.1867 1.8241 1.8560 1.9077 1.9139 2.0588 2.0766 2.1228 2.1457 2.4597 2.4622 3.0502 3.0604 3.0881 3.0904 3.1524 3.1698 3.4897 3.4905 3.5078 3.5091 4.3583 4.3726 4.6841 4.7002 4.7032 4.7133 4.7487 4.8220 4.9035 4.9805 5.0078 5.0954 5.3642 5.3880 5.5849 5.5980 6.0812 6.0948 6.1628 6.1722 6.3267 6.3332 6.5525 6.5532 7.1382 7.1440 7.1851 7.1856 7.4346 7.4462 9.2920 9.2944 9.7054 9.7451 9.7526 9.7615 9.9187 9.9598 k = 0.4578 0.4172 0.0725 ( 5304 PWs) bands (ev): -7.7083 -7.7080 -6.8792 -6.8778 -6.2833 -6.2832 -6.2542 -6.2517 -1.6318 -1.6310 1.1945 1.1967 1.7905 1.8226 1.9047 1.9125 2.0515 2.0678 2.1302 2.1556 2.4763 2.4782 3.0444 3.0572 3.0834 3.0854 3.1507 3.1714 3.4839 3.4846 3.5013 3.5030 4.3653 4.3826 4.6650 4.6998 4.7045 4.7105 4.7534 4.8228 4.8960 4.9851 5.0175 5.1190 5.3578 5.3870 5.5846 5.6012 6.0693 6.0828 6.1599 6.1744 6.3352 6.3439 6.5566 6.5576 7.1248 7.1344 7.1837 7.1879 7.4427 7.4554 9.2886 9.2914 9.7138 9.7494 9.7626 9.7669 9.9675 10.0114 k = 0.4493 0.4290 0.0870 ( 5300 PWs) bands (ev): -7.7039 -7.7035 -6.8743 -6.8727 -6.2956 -6.2954 -6.2541 -6.2511 -1.6255 -1.6245 1.2061 1.2087 1.7554 1.7869 1.9012 1.9106 2.0419 2.0575 2.1361 2.1617 2.4965 2.4972 3.0375 3.0530 3.0778 3.0792 3.1492 3.1726 3.4771 3.4775 3.4935 3.4958 4.3741 4.3942 4.6465 4.6978 4.7057 4.7096 4.7580 4.8138 4.8990 4.9914 5.0280 5.1415 5.3515 5.3858 5.5847 5.6047 6.0535 6.0663 6.1576 6.1778 6.3453 6.3564 6.5615 6.5628 7.1108 7.1234 7.1830 7.1916 7.4512 7.4643 9.2846 9.2877 9.7279 9.7541 9.7744 9.7801 10.0218 10.0682 k = 0.4409 0.4408 0.1015 ( 5300 PWs) bands (ev): -7.6988 -7.6984 -6.8686 -6.8667 -6.3098 -6.3096 -6.2539 -6.2503 -1.6183 -1.6171 1.2197 1.2227 1.7195 1.7498 1.8970 1.9081 2.0304 2.0458 2.1397 2.1642 2.5189 2.5196 3.0297 3.0477 3.0715 3.0719 3.1478 3.1735 3.4692 3.4695 3.4847 3.4876 4.3846 4.4071 4.6290 4.6944 4.7068 4.7105 4.7622 4.8000 4.9085 4.9992 5.0391 5.1627 5.3456 5.3848 5.5849 5.6084 6.0338 6.0459 6.1560 6.1816 6.3567 6.3705 6.5670 6.5687 7.0970 7.1118 7.1837 7.1965 7.4595 7.4726 9.2800 9.2833 9.7452 9.7592 9.7868 9.8052 10.0810 10.1297 k = 0.4324 0.4526 0.1160 ( 5300 PWs) bands (ev): -7.6931 -7.6926 -6.8620 -6.8598 -6.3258 -6.3256 -6.2535 -6.2495 -1.6104 -1.6091 1.2354 1.2388 1.6830 1.7120 1.8921 1.9047 2.0176 2.0332 2.1408 2.1634 2.5429 2.5448 3.0209 3.0411 3.0634 3.0645 3.1464 3.1740 3.4599 3.4610 3.4748 3.4786 4.3967 4.4210 4.6126 4.6902 4.7075 4.7124 4.7650 4.7863 4.9208 5.0085 5.0505 5.1826 5.3404 5.3844 5.5854 5.6123 6.0105 6.0221 6.1546 6.1852 6.3693 6.3860 6.5730 6.5754 7.0837 7.1000 7.1856 7.2026 7.4676 7.4802 9.2747 9.2781 9.7608 9.7649 9.8086 9.8376 10.1446 10.1956 k = 0.4240 0.4644 0.1305 ( 5299 PWs) bands (ev): -7.6868 -7.6862 -6.8545 -6.8521 -6.3434 -6.3432 -6.2532 -6.2487 -1.6019 -1.6004 1.2531 1.2569 1.6463 1.6737 1.8862 1.9002 2.0044 2.0201 2.1394 2.1597 2.5685 2.5715 3.0109 3.0329 3.0541 3.0572 3.1450 3.1742 3.4496 3.4519 3.4642 3.4690 4.4104 4.4358 4.5975 4.6856 4.7078 4.7147 4.7626 4.7786 4.9345 5.0192 5.0618 5.2011 5.3363 5.3850 5.5860 5.6164 5.9839 5.9954 6.1530 6.1882 6.3829 6.4024 6.5795 6.5826 7.0711 7.0883 7.1890 7.2099 7.4754 7.4870 9.2689 9.2721 9.7711 9.7721 9.8418 9.8767 10.2125 10.2655 k = 0.4155 0.4761 0.1450 ( 5291 PWs) bands (ev): -7.6800 -7.6793 -6.8463 -6.8435 -6.3625 -6.3623 -6.2527 -6.2478 -1.5930 -1.5914 1.2727 1.2768 1.6097 1.6355 1.8791 1.8941 1.9914 2.0072 2.1357 2.1535 2.5952 2.5989 2.9998 3.0229 3.0439 3.0499 3.1436 3.1741 3.4384 3.4422 3.4528 3.4589 4.4254 4.4510 4.5837 4.6807 4.7075 4.7174 4.7539 4.7790 4.9490 5.0314 5.0730 5.2181 5.3335 5.3870 5.5867 5.6206 5.9544 5.9663 6.1507 6.1901 6.3974 6.4196 6.5865 6.5905 7.0595 7.0769 7.1937 7.2184 7.4828 7.4932 9.2624 9.2655 9.7780 9.7811 9.8839 9.9218 10.2844 10.3393 k = 0.4071 0.4879 0.1595 ( 5309 PWs) bands (ev): -7.6728 -7.6721 -6.8372 -6.8342 -6.3827 -6.3825 -6.2522 -6.2468 -1.5838 -1.5821 1.2941 1.2986 1.5733 1.5974 1.8703 1.8857 1.9799 1.9951 2.1299 2.1452 2.6225 2.6265 2.9874 3.0110 3.0332 3.0426 3.1420 3.1736 3.4265 3.4321 3.4408 3.4485 4.4416 4.4663 4.5713 4.6758 4.7063 4.7202 4.7457 4.7813 4.9641 5.0448 5.0838 5.2337 5.3322 5.3904 5.5873 5.6247 5.9224 5.9351 6.1475 6.1908 6.4124 6.4373 6.5936 6.5989 7.0487 7.0658 7.1996 7.2279 7.4900 7.4988 9.2553 9.2581 9.7857 9.7896 9.9325 9.9720 10.3602 10.4168 k = 0.3986 0.4997 0.1740 ( 5311 PWs) bands (ev): -7.6653 -7.6645 -6.8274 -6.8241 -6.4040 -6.4037 -6.2517 -6.2458 -1.5746 -1.5728 1.3172 1.3220 1.5373 1.5598 1.8597 1.8744 1.9706 1.9845 2.1223 2.1352 2.6498 2.6537 2.9736 2.9971 3.0222 3.0356 3.1404 3.1729 3.4141 3.4215 3.4286 3.4379 4.4589 4.4812 4.5603 4.6707 4.7043 4.7232 4.7403 4.7838 4.9796 5.0594 5.0942 5.2478 5.3328 5.3957 5.5879 5.6288 5.8884 5.9024 6.1431 6.1901 6.4280 6.4553 6.6011 6.6078 7.0388 7.0552 7.2065 7.2383 7.4972 7.5043 9.2476 9.2501 9.7942 9.7983 9.9860 10.0263 10.4401 10.4978 k = 0.3902 0.5115 0.1885 ( 5303 PWs) bands (ev): -7.6576 -7.6568 -6.8168 -6.8133 -6.4260 -6.4257 -6.2511 -6.2448 -1.5656 -1.5636 1.3420 1.3470 1.5020 1.5228 1.8469 1.8602 1.9643 1.9761 2.1131 2.1237 2.6768 2.6800 2.9585 2.9814 3.0113 3.0288 3.1386 3.1719 3.4014 3.4106 3.4162 3.4272 4.4770 4.4952 4.5508 4.6656 4.7025 4.7263 4.7378 4.7858 4.9955 5.0750 5.1043 5.2605 5.3354 5.4029 5.5883 5.6329 5.8528 5.8687 6.1375 6.1880 6.4442 6.4734 6.6088 6.6172 7.0296 7.0449 7.2144 7.2493 7.5045 7.5096 9.2393 9.2415 9.8037 9.8075 10.0430 10.0833 10.5241 10.5826 k = 0.3817 0.5233 0.2030 ( 5309 PWs) bands (ev): -7.6499 -7.6491 -6.8055 -6.8018 -6.4484 -6.4481 -6.2505 -6.2438 -1.5568 -1.5547 1.3682 1.3734 1.4674 1.4865 1.8321 1.8433 1.9609 1.9702 2.1025 2.1109 2.7027 2.7048 2.9418 2.9640 3.0006 3.0224 3.1368 3.1707 3.3884 3.3992 3.4041 3.4164 4.4957 4.5077 4.5428 4.6604 4.7017 4.7295 4.7376 4.7875 5.0116 5.0913 5.1140 5.2717 5.3401 5.4120 5.5881 5.6366 5.8160 5.8346 6.1306 6.1845 6.4607 6.4914 6.6165 6.6270 7.0211 7.0349 7.2228 7.2606 7.5120 7.5149 9.2306 9.2323 9.8143 9.8175 10.1021 10.1418 10.6123 10.6709 k = 0.3733 0.5351 0.2175 ( 5299 PWs) bands (ev): -7.6424 -7.6415 -6.7935 -6.7896 -6.4711 -6.4708 -6.2498 -6.2428 -1.5485 -1.5463 1.3955 1.4009 1.4338 1.4513 1.8157 1.8247 1.9602 1.9668 2.0906 2.0970 2.7269 2.7277 2.9236 2.9449 2.9907 3.0166 3.1349 3.1694 3.3756 3.3874 3.3924 3.4057 4.5148 4.5185 4.5364 4.6552 4.7026 4.7329 4.7394 4.7887 5.0278 5.1083 5.1235 5.2815 5.3471 5.4233 5.5872 5.6401 5.7785 5.8008 6.1224 6.1796 6.4778 6.5093 6.6244 6.6371 7.0131 7.0252 7.2314 7.2716 7.5196 7.5203 9.2215 9.2227 9.8260 9.8285 10.1620 10.2004 10.7052 10.7631 k = 0.3649 0.5469 0.2320 ( 5301 PWs) bands (ev): -7.6351 -7.6342 -6.7809 -6.7767 -6.4938 -6.4933 -6.2492 -6.2417 -1.5409 -1.5385 1.4008 1.4146 1.4262 1.4296 1.7984 1.8051 1.9618 1.9660 2.0777 2.0821 2.7478 2.7487 2.9039 2.9244 2.9822 3.0117 3.1329 3.1679 3.3629 3.3752 3.3811 3.3950 4.5271 4.5288 4.5367 4.6501 4.7050 4.7365 4.7433 4.7897 5.0438 5.1255 5.1325 5.2896 5.3563 5.4364 5.5854 5.6431 5.7409 5.7682 6.1130 6.1735 6.4951 6.5269 6.6324 6.6476 7.0058 7.0159 7.2398 7.2819 7.5257 7.5272 9.2120 9.2128 9.8390 9.8408 10.2213 10.2577 10.8026 10.8592 k = 0.3564 0.5587 0.2465 ( 5301 PWs) bands (ev): -7.6282 -7.6273 -6.7677 -6.7632 -6.5160 -6.5155 -6.2485 -6.2407 -1.5341 -1.5317 1.3694 1.3830 1.4534 1.4581 1.7811 1.7857 1.9654 1.9676 2.0639 2.0665 2.7648 2.7672 2.8829 2.9024 2.9757 3.0081 3.1311 3.1664 3.3506 3.3629 3.3702 3.3845 4.5261 4.5337 4.5550 4.6452 4.7081 4.7403 4.7497 4.7906 5.0594 5.1414 5.1427 5.2960 5.3680 5.4515 5.5820 5.6456 5.7037 5.7378 6.1025 6.1662 6.5129 6.5440 6.6403 6.6584 6.9989 7.0070 7.2476 7.2911 7.5312 7.5348 9.2025 9.2028 9.8535 9.8544 10.2786 10.3124 10.9047 10.9591 k = 0.3480 0.5705 0.2610 ( 5309 PWs) bands (ev): -7.6221 -7.6211 -6.7539 -6.7492 -6.5376 -6.5370 -6.2478 -6.2397 -1.5283 -1.5258 1.3391 1.3511 1.4818 1.4861 1.7651 1.7676 1.9710 1.9715 2.0494 2.0501 2.7778 2.7811 2.8607 2.8792 2.9722 3.0063 3.1294 3.1649 3.3389 3.3509 3.3595 3.3740 4.5234 4.5386 4.5743 4.6404 4.7110 4.7442 4.7588 4.7915 5.0743 5.1500 5.1596 5.3001 5.3822 5.4683 5.5767 5.6465 5.6685 5.7109 6.0910 6.1578 6.5309 6.5605 6.6481 6.6694 6.9926 6.9986 7.2544 7.2987 7.5366 7.5421 9.1929 9.1930 9.8693 9.8695 10.3327 10.3635 11.0113 11.0629 k = 0.3395 0.5822 0.2755 ( 5303 PWs) bands (ev): -7.6168 -7.6159 -6.7395 -6.7346 -6.5582 -6.5575 -6.2471 -6.2387 -1.5237 -1.5211 1.3101 1.3206 1.5087 1.5120 1.7522 1.7523 1.9776 1.9781 2.0332 2.0344 2.7865 2.7894 2.8375 2.8548 2.9723 3.0066 3.1280 3.1635 3.3279 3.3394 3.3489 3.3636 4.5217 4.5422 4.5932 4.6362 4.7133 4.7485 4.7705 4.7926 5.0880 5.1587 5.1760 5.3014 5.3988 5.4865 5.5691 5.6297 5.6523 5.6885 6.0786 6.1484 6.5492 6.5765 6.6559 6.6808 6.9871 6.9910 7.2598 7.3043 7.5417 7.5489 9.1833 9.1839 9.8861 9.8867 10.3827 10.4102 11.1221 11.1701 k = 0.3311 0.5940 0.2900 ( 5291 PWs) bands (ev): -7.6126 -7.6117 -6.7247 -6.7196 -6.5774 -6.5766 -6.2465 -6.2378 -1.5203 -1.5176 1.2826 1.2915 1.5319 1.5337 1.7421 1.7447 1.9858 1.9862 2.0160 2.0199 2.7906 2.7908 2.8145 2.8294 2.9763 3.0090 3.1270 3.1622 3.3179 3.3284 3.3384 3.3533 4.5210 4.5450 4.6104 4.6334 4.7148 4.7531 4.7839 4.7943 5.0999 5.1674 5.1917 5.2994 5.4180 5.5051 5.5597 5.5993 5.6522 5.6713 6.0654 6.1382 6.5677 6.5917 6.6637 6.6923 6.9825 6.9842 7.2637 7.3076 7.5462 7.5549 9.1743 9.1753 9.9044 9.9057 10.4277 10.4520 11.2362 11.2801 k = 0.3226 0.6058 0.3045 ( 5301 PWs) bands (ev): -7.6098 -7.6089 -6.7094 -6.7041 -6.5950 -6.5941 -6.2458 -6.2369 -1.5182 -1.5155 1.2567 1.2639 1.5482 1.5484 1.7402 1.7458 1.9896 1.9932 2.0011 2.0114 2.7799 2.7903 2.7975 2.8029 2.9833 3.0132 3.1265 3.1610 3.3090 3.3181 3.3281 3.3431 4.5213 4.5474 4.6197 4.6381 4.7155 4.7580 4.7949 4.7997 5.1094 5.1764 5.2065 5.2930 5.4393 5.5199 5.5499 5.5758 5.6524 5.6589 6.0515 6.1271 6.5863 6.6061 6.6712 6.7039 6.9784 6.9787 7.2655 7.3082 7.5500 7.5599 9.1662 9.1676 9.9243 9.9261 10.4675 10.4886 11.3522 11.3916 k = 0.3142 0.6176 0.3190 ( 5295 PWs) bands (ev): -7.6084 -7.6076 -6.6938 -6.6882 -6.6107 -6.6097 -6.2452 -6.2360 -1.5177 -1.5149 1.2324 1.2381 1.5534 1.5557 1.7494 1.7577 1.9786 1.9787 2.0101 2.0189 2.7564 2.7758 2.7861 2.7880 2.9922 3.0186 3.1267 3.1598 3.3012 3.3085 3.3179 3.3331 4.5224 4.5497 4.6186 4.6528 4.7156 4.7633 4.7979 4.8139 5.1157 5.1860 5.2203 5.2819 5.4625 5.5180 5.5415 5.5737 5.6502 5.6520 6.0369 6.1153 6.6050 6.6194 6.6786 6.7156 6.9741 6.9763 7.2654 7.3059 7.5527 7.5635 9.1591 9.1610 9.9458 9.9480 10.5019 10.5202 11.4681 11.5022 k = 0.3142 0.6176 0.3190 ( 5295 PWs) bands (ev): -7.6084 -7.6076 -6.6938 -6.6882 -6.6107 -6.6097 -6.2452 -6.2360 -1.5177 -1.5149 1.2324 1.2381 1.5534 1.5557 1.7494 1.7577 1.9786 1.9787 2.0101 2.0189 2.7564 2.7758 2.7861 2.7880 2.9922 3.0186 3.1267 3.1598 3.3012 3.3085 3.3179 3.3331 4.5224 4.5497 4.6186 4.6528 4.7156 4.7633 4.7979 4.8139 5.1157 5.1860 5.2203 5.2819 5.4625 5.5180 5.5415 5.5737 5.6502 5.6520 6.0369 6.1153 6.6050 6.6194 6.6786 6.7156 6.9741 6.9763 7.2654 7.3059 7.5527 7.5635 9.1591 9.1610 9.9458 9.9480 10.5019 10.5202 11.4681 11.5022 k = 0.2957 0.6123 0.3255 ( 5307 PWs) bands (ev): -7.6089 -7.6080 -6.6877 -6.6821 -6.6152 -6.6136 -6.2452 -6.2359 -1.5183 -1.5156 1.2221 1.2271 1.5522 1.5551 1.7560 1.7657 1.9696 1.9749 2.0170 2.0264 2.7368 2.7514 2.7897 2.7967 2.9963 3.0211 3.1266 3.1587 3.2940 3.3056 3.3138 3.3307 4.5232 4.5505 4.6173 4.6596 4.7156 4.7652 4.7997 4.8210 5.1169 5.1891 5.2264 5.2770 5.4728 5.5111 5.5392 5.5802 5.6471 5.6518 6.0300 6.1095 6.6136 6.6255 6.6821 6.7208 6.9728 6.9760 7.2637 7.3029 7.5540 7.5652 9.1567 9.1588 9.9570 9.9611 10.5146 10.5319 11.5174 11.5489 k = 0.2772 0.6071 0.3320 ( 5299 PWs) bands (ev): -7.6105 -7.6097 -6.6850 -6.6798 -6.6143 -6.6112 -6.2457 -6.2363 -1.5199 -1.5172 1.2124 1.2167 1.5476 1.5511 1.7630 1.7745 1.9636 1.9729 2.0260 2.0369 2.7107 2.7221 2.7996 2.8088 3.0001 3.0234 3.1257 3.1565 3.2836 3.2993 3.3129 3.3306 4.5242 4.5509 4.6163 4.6653 4.7158 4.7660 4.8028 4.8289 5.1172 5.1894 5.2324 5.2743 5.4822 5.5041 5.5382 5.5888 5.6447 5.6519 6.0226 6.1029 6.6230 6.6326 6.6863 6.7261 6.9724 6.9768 7.2600 7.2976 7.5553 7.5669 9.1551 9.1576 9.9719 9.9791 10.5248 10.5413 11.5622 11.5912 k = 0.2587 0.6018 0.3385 ( 5291 PWs) bands (ev): -7.6131 -7.6123 -6.6866 -6.6819 -6.6067 -6.6024 -6.2468 -6.2373 -1.5224 -1.5197 1.2035 1.2073 1.5395 1.5431 1.7709 1.7841 1.9605 1.9730 2.0371 2.0494 2.6826 2.6915 2.8108 2.8215 3.0033 3.0253 3.1241 3.1534 3.2729 3.2907 3.3138 3.3310 4.5255 4.5511 4.6154 4.6692 4.7163 4.7658 4.8070 4.8371 5.1172 5.1874 5.2378 5.2731 5.4882 5.5008 5.5382 5.5981 5.6431 5.6525 6.0146 6.0954 6.6331 6.6406 6.6913 6.7315 6.9727 6.9785 7.2544 7.2902 7.5559 7.5681 9.1547 9.1575 9.9913 10.0017 10.5328 10.5490 11.6022 11.6288 k = 0.2403 0.5965 0.3450 ( 5296 PWs) bands (ev): -7.6165 -7.6157 -6.6914 -6.6874 -6.5939 -6.5887 -6.2486 -6.2389 -1.5257 -1.5231 1.1956 1.1989 1.5278 1.5316 1.7803 1.7946 1.9599 1.9749 2.0500 2.0636 2.6533 2.6601 2.8227 2.8345 3.0057 3.0266 3.1219 3.1494 3.2623 3.2818 3.3147 3.3314 4.5269 4.5512 4.6145 4.6709 4.7174 4.7649 4.8122 4.8450 5.1175 5.1841 5.2424 5.2725 5.4869 5.5061 5.5393 5.6074 5.6422 5.6537 6.0059 6.0869 6.6437 6.6495 6.6968 6.7369 6.9738 6.9810 7.2471 7.2811 7.5552 7.5679 9.1556 9.1588 10.0151 10.0288 10.5391 10.5554 11.6373 11.6616 k = 0.2218 0.5913 0.3514 ( 5296 PWs) bands (ev): -7.6204 -7.6197 -6.6978 -6.6943 -6.5778 -6.5720 -6.2510 -6.2413 -1.5295 -1.5270 1.1887 1.1917 1.5133 1.5172 1.7912 1.8061 1.9614 1.9780 2.0645 2.0792 2.6231 2.6281 2.8351 2.8479 3.0072 3.0272 3.1190 3.1446 3.2521 3.2731 3.3153 3.3315 4.5285 4.5514 4.6135 4.6704 4.7190 4.7636 4.8181 4.8522 5.1185 5.1804 5.2459 5.2719 5.4842 5.5142 5.5414 5.6163 5.6425 5.6556 5.9963 6.0773 6.6547 6.6595 6.7031 6.7423 6.9758 6.9844 7.2385 7.2706 7.5526 7.5660 9.1578 9.1613 10.0435 10.0602 10.5443 10.5611 11.6678 11.6896 k = 0.2033 0.5860 0.3579 ( 5302 PWs) bands (ev): -7.6247 -7.6240 -6.7048 -6.7018 -6.5597 -6.5534 -6.2543 -6.2445 -1.5339 -1.5315 1.1829 1.1857 1.4966 1.5007 1.8035 1.8185 1.9643 1.9821 2.0801 2.0960 2.5924 2.5958 2.8478 2.8615 3.0078 3.0270 3.1155 3.1390 3.2424 3.2649 3.3157 3.3313 4.5305 4.5518 4.6125 4.6679 4.7209 4.7621 4.8243 4.8583 5.1202 5.1768 5.2483 5.2708 5.4830 5.5223 5.5445 5.6238 5.6448 5.6584 5.9858 6.0665 6.6658 6.6706 6.7098 6.7475 6.9784 6.9885 7.2289 7.2589 7.5477 7.5619 9.1614 9.1653 10.0762 10.0959 10.5486 10.5663 11.6937 11.7128 k = 0.1848 0.5807 0.3644 ( 5300 PWs) bands (ev): -7.6292 -7.6285 -6.7119 -6.7092 -6.5405 -6.5337 -6.2583 -6.2485 -1.5385 -1.5363 1.1783 1.1810 1.4785 1.4830 1.8168 1.8314 1.9684 1.9869 2.0966 2.1135 2.5613 2.5634 2.8609 2.8755 3.0074 3.0259 3.1113 3.1327 3.2337 3.2573 3.3159 3.3309 4.5327 4.5525 4.6113 4.6639 4.7228 4.7604 4.8307 4.8632 5.1227 5.1738 5.2497 5.2692 5.4837 5.5293 5.5492 5.6288 5.6495 5.6626 5.9744 6.0544 6.6769 6.6828 6.7171 6.7525 6.9818 6.9934 7.2186 7.2463 7.5407 7.5555 9.1665 9.1706 10.1130 10.1355 10.5524 10.5711 11.7151 11.7313 k = 0.1663 0.5755 0.3709 ( 5297 PWs) bands (ev): -7.6337 -7.6331 -6.7187 -6.7163 -6.5205 -6.5134 -6.2633 -6.2534 -1.5433 -1.5412 1.1747 1.1775 1.4600 1.4648 1.8308 1.8447 1.9733 1.9921 2.1135 2.1314 2.5297 2.5314 2.8743 2.8897 3.0062 3.0239 3.1061 3.1257 3.2260 3.2504 3.3160 3.3301 4.5352 4.5536 4.6100 4.6587 4.7246 4.7586 4.8367 4.8668 5.1258 5.1715 5.2504 5.2669 5.4863 5.5343 5.5561 5.6316 5.6559 5.6690 5.9621 6.0412 6.6880 6.6957 6.7247 6.7573 6.9859 6.9989 7.2077 7.2331 7.5315 7.5470 9.1728 9.1770 10.1532 10.1783 10.5557 10.5758 11.7320 11.7451 k = 0.1478 0.5702 0.3774 ( 5301 PWs) bands (ev): -7.6380 -7.6375 -6.7250 -6.7230 -6.5004 -6.4928 -6.2692 -6.2592 -1.5481 -1.5462 1.1721 1.1750 1.4416 1.4468 1.8449 1.8579 1.9788 1.9977 2.1305 2.1494 2.4979 2.5004 2.8880 2.9040 3.0044 3.0211 3.1000 3.1182 3.2195 3.2441 3.3159 3.3291 4.5382 4.5552 4.6083 4.6524 4.7263 4.7567 4.8422 4.8693 5.1292 5.1697 5.2504 5.2643 5.4903 5.5374 5.5649 5.6332 5.6620 5.6782 5.9490 6.0267 6.6990 6.7091 6.7325 6.7617 6.9907 7.0049 7.1965 7.2192 7.5207 7.5365 9.1801 9.1843 10.1961 10.2235 10.5587 10.5803 11.7447 11.7550 k = 0.1294 0.5649 0.3839 ( 5300 PWs) bands (ev): -7.6422 -7.6417 -6.7307 -6.7290 -6.4802 -6.4723 -6.2760 -6.2661 -1.5527 -1.5510 1.1704 1.1734 1.4241 1.4294 1.8587 1.8705 1.9850 2.0035 2.1473 2.1671 2.4664 2.4703 2.9019 2.9184 3.0021 3.0176 3.0927 3.1101 3.2145 3.2384 3.3159 3.3280 4.5416 4.5571 4.6064 4.6455 4.7279 4.7548 4.8471 4.8707 5.1330 5.1685 5.2501 5.2616 5.4953 5.5391 5.5748 5.6343 5.6678 5.6895 5.9354 6.0111 6.7095 6.7226 6.7402 6.7659 6.9963 7.0116 7.1850 7.2049 7.5088 7.5245 9.1882 9.1922 10.2407 10.2702 10.5613 10.5844 11.7540 11.7618 k = 0.1109 0.5596 0.3903 ( 5298 PWs) bands (ev): -7.6460 -7.6456 -6.7357 -6.7343 -6.4602 -6.4521 -6.2839 -6.2740 -1.5570 -1.5555 1.1696 1.1726 1.4080 1.4133 1.8718 1.8822 1.9917 2.0095 2.1638 2.1845 2.4356 2.4411 2.9159 2.9328 2.9998 3.0137 3.0844 3.1013 3.2108 3.2332 3.3159 3.3267 4.5455 4.5594 4.6043 4.6381 4.7295 4.7528 4.8513 4.8714 5.1368 5.1675 5.2496 5.2588 5.5010 5.5399 5.5852 5.6351 5.6741 5.7019 5.9216 5.9945 6.7193 6.7359 6.7474 6.7701 7.0027 7.0187 7.1735 7.1904 7.4965 7.5117 9.1965 9.2002 10.2857 10.3169 10.5636 10.5882 11.7606 11.7667 k = 0.0924 0.5544 0.3968 ( 5297 PWs) bands (ev): -7.6493 -7.6490 -6.7401 -6.7388 -6.4407 -6.4323 -6.2928 -6.2829 -1.5609 -1.5596 1.1694 1.1723 1.3936 1.3987 1.8837 1.8925 1.9988 2.0154 2.1800 2.2012 2.4060 2.4131 2.9299 2.9470 2.9975 3.0097 3.0751 3.0920 3.2085 3.2286 3.3160 3.3254 4.5497 4.5619 4.6021 4.6304 4.7312 4.7507 4.8549 4.8714 5.1407 5.1665 5.2491 5.2562 5.5069 5.5399 5.5955 5.6355 5.6813 5.7144 5.9084 5.9771 6.7281 6.7487 6.7533 6.7745 7.0099 7.0261 7.1619 7.1759 7.4846 7.4987 9.2047 9.2080 10.3297 10.3619 10.5654 10.5912 11.7656 11.7706 k = 0.0739 0.5491 0.4033 ( 5297 PWs) bands (ev): -7.6521 -7.6519 -6.7436 -6.7427 -6.4218 -6.4132 -6.3028 -6.2930 -1.5642 -1.5632 1.1697 1.1724 1.3815 1.3860 1.8941 1.9012 2.0062 2.0209 2.1959 2.2173 2.3780 2.3868 2.9437 2.9605 2.9957 3.0057 3.0654 3.0821 3.2074 3.2244 3.3162 3.3240 4.5544 4.5646 4.5997 4.6226 4.7328 4.7487 4.8578 4.8708 5.1444 5.1654 5.2487 5.2539 5.5127 5.5393 5.6051 5.6356 5.6897 5.7257 5.8967 5.9594 6.7359 6.7574 6.7605 6.7791 7.0178 7.0337 7.1506 7.1617 7.4739 7.4862 9.2123 9.2151 10.3711 10.4032 10.5669 10.5932 11.7697 11.7742 k = 0.0554 0.5438 0.4098 ( 5298 PWs) bands (ev): -7.6544 -7.6542 -6.7464 -6.7457 -6.4037 -6.3948 -6.3139 -6.3041 -1.5669 -1.5661 1.1704 1.1726 1.3719 1.3756 1.9025 1.9078 2.0134 2.0255 2.2118 2.2325 2.3521 2.3626 2.9572 2.9728 2.9945 3.0022 3.0556 3.0717 3.2073 3.2206 3.3166 3.3226 4.5592 4.5672 4.5976 4.6150 4.7346 4.7466 4.8604 4.8700 5.1481 5.1640 5.2483 5.2520 5.5180 5.5380 5.6135 5.6351 5.6995 5.7343 5.8882 5.9416 6.7426 6.7595 6.7707 6.7836 7.0265 7.0409 7.1398 7.1483 7.4652 7.4751 9.2188 9.2210 10.4080 10.4380 10.5685 10.5938 11.7737 11.7779 k = 0.0370 0.5386 0.4163 ( 5297 PWs) bands (ev): -7.6560 -7.6559 -6.7484 -6.7479 -6.3864 -6.3774 -6.3260 -6.3164 -1.5688 -1.5683 1.1711 1.1728 1.3651 1.3677 1.9089 1.9124 2.0199 2.0286 2.2276 2.2462 2.3296 2.3408 2.9698 2.9823 2.9945 2.9995 3.0471 3.0612 3.2081 3.2172 3.3172 3.3213 4.5638 4.5695 4.5960 4.6079 4.7364 4.7445 4.8625 4.8688 5.1515 5.1622 5.2482 5.2506 5.5229 5.5362 5.6204 5.6341 5.7104 5.7386 5.8846 5.9244 6.7483 6.7598 6.7789 6.7870 7.0352 7.0468 7.1305 7.1368 7.4591 7.4660 9.2239 9.2254 10.4387 10.4632 10.5712 10.5923 11.7779 11.7814 k = 0.0185 0.5333 0.4227 ( 5294 PWs) bands (ev): -7.6570 -7.6569 -6.7495 -6.7493 -6.3702 -6.3614 -6.3387 -6.3296 -1.5699 -1.5697 1.1719 1.1727 1.3612 1.3625 1.9131 1.9148 2.0252 2.0297 2.2428 2.2556 2.3137 2.3227 2.9804 2.9869 2.9952 2.9982 3.0424 3.0515 3.2096 3.2142 3.3180 3.3200 4.5678 4.5708 4.5957 4.6019 4.7383 4.7424 4.8644 4.8675 5.1547 5.1601 5.2484 5.2495 5.5271 5.5338 5.6257 5.6324 5.7214 5.7373 5.8873 5.9087 6.7529 6.7587 6.7847 6.7887 7.0432 7.0499 7.1245 7.1280 7.4560 7.4596 9.2272 9.2280 10.4615 10.4757 10.5760 10.5884 11.7817 11.7838 k = 0.0000 0.5280 0.4292 ( 5292 PWs) bands (ev): -7.6573 -7.6573 -6.7498 -6.7498 -6.3562 -6.3562 -6.3427 -6.3427 -1.5702 -1.5702 1.1724 1.1724 1.3603 1.3603 1.9150 1.9150 2.0286 2.0286 2.2544 2.2544 2.3113 2.3113 2.9865 2.9865 2.9966 2.9966 3.0442 3.0442 3.2116 3.2116 3.3190 3.3190 4.5703 4.5703 4.5976 4.5976 4.7403 4.7403 4.8660 4.8660 5.1576 5.1576 5.2488 5.2488 5.5308 5.5308 5.6297 5.6297 5.7310 5.7310 5.8958 5.8958 6.7564 6.7564 6.7880 6.7880 7.0486 7.0486 7.1235 7.1235 7.4561 7.4561 9.2286 9.2286 10.4745 10.4745 10.5824 10.5824 11.7840 11.7840 k = 0.0000 0.5280 0.4292 ( 5292 PWs) bands (ev): -7.6573 -7.6573 -6.7498 -6.7498 -6.3562 -6.3562 -6.3427 -6.3427 -1.5702 -1.5702 1.1724 1.1724 1.3603 1.3603 1.9150 1.9150 2.0286 2.0286 2.2544 2.2544 2.3113 2.3113 2.9865 2.9865 2.9966 2.9966 3.0442 3.0442 3.2116 3.2116 3.3190 3.3190 4.5703 4.5703 4.5976 4.5976 4.7403 4.7403 4.8660 4.8660 5.1576 5.1576 5.2488 5.2488 5.5308 5.5308 5.6297 5.6297 5.7310 5.7310 5.8958 5.8958 6.7564 6.7564 6.7880 6.7880 7.0486 7.0486 7.1235 7.1235 7.4561 7.4561 9.2286 9.2286 10.4745 10.4745 10.5824 10.5824 11.7840 11.7840 k = 0.0083 0.5164 0.4435 ( 5296 PWs) bands (ev): -7.6569 -7.6569 -6.7495 -6.7494 -6.3566 -6.3566 -6.3430 -6.3429 -1.5707 -1.5705 1.1716 1.1718 1.3572 1.3575 1.9044 1.9062 2.0299 2.0377 2.2556 2.2556 2.3152 2.3221 2.9860 2.9865 2.9967 2.9971 3.0439 3.0445 3.2112 3.2118 3.3186 3.3193 4.5681 4.5732 4.5926 4.6032 4.7387 4.7423 4.8643 4.8677 5.1575 5.1585 5.2471 5.2501 5.5201 5.5368 5.6288 5.6303 5.7197 5.7476 5.8930 5.9008 6.7474 6.7616 6.7830 6.7983 7.0492 7.0494 7.1241 7.1245 7.4550 7.4553 9.2260 9.2268 10.4740 10.4761 10.5830 10.5834 11.7808 11.7809 k = 0.0167 0.5048 0.4578 ( 5292 PWs) bands (ev): -7.6558 -7.6557 -6.7486 -6.7483 -6.3579 -6.3579 -6.3438 -6.3435 -1.5719 -1.5715 1.1692 1.1697 1.3482 1.3488 1.8789 1.8807 2.0408 2.0532 2.2589 2.2590 2.3327 2.3455 2.9850 2.9861 2.9974 2.9982 3.0438 3.0449 3.2105 3.2116 3.3184 3.3198 4.5664 4.5766 4.5881 4.6091 4.7375 4.7445 4.8627 4.8696 5.1582 5.1603 5.2453 5.2511 5.5066 5.5376 5.6282 5.6285 5.7171 5.7671 5.8928 5.9077 6.7381 6.7578 6.7888 6.8105 7.0512 7.0518 7.1262 7.1271 7.4519 7.4526 9.2190 9.2206 10.4743 10.4785 10.5853 10.5862 11.7713 11.7715 k = 0.0250 0.4931 0.4721 ( 5292 PWs) bands (ev): -7.6539 -7.6537 -6.7471 -6.7466 -6.3602 -6.3601 -6.3450 -6.3446 -1.5738 -1.5733 1.1654 1.1661 1.3340 1.3349 1.8440 1.8447 2.0577 2.0721 2.2645 2.2647 2.3611 2.3781 2.9835 2.9854 2.9988 2.9996 3.0438 3.0455 3.2095 3.2112 3.3182 3.3203 4.5654 4.5797 4.5849 4.6155 4.7367 4.7470 4.8611 4.8715 5.1597 5.1628 5.2431 5.2517 5.4923 5.5341 5.6220 5.6270 5.7250 5.7881 5.8954 5.9159 6.7294 6.7502 6.7999 6.8233 7.0546 7.0560 7.1300 7.1313 7.4468 7.4478 9.2080 9.2104 10.4756 10.4819 10.5893 10.5906 11.7555 11.7559 k = 0.0333 0.4815 0.4865 ( 5288 PWs) bands (ev): -7.6512 -7.6510 -6.7449 -6.7443 -6.3633 -6.3632 -6.3467 -6.3460 -1.5764 -1.5758 1.1602 1.1610 1.3152 1.3165 1.8030 1.8032 2.0785 2.0936 2.2721 2.2727 2.3968 2.4169 2.9816 2.9844 3.0006 3.0014 3.0439 3.0461 3.2082 3.2105 3.3181 3.3208 4.5649 4.5788 4.5870 4.6223 4.7363 4.7498 4.8594 4.8735 5.1618 5.1660 5.2407 5.2518 5.4785 5.5276 5.6117 5.6248 5.7413 5.8095 5.9010 5.9252 6.7213 6.7427 6.8127 6.8366 7.0596 7.0623 7.1353 7.1371 7.4399 7.4411 9.1932 9.1962 10.4777 10.4862 10.5949 10.5966 11.7335 11.7342 k = 0.0417 0.4699 0.5008 ( 5288 PWs) bands (ev): -7.6478 -7.6476 -6.7421 -6.7413 -6.3673 -6.3671 -6.3487 -6.3479 -1.5796 -1.5789 1.1535 1.1546 1.2926 1.2943 1.7579 1.7586 2.1024 2.1177 2.2820 2.2827 2.4372 2.4594 2.9796 2.9832 3.0029 3.0036 3.0441 3.0469 3.2067 3.2096 3.3180 3.3213 4.5649 4.5760 4.5921 4.6294 4.7362 4.7527 4.8576 4.8755 5.1644 5.1693 5.2378 5.2515 5.4664 5.5197 5.5998 5.6213 5.7630 5.8302 5.9099 5.9350 6.7140 6.7360 6.8261 6.8498 7.0665 7.0711 7.1422 7.1444 7.4310 7.4323 9.1752 9.1788 10.4805 10.4913 10.6019 10.6041 11.7055 11.7067 k = 0.0500 0.4583 0.5151 ( 5286 PWs) bands (ev): -7.6436 -7.6434 -6.7387 -6.7377 -6.3722 -6.3720 -6.3512 -6.3502 -1.5835 -1.5826 1.1455 1.1468 1.2672 1.2693 1.7108 1.7118 2.1285 2.1438 2.2938 2.2948 2.4801 2.5038 2.9773 2.9816 3.0055 3.0060 3.0444 3.0477 3.2049 3.2085 3.3180 3.3217 4.5655 4.5734 4.5981 4.6369 4.7365 4.7559 4.8558 4.8777 5.1673 5.1722 5.2345 5.2510 5.4567 5.5114 5.5876 5.6165 5.7878 5.8491 5.9225 5.9451 6.7074 6.7304 6.8397 6.8627 7.0754 7.0826 7.1507 7.1533 7.4203 7.4216 9.1544 9.1584 10.4841 10.4973 10.6105 10.6130 11.6718 11.6738 k = 0.0583 0.4466 0.5294 ( 5286 PWs) bands (ev): -7.6388 -7.6385 -6.7346 -6.7335 -6.3780 -6.3777 -6.3540 -6.3528 -1.5879 -1.5868 1.1362 1.1377 1.2396 1.2422 1.6628 1.6637 2.1565 2.1717 2.3077 2.3089 2.5243 2.5491 2.9749 2.9799 3.0083 3.0088 3.0449 3.0486 3.2030 3.2072 3.3180 3.3221 4.5664 4.5713 4.6047 4.6447 4.7372 4.7591 4.8540 4.8797 5.1703 5.1736 5.2306 5.2512 5.4500 5.5036 5.5761 5.6106 5.8143 5.8652 5.9390 5.9551 6.7017 6.7259 6.8533 6.8753 7.0867 7.0970 7.1607 7.1635 7.4079 7.4089 9.1314 9.1357 10.4884 10.5039 10.6203 10.6232 11.6328 11.6358 k = 0.0667 0.4350 0.5437 ( 5288 PWs) bands (ev): -7.6333 -7.6330 -6.7300 -6.7287 -6.3846 -6.3842 -6.3572 -6.3558 -1.5927 -1.5916 1.1256 1.1275 1.2107 1.2137 1.6145 1.6150 2.1858 2.2008 2.3234 2.3248 2.5687 2.5944 2.9726 2.9779 3.0114 3.0119 3.0455 3.0496 3.2009 3.2059 3.3179 3.3223 4.5678 4.5698 4.6119 4.6529 4.7383 4.7624 4.8521 4.8817 5.1723 5.1729 5.2265 5.2529 5.4465 5.4968 5.5656 5.6039 5.8416 5.8779 5.9592 5.9649 6.6967 6.7226 6.8668 6.8874 7.1005 7.1145 7.1722 7.1752 7.3937 7.3942 9.1067 9.1112 10.4931 10.5113 10.6313 10.6346 11.5891 11.5933 k = 0.0750 0.4234 0.5580 ( 5286 PWs) bands (ev): -7.6272 -7.6269 -6.7248 -6.7233 -6.3919 -6.3914 -6.3608 -6.3592 -1.5979 -1.5967 1.1139 1.1161 1.1811 1.1843 1.5661 1.5662 2.2160 2.2309 2.3407 2.3423 2.6128 2.6390 2.9702 2.9758 3.0147 3.0153 3.0462 3.0506 3.1987 3.2044 3.3178 3.3224 4.5687 4.5696 4.6196 4.6614 4.7396 4.7657 4.8502 4.8836 5.1676 5.1743 5.2227 5.2571 5.4461 5.4912 5.5566 5.5965 5.8690 5.8877 5.9745 5.9821 6.6924 6.7204 6.8800 6.8993 7.1170 7.1348 7.1854 7.1882 7.3778 7.3781 9.0807 9.0853 10.4984 10.5193 10.6433 10.6470 11.5413 11.5470 k = 0.0833 0.4117 0.5723 ( 5282 PWs) bands (ev): -7.6205 -7.6202 -6.7190 -6.7174 -6.4000 -6.3994 -6.3647 -6.3630 -1.6035 -1.6022 1.1010 1.1037 1.1514 1.1547 1.5177 1.5182 2.2468 2.2614 2.3597 2.3614 2.6558 2.6825 2.9680 2.9736 3.0180 3.0188 3.0471 3.0517 3.1966 3.2030 3.3176 3.3222 4.5683 4.5716 4.6276 4.6702 4.7414 4.7690 4.8484 4.8853 5.1595 5.1733 5.2201 5.2638 5.4486 5.4869 5.5495 5.5889 5.8948 5.8954 5.9843 6.0067 6.6890 6.7193 6.8932 6.9111 7.1359 7.1576 7.2001 7.2022 7.3596 7.3613 9.0541 9.0586 10.5040 10.5277 10.6561 10.6602 11.4901 11.4975 k = 0.0917 0.4001 0.5866 ( 5288 PWs) bands (ev): -7.6134 -7.6129 -6.7127 -6.7110 -6.4086 -6.4080 -6.3691 -6.3671 -1.6093 -1.6079 1.0867 1.0904 1.1224 1.1254 1.4698 1.4710 2.2778 2.2922 2.3799 2.3817 2.6975 2.7243 2.9660 2.9714 3.0214 3.0225 3.0481 3.0529 3.1945 3.2016 3.3172 3.3218 4.5684 4.5738 4.6360 4.6790 4.7434 4.7723 4.8468 4.8867 5.1485 5.1690 5.2198 5.2724 5.4534 5.4839 5.5446 5.5813 5.8996 5.9192 5.9952 6.0322 6.6864 6.7190 6.9065 6.9232 7.1568 7.1820 7.2166 7.2169 7.3400 7.3441 9.0270 9.0314 10.5098 10.5366 10.6697 10.6741 11.4363 11.4457 k = 0.1000 0.3885 0.6009 ( 5290 PWs) bands (ev): -7.6057 -7.6053 -6.7059 -6.7041 -6.4178 -6.4172 -6.3738 -6.3717 -1.6152 -1.6138 1.0705 1.0761 1.0951 1.0968 1.4228 1.4246 2.3087 2.3229 2.4013 2.4032 2.7373 2.7641 2.9643 2.9693 3.0248 3.0264 3.0492 3.0541 3.1927 3.2004 3.3165 3.3211 4.5691 4.5764 4.6446 4.6879 4.7460 4.7754 4.8454 4.8879 5.1355 5.1610 5.2218 5.2823 5.4604 5.4817 5.5422 5.5742 5.9023 5.9383 6.0090 6.0581 6.6845 6.7195 6.9204 6.9359 7.1790 7.2070 7.2313 7.2353 7.3195 7.3279 8.9998 9.0039 10.5158 10.5458 10.6836 10.6886 11.3807 11.3924 k = 0.1083 0.3768 0.6152 ( 5284 PWs) bands (ev): -7.5976 -7.5972 -6.6987 -6.6967 -6.4275 -6.4268 -6.3789 -6.3766 -1.6212 -1.6198 1.0508 1.0597 1.0706 1.0718 1.3768 1.3792 2.3395 2.3534 2.4235 2.4254 2.7750 2.8015 2.9631 2.9674 3.0281 3.0303 3.0505 3.0553 3.1913 3.1996 3.3157 3.3201 4.5704 4.5792 4.6534 4.6966 4.7491 4.7785 4.8443 4.8889 5.1213 5.1504 5.2251 5.2926 5.4689 5.4805 5.5425 5.5678 5.9030 5.9508 6.0273 6.0839 6.6834 6.7205 6.9352 6.9496 7.2007 7.2301 7.2435 7.2563 7.2998 7.3160 8.9728 8.9766 10.5217 10.5552 10.6977 10.7032 11.3241 11.3383 k = 0.1167 0.3652 0.6295 ( 5290 PWs) bands (ev): -7.5893 -7.5888 -6.6910 -6.6888 -6.4376 -6.4368 -6.3843 -6.3819 -1.6273 -1.6258 1.0273 1.0376 1.0509 1.0529 1.3320 1.3351 2.3697 2.3834 2.4464 2.4482 2.8101 2.8361 2.9622 2.9657 3.0313 3.0343 3.0519 3.0565 3.1905 3.1991 3.3145 3.3188 4.5722 4.5822 4.6622 4.7046 4.7529 4.7813 4.8437 4.8897 5.1063 5.1377 5.2289 5.3025 5.4786 5.4802 5.5453 5.5628 5.9017 5.9570 6.0496 6.1093 6.6829 6.7217 6.9513 6.9644 7.2161 7.2453 7.2528 7.2732 7.2930 7.3147 8.9462 8.9496 10.5273 10.5645 10.7118 10.7179 11.2674 11.2842 k = 0.1250 0.3536 0.6438 ( 5300 PWs) bands (ev): -7.5806 -7.5802 -6.6828 -6.6806 -6.4479 -6.4471 -6.3902 -6.3876 -1.6333 -1.6318 1.0028 1.0128 1.0350 1.0364 1.2886 1.2923 2.3993 2.4127 2.4695 2.4714 2.8425 2.8676 2.9620 2.9644 3.0343 3.0383 3.0533 3.0577 3.1904 3.1992 3.3130 3.3170 4.5745 4.5854 4.6708 4.7116 4.7579 4.7839 4.8437 4.8904 5.0909 5.1238 5.2324 5.3113 5.4811 5.4891 5.5504 5.5596 5.8987 5.9584 6.0740 6.1340 6.6829 6.7229 6.9688 6.9804 7.2136 7.2363 7.2686 7.2856 7.3156 7.3258 8.9200 8.9229 10.5325 10.5736 10.7256 10.7324 11.2112 11.2309 k = 0.1333 0.3420 0.6581 ( 5292 PWs) bands (ev): -7.5718 -7.5713 -6.6743 -6.6719 -6.4584 -6.4576 -6.3964 -6.3937 -1.6391 -1.6376 0.9789 0.9888 1.0198 1.0207 1.2467 1.2510 2.4282 2.4412 2.4928 2.4945 2.8717 2.8955 2.9626 2.9637 3.0372 3.0423 3.0549 3.0589 3.1913 3.2001 3.3112 3.3149 4.5775 4.5890 4.6792 4.7172 4.7642 4.7863 4.8445 4.8910 5.0756 5.1091 5.2351 5.3183 5.4836 5.5000 5.5573 5.5589 5.8940 5.9564 6.0992 6.1578 6.6836 6.7240 6.9878 6.9978 7.1980 7.2149 7.2908 7.3051 7.3439 7.3444 8.8943 8.8968 10.5370 10.5822 10.7388 10.7465 11.1564 11.1791 k = 0.1417 0.3303 0.6725 ( 5290 PWs) bands (ev): -7.5630 -7.5625 -6.6655 -6.6630 -6.4689 -6.4681 -6.4029 -6.4001 -1.6448 -1.6433 0.9563 0.9664 1.0050 1.0056 1.2064 1.2113 2.4561 2.4688 2.5157 2.5172 2.8976 2.9194 2.9635 2.9642 3.0399 3.0463 3.0565 3.0600 3.1935 3.2019 3.3089 3.3124 4.5810 4.5927 4.6870 4.7210 4.7719 4.7885 4.8460 4.8916 5.0604 5.0938 5.2366 5.3229 5.4879 5.5112 5.5610 5.5657 5.8878 5.9518 6.1242 6.1805 6.6846 6.7248 7.0081 7.0163 7.1781 7.1916 7.3146 7.3263 7.3662 7.3729 8.8693 8.8713 10.5406 10.5899 10.7511 10.7599 11.1040 11.1297 k = 0.1500 0.3187 0.6868 ( 5294 PWs) bands (ev): -7.5541 -7.5536 -6.6563 -6.6537 -6.4794 -6.4787 -6.4098 -6.4069 -1.6502 -1.6488 0.9355 0.9457 0.9905 0.9910 1.1679 1.1733 2.4830 2.4953 2.5381 2.5394 2.9198 2.9388 2.9640 2.9673 3.0423 3.0502 3.0581 3.0610 3.1971 3.2048 3.3062 3.3094 4.5851 4.5967 4.6939 4.7232 4.7808 4.7909 4.8484 4.8923 5.0457 5.0784 5.2369 5.3247 5.4940 5.5225 5.5660 5.5750 5.8804 5.9451 6.1485 6.2018 6.6860 6.7253 7.0289 7.0350 7.1576 7.1690 7.3384 7.3481 7.3895 7.4010 8.8450 8.8465 10.5429 10.5963 10.7624 10.7723 11.0546 11.0832 k = 0.1583 0.3071 0.7011 ( 5296 PWs) bands (ev): -7.5454 -7.5449 -6.6470 -6.6442 -6.4897 -6.4890 -6.4170 -6.4140 -1.6554 -1.6540 0.9167 0.9270 0.9766 0.9770 1.1313 1.1372 2.5086 2.5206 2.5596 2.5606 2.9382 2.9527 2.9655 2.9726 3.0445 3.0540 3.0597 3.0619 3.2021 3.2088 3.3031 3.3059 4.5897 4.6010 4.6996 4.7239 4.7906 4.7938 4.8514 4.8931 5.0315 5.0629 5.2359 5.3235 5.5021 5.5341 5.5736 5.5849 5.8720 5.9367 6.1717 6.2217 6.6876 6.7253 7.0481 7.0522 7.1399 7.1495 7.3618 7.3700 7.4129 7.4278 8.8214 8.8225 10.5439 10.6010 10.7722 10.7838 11.0094 11.0402 k = 0.1667 0.2954 0.7154 ( 5296 PWs) bands (ev): -7.5369 -7.5364 -6.6374 -6.6346 -6.4997 -6.4990 -6.4245 -6.4214 -1.6602 -1.6589 0.8999 0.9104 0.9633 0.9638 1.0967 1.1030 2.5329 2.5445 2.5800 2.5806 2.9524 2.9613 2.9685 2.9803 3.0464 3.0576 3.0614 3.0627 3.2085 3.2140 3.2995 3.3021 4.5949 4.6055 4.7037 4.7233 4.7974 4.8008 4.8551 4.8940 5.0180 5.0475 5.2339 5.3196 5.5118 5.5462 5.5829 5.5951 5.8628 5.9269 6.1935 6.2399 6.6894 6.7250 7.0599 7.0629 7.1311 7.1383 7.3844 7.3918 7.4357 7.4525 8.7987 8.7994 10.5434 10.6034 10.7805 10.7940 10.9692 11.0014 k = 0.1750 0.2838 0.7297 ( 5294 PWs) bands (ev): -7.5287 -7.5283 -6.6276 -6.6247 -6.5093 -6.5087 -6.4322 -6.4291 -1.6646 -1.6634 0.8854 0.8960 0.9508 0.9513 1.0641 1.0709 2.5556 2.5668 2.5990 2.5992 2.9618 2.9673 2.9736 2.9878 3.0480 3.0605 3.0630 3.0638 3.2159 3.2201 3.2956 3.2980 4.6005 4.6104 4.7059 4.7215 4.8023 4.8113 4.8593 4.8950 5.0051 5.0324 5.2312 5.3135 5.5229 5.5589 5.5933 5.6053 5.8531 5.9160 6.2138 6.2562 6.6913 6.7244 7.0569 7.0604 7.1388 7.1422 7.4060 7.4131 7.4572 7.4749 8.7770 8.7773 10.5412 10.6028 10.7870 10.8028 10.9351 10.9671 k = 0.1833 0.2722 0.7440 ( 5294 PWs) bands (ev): -7.5210 -7.5206 -6.6178 -6.6149 -6.5183 -6.5177 -6.4402 -6.4371 -1.6686 -1.6676 0.8732 0.8839 0.9392 0.9398 1.0338 1.0409 2.5766 2.5874 2.6161 2.6165 2.9677 2.9725 2.9801 2.9937 3.0494 3.0617 3.0649 3.0661 3.2240 3.2269 3.2914 3.2935 4.6067 4.6155 4.7063 4.7186 4.8084 4.8218 4.8639 4.8961 4.9931 5.0176 5.2281 5.3055 5.5351 5.5719 5.6039 5.6152 5.8431 5.9042 6.2324 6.2707 6.6933 6.7234 7.0436 7.0475 7.1581 7.1581 7.4263 7.4337 7.4771 7.4945 8.7564 8.7564 10.5376 10.5988 10.7917 10.8103 10.9078 10.9375 k = 0.1917 0.2605 0.7583 ( 5290 PWs) bands (ev): -7.5139 -7.5135 -6.6080 -6.6050 -6.5267 -6.5261 -6.4483 -6.4452 -1.6722 -1.6713 0.8633 0.8741 0.9286 0.9294 1.0058 1.0131 2.5957 2.6061 2.6313 2.6322 2.9723 2.9775 2.9858 2.9977 3.0506 3.0619 3.0668 3.0693 3.2322 3.2340 3.2869 3.2888 4.6133 4.6210 4.7049 4.7147 4.8158 4.8321 4.8686 4.8971 4.9818 5.0033 5.2251 5.2963 5.5480 5.5850 5.6143 5.6245 5.8334 5.8917 6.2491 6.2831 6.6953 6.7222 7.0277 7.0314 7.1790 7.1814 7.4450 7.4530 7.4949 7.5112 8.7370 8.7373 10.5327 10.5913 10.7947 10.8163 10.8876 10.9127 k = 0.2000 0.2489 0.7726 ( 5294 PWs) bands (ev): -7.5074 -7.5070 -6.5982 -6.5953 -6.5342 -6.5337 -6.4565 -6.4534 -1.6754 -1.6745 0.8559 0.8667 0.9191 0.9202 0.9802 0.9876 2.6126 2.6225 2.6447 2.6461 2.9768 2.9824 2.9899 2.9999 3.0517 3.0616 3.0690 3.0724 3.2401 3.2410 3.2824 3.2841 4.6203 4.6267 4.7019 4.7099 4.8241 4.8420 4.8734 4.8980 4.9713 4.9896 5.2226 5.2863 5.5613 5.5976 5.6240 5.6330 5.8242 5.8788 6.2640 6.2935 6.6974 6.7208 7.0120 7.0153 7.2011 7.2053 7.4618 7.4705 7.5106 7.5250 8.7192 8.7197 10.5273 10.5809 10.7965 10.8207 10.8738 10.8924 k = 0.2083 0.2373 0.7869 ( 5298 PWs) bands (ev): -7.5017 -7.5014 -6.5888 -6.5858 -6.5407 -6.5404 -6.4646 -6.4616 -1.6781 -1.6774 0.8510 0.8616 0.9109 0.9122 0.9572 0.9646 2.6273 2.6363 2.6563 2.6582 2.9813 2.9870 2.9928 3.0008 3.0527 3.0611 3.0713 3.0752 3.2473 3.2476 3.2780 3.2795 4.6277 4.6328 4.6976 4.7042 4.8333 4.8514 4.8782 4.8986 4.9615 4.9764 5.2208 5.2761 5.5746 5.6093 5.6326 5.6404 5.8161 5.8659 6.2770 6.3018 6.6994 6.7192 6.9978 7.0006 7.2226 7.2279 7.4764 7.4858 7.5241 7.5358 8.7035 8.7040 10.5218 10.5686 10.7977 10.8235 10.8650 10.8767 k = 0.2167 0.2257 0.8012 ( 5296 PWs) bands (ev): -7.4969 -7.4967 -6.5797 -6.5769 -6.5462 -6.5460 -6.4724 -6.4696 -1.6803 -1.6797 0.8484 0.8588 0.9038 0.9056 0.9371 0.9441 2.6395 2.6474 2.6663 2.6683 2.9857 2.9910 2.9945 3.0007 3.0536 3.0605 3.0737 3.0778 3.2535 3.2535 3.2739 3.2751 4.6354 4.6391 4.6924 4.6979 4.8428 4.8599 4.8828 4.8989 4.9527 4.9640 5.2202 5.2659 5.5877 5.6194 5.6398 5.6466 5.8096 5.8531 6.2880 6.3080 6.7015 6.7174 6.9857 6.9880 7.2425 7.2482 7.4885 7.4983 7.5354 7.5441 8.6901 8.6906 10.5170 10.5555 10.7991 10.8242 10.8597 10.8653 k = 0.2250 0.2140 0.8155 ( 5300 PWs) bands (ev): -7.4931 -7.4929 -6.5715 -6.5689 -6.5505 -6.5504 -6.4796 -6.4771 -1.6820 -1.6815 0.8482 0.8580 0.8978 0.9004 0.9203 0.9264 2.6493 2.6555 2.6745 2.6763 2.9896 2.9941 2.9956 3.0001 3.0546 3.0597 3.0761 3.0797 3.2583 3.2585 3.2703 3.2714 4.6433 4.6457 4.6865 4.6910 4.8523 4.8673 4.8871 4.8988 4.9448 4.9527 5.2210 5.2561 5.6000 5.6270 5.6455 5.6512 5.8056 5.8408 6.2971 6.3122 6.7036 6.7156 6.9761 6.9779 7.2596 7.2649 7.4983 7.5074 7.5445 7.5502 8.6793 8.6797 10.5136 10.5430 10.8009 10.8227 10.8566 10.8582 k = 0.2333 0.2024 0.8298 ( 5294 PWs) bands (ev): -7.4902 -7.4901 -6.5646 -6.5625 -6.5535 -6.5534 -6.4856 -6.4836 -1.6832 -1.6829 0.8501 0.8585 0.8929 0.8965 0.9078 0.9118 2.6565 2.6608 2.6808 2.6821 2.9930 2.9961 2.9963 2.9992 3.0555 3.0589 3.0784 3.0811 3.2620 3.2621 3.2676 3.2684 4.6514 4.6525 4.6800 4.6836 4.8613 4.8728 4.8910 4.8983 4.9383 4.9431 5.2232 5.2471 5.6111 5.6313 5.6498 5.6543 5.8044 5.8294 6.3043 6.3145 6.7056 6.7137 6.9693 6.9704 7.2730 7.2771 7.5058 7.5130 7.5512 7.5545 8.6714 8.6717 10.5121 10.5319 10.8035 10.8193 10.8545 10.8547 k = 0.2417 0.1908 0.8441 ( 5292 PWs) bands (ev): -7.4885 -7.4885 -6.5601 -6.5590 -6.5546 -6.5546 -6.4895 -6.4884 -1.6839 -1.6837 0.8535 0.8589 0.8896 0.8935 0.9004 0.9016 2.6612 2.6635 2.6848 2.6855 2.9955 2.9967 2.9971 2.9983 3.0564 3.0581 3.0802 3.0816 3.2642 3.2643 3.2659 3.2665 4.6592 4.6597 4.6732 4.6758 4.8689 4.8754 4.8943 4.8976 4.9339 4.9361 5.2270 5.2391 5.6206 5.6314 5.6531 5.6556 5.8065 5.8196 6.3097 6.3147 6.7077 6.7117 6.9652 6.9657 7.2821 7.2843 7.5111 7.5152 7.5555 7.5569 8.6666 8.6667 10.5131 10.5230 10.8068 10.8151 10.8532 10.8535 k = 0.2500 0.1791 0.8585 ( 5284 PWs) bands (ev): -7.4879 -7.4879 -6.5587 -6.5587 -6.5544 -6.5544 -6.4906 -6.4906 -1.6841 -1.6841 0.8571 0.8571 0.8902 0.8902 0.8981 0.8981 2.6636 2.6636 2.6864 2.6864 2.9970 2.9970 2.9973 2.9974 3.0573 3.0573 3.0813 3.0813 3.2650 3.2650 3.2657 3.2657 4.6661 4.6661 4.6680 4.6680 4.8740 4.8740 4.8965 4.8965 4.9329 4.9329 5.2324 5.2324 5.6276 5.6276 5.6551 5.6551 5.8117 5.8117 6.3131 6.3131 6.7097 6.7097 6.9640 6.9640 7.2860 7.2860 7.5144 7.5144 7.5573 7.5573 8.6650 8.6650 10.5167 10.5167 10.8107 10.8107 10.8530 10.8530 k = 0.2500 0.1791 0.8585 ( 5284 PWs) bands (ev): -7.4879 -7.4879 -6.5587 -6.5587 -6.5544 -6.5544 -6.4906 -6.4906 -1.6841 -1.6841 0.8571 0.8571 0.8902 0.8902 0.8981 0.8981 2.6636 2.6636 2.6864 2.6864 2.9970 2.9970 2.9973 2.9974 3.0573 3.0573 3.0813 3.0813 3.2650 3.2650 3.2657 3.2657 4.6661 4.6661 4.6680 4.6680 4.8740 4.8740 4.8965 4.8965 4.9329 4.9329 5.2324 5.2324 5.6276 5.6276 5.6551 5.6551 5.8117 5.8117 6.3131 6.3131 6.7097 6.7097 6.9640 6.9640 7.2860 7.2860 7.5144 7.5144 7.5573 7.5573 8.6650 8.6650 10.5167 10.5167 10.8107 10.8107 10.8530 10.8530 k = 0.2632 0.1886 0.8469 ( 5294 PWs) bands (ev): -7.4881 -7.4881 -6.5594 -6.5591 -6.5542 -6.5542 -6.4904 -6.4898 -1.6841 -1.6840 0.8475 0.8537 0.8652 0.8712 0.9294 0.9296 2.6403 2.6413 2.7065 2.7072 2.9732 2.9733 3.0201 3.0204 3.0569 3.0577 3.0809 3.0818 3.2644 3.2651 3.2658 3.2660 4.6611 4.6662 4.6663 4.6744 4.8706 4.8753 4.8949 4.8978 4.9330 4.9341 5.2291 5.2362 5.6110 5.6188 5.6672 5.6682 5.8088 5.8155 6.3117 6.3145 6.7072 6.7096 6.9665 6.9668 7.2843 7.2856 7.5127 7.5147 7.5573 7.5577 8.6637 8.6638 10.5145 10.5209 10.7596 10.7652 10.9017 10.9018 k = 0.2763 0.1980 0.8353 ( 5302 PWs) bands (ev): -7.4886 -7.4886 -6.5604 -6.5601 -6.5543 -6.5541 -6.4892 -6.4882 -1.6840 -1.6838 0.8203 0.8249 0.8653 0.8693 0.9669 0.9673 2.6067 2.6085 2.7319 2.7337 2.9487 2.9492 3.0415 3.0415 3.0572 3.0583 3.0806 3.0826 3.2636 3.2651 3.2662 3.2666 4.6551 4.6656 4.6659 4.6812 4.8654 4.8753 4.8921 4.8989 4.9345 4.9365 5.2261 5.2409 5.5869 5.6003 5.6876 5.6897 5.8073 5.8192 6.3104 6.3155 6.7025 6.7071 6.9743 6.9747 7.2807 7.2833 7.5106 7.5141 7.5571 7.5575 8.6598 8.6601 10.5126 10.5275 10.6938 10.7065 10.9658 10.9665 k = 0.2895 0.2074 0.8237 ( 5310 PWs) bands (ev): -7.4893 -7.4893 -6.5614 -6.5610 -6.5548 -6.5546 -6.4874 -6.4861 -1.6837 -1.6834 0.7915 0.7952 0.8701 0.8729 1.0063 1.0069 2.5706 2.5732 2.7552 2.7586 2.9240 2.9257 3.0518 3.0547 3.0648 3.0658 3.0805 3.0841 3.2629 3.2652 3.2668 3.2675 4.6489 4.6651 4.6655 4.6878 4.8595 4.8738 4.8891 4.8990 4.9371 4.9394 5.2237 5.2463 5.5626 5.5800 5.7087 5.7121 5.8070 5.8226 6.3091 6.3163 6.6963 6.7030 6.9868 6.9874 7.2754 7.2792 7.5083 7.5132 7.5561 7.5565 8.6531 8.6536 10.5066 10.5335 10.6325 10.6557 11.0288 11.0300 k = 0.3026 0.2168 0.8121 ( 5310 PWs) bands (ev): -7.4903 -7.4902 -6.5621 -6.5617 -6.5556 -6.5555 -6.4853 -6.4839 -1.6831 -1.6828 0.7646 0.7679 0.8765 0.8785 1.0472 1.0480 2.5325 2.5359 2.7753 2.7813 2.8996 2.9037 3.0520 3.0555 3.0773 3.0773 3.0841 3.0902 3.2627 3.2656 3.2678 3.2688 4.6427 4.6648 4.6650 4.6941 4.8532 4.8702 4.8869 4.8981 4.9404 4.9423 5.2218 5.2524 5.5391 5.5594 5.7285 5.7340 5.8080 5.8258 6.3079 6.3169 6.6897 6.6979 7.0031 7.0040 7.2688 7.2735 7.5056 7.5122 7.5542 7.5549 8.6438 8.6445 10.4879 10.5228 10.5934 10.6232 11.0885 11.0903 k = 0.3158 0.2263 0.8005 ( 5311 PWs) bands (ev): -7.4913 -7.4912 -6.5627 -6.5622 -6.5567 -6.5565 -6.4831 -6.4818 -1.6822 -1.6818 0.7402 0.7432 0.8843 0.8857 1.0894 1.0904 2.4929 2.4969 2.7905 2.8016 2.8761 2.8852 3.0510 3.0547 3.0788 3.0803 3.0971 3.1027 3.2631 3.2667 3.2693 3.2705 4.6364 4.6645 4.6646 4.6999 4.8468 4.8645 4.8857 4.8966 4.9439 4.9449 5.2206 5.2593 5.5169 5.5393 5.7453 5.7542 5.8107 5.8291 6.3067 6.3173 6.6834 6.6929 7.0224 7.0235 7.2611 7.2665 7.5024 7.5112 7.5511 7.5527 8.6321 8.6330 10.4517 10.4774 10.5953 10.6147 11.1435 11.1457 k = 0.3289 0.2357 0.7889 ( 5301 PWs) bands (ev): -7.4923 -7.4922 -6.5631 -6.5625 -6.5580 -6.5575 -6.4812 -6.4800 -1.6808 -1.6804 0.7185 0.7212 0.8933 0.8942 1.1328 1.1339 2.4520 2.4565 2.7975 2.8174 2.8559 2.8739 3.0495 3.0533 3.0790 3.0812 3.1081 3.1139 3.2641 3.2685 3.2717 3.2725 4.6302 4.6639 4.6644 4.7052 4.8404 4.8577 4.8849 4.8946 4.9472 4.9473 5.2200 5.2668 5.4962 5.5200 5.7571 5.7714 5.8163 5.8333 6.3055 6.3176 6.6784 6.6887 7.0437 7.0451 7.2528 7.2584 7.4984 7.5101 7.5469 7.5501 8.6184 8.6195 10.4060 10.4226 10.6137 10.6227 11.1924 11.1950 k = 0.3421 0.2451 0.7773 ( 5303 PWs) bands (ev): -7.4935 -7.4933 -6.5634 -6.5629 -6.5590 -6.5581 -6.4797 -6.4787 -1.6790 -1.6786 0.6996 0.7021 0.9034 0.9037 1.1770 1.1783 2.4099 2.4149 2.7930 2.8174 2.8506 2.8734 3.0478 3.0515 3.0791 3.0815 3.1157 3.1217 3.2656 3.2713 3.2748 3.2751 4.6239 4.6632 4.6641 4.7099 4.8340 4.8500 4.8843 4.8924 4.9490 4.9504 5.2201 5.2749 5.4770 5.5018 5.7629 5.7840 5.8249 5.8390 6.3044 6.3176 6.6751 6.6858 7.0661 7.0675 7.2443 7.2497 7.4936 7.5086 7.5418 7.5472 8.6032 8.6044 10.3584 10.3692 10.6378 10.6397 11.2344 11.2374 k = 0.3553 0.2546 0.7657 ( 5313 PWs) bands (ev): -7.4946 -7.4945 -6.5639 -6.5636 -6.5594 -6.5583 -6.4788 -6.4781 -1.6767 -1.6762 0.6834 0.6858 0.9143 0.9145 1.2217 1.2232 2.3671 2.3726 2.7800 2.8005 2.8615 2.8809 3.0458 3.0493 3.0794 3.0816 3.1195 3.1257 3.2675 3.2749 3.2775 3.2798 4.6177 4.6624 4.6637 4.7139 4.8277 4.8419 4.8835 4.8901 4.9504 4.9531 5.2209 5.2834 5.4594 5.4849 5.7635 5.7911 5.8350 5.8468 6.3032 6.3175 6.6739 6.6847 7.0886 7.0896 7.2361 7.2406 7.4879 7.5064 7.5361 7.5442 8.5874 8.5886 10.3129 10.3195 10.6622 10.6653 11.2691 11.2724 k = 0.3684 0.2640 0.7541 ( 5316 PWs) bands (ev): -7.4956 -7.4955 -6.5649 -6.5646 -6.5590 -6.5580 -6.4784 -6.4781 -1.6738 -1.6733 0.6701 0.6724 0.9257 0.9264 1.2668 1.2685 2.3238 2.3297 2.7640 2.7815 2.8742 2.8913 3.0436 3.0468 3.0798 3.0816 3.1200 3.1264 3.2695 3.2787 3.2808 3.2854 4.6115 4.6615 4.6633 4.7172 4.8216 4.8337 4.8825 4.8878 4.9514 4.9555 5.2224 5.2924 5.4434 5.4694 5.7606 5.7933 5.8447 5.8557 6.3020 6.3171 6.6751 6.6855 7.1097 7.1100 7.2289 7.2318 7.4816 7.5034 7.5301 7.5412 8.5717 8.5729 10.2709 10.2744 10.6882 10.6954 11.2967 11.3003 k = 0.3816 0.2734 0.7425 ( 5314 PWs) bands (ev): -7.4966 -7.4966 -6.5664 -6.5655 -6.5579 -6.5571 -6.4787 -6.4786 -1.6703 -1.6698 0.6597 0.6619 0.9377 0.9389 1.3117 1.3136 2.2804 2.2867 2.7478 2.7635 2.8858 2.9018 3.0411 3.0441 3.0802 3.0815 3.1176 3.1244 3.2717 3.2823 3.2849 3.2915 4.6054 4.6604 4.6627 4.7199 4.8157 4.8256 4.8811 4.8855 4.9521 4.9576 5.2246 5.3018 5.4290 5.4554 5.7552 5.7919 5.8526 5.8641 6.3007 6.3166 6.6788 6.6885 7.1261 7.1290 7.2238 7.2239 7.4749 7.4993 7.5243 7.5380 8.5571 8.5581 10.2334 10.2343 10.7168 10.7273 11.3177 11.3215 k = 0.3947 0.2828 0.7309 ( 5312 PWs) bands (ev): -7.4976 -7.4976 -6.5682 -6.5666 -6.5564 -6.5556 -6.4799 -6.4793 -1.6662 -1.6657 0.6522 0.6542 0.9503 0.9520 1.3561 1.3582 2.2373 2.2441 2.7325 2.7472 2.8955 2.9114 3.0384 3.0412 3.0807 3.0813 3.1129 3.1202 3.2742 3.2856 3.2891 3.2975 4.5995 4.6590 4.6620 4.7221 4.8099 4.8177 4.8794 4.8832 4.9527 4.9595 5.2276 5.3116 5.4160 5.4428 5.7480 5.7882 5.8581 5.8708 6.2994 6.3158 6.6847 6.6934 7.1367 7.1436 7.2181 7.2219 7.4681 7.4937 7.5190 7.5347 8.5445 8.5452 10.1997 10.2007 10.7472 10.7604 11.3328 11.3369 k = 0.4079 0.2923 0.7193 ( 5312 PWs) bands (ev): -7.4986 -7.4986 -6.5702 -6.5679 -6.5545 -6.5538 -6.4817 -6.4805 -1.6616 -1.6611 0.6475 0.6494 0.9633 0.9656 1.3994 1.4017 2.1952 2.2023 2.7188 2.7328 2.9031 2.9193 3.0354 3.0380 3.0810 3.0811 3.1066 3.1145 3.2768 3.2890 3.2930 3.3029 4.5938 4.6575 4.6610 4.7239 4.8044 4.8102 4.8772 4.8809 4.9530 4.9611 5.2312 5.3216 5.4045 5.4318 5.7391 5.7827 5.8609 5.8751 6.2978 6.3148 6.6926 6.7002 7.1404 7.1515 7.2161 7.2235 7.4613 7.4866 7.5142 7.5313 8.5349 8.5352 10.1706 10.1732 10.7785 10.7939 11.3427 11.3472 k = 0.4211 0.3017 0.7077 ( 5312 PWs) bands (ev): -7.4995 -7.4995 -6.5725 -6.5695 -6.5522 -6.5515 -6.4837 -6.4820 -1.6565 -1.6559 0.6456 0.6475 0.9767 0.9794 1.4409 1.4433 2.1546 2.1621 2.7070 2.7207 2.9082 2.9252 3.0322 3.0346 3.0805 3.0813 3.0995 3.1080 3.2796 3.2925 3.2961 3.3075 4.5884 4.6557 4.6598 4.7253 4.7991 4.8033 4.8745 4.8787 4.9533 4.9625 5.2354 5.3319 5.3943 5.4221 5.7290 5.7761 5.8610 5.8770 6.2961 6.3133 6.7022 6.7086 7.1382 7.1520 7.2182 7.2270 7.4546 7.4783 7.5099 7.5276 8.5287 8.5290 10.1472 10.1511 10.8101 10.8273 11.3480 11.3528 k = 0.4342 0.3111 0.6961 ( 5308 PWs) bands (ev): -7.5005 -7.5005 -6.5752 -6.5716 -6.5495 -6.5488 -6.4859 -6.4837 -1.6509 -1.6504 0.6466 0.6484 0.9903 0.9935 1.4797 1.4822 2.1164 2.1245 2.6974 2.7109 2.9106 2.9288 3.0288 3.0307 3.0798 3.0807 3.0928 3.1012 3.2826 3.2958 3.2986 3.3110 4.5833 4.6536 4.6583 4.7265 4.7941 4.7969 4.8714 4.8765 4.9535 4.9638 5.2402 5.3425 5.3851 5.4138 5.7179 5.7686 5.8587 5.8765 6.2940 6.3115 6.7129 6.7180 7.1320 7.1467 7.2223 7.2302 7.4480 7.4687 7.5059 7.5238 8.5265 8.5273 10.1294 10.1343 10.8410 10.8598 11.3489 11.3543 k = 0.4474 0.3206 0.6845 ( 5309 PWs) bands (ev): -7.5016 -7.5016 -6.5783 -6.5742 -6.5464 -6.5458 -6.4880 -6.4852 -1.6449 -1.6444 0.6504 0.6521 1.0041 1.0078 1.5146 1.5172 2.0819 2.0904 2.6900 2.7034 2.9100 2.9296 3.0253 3.0262 3.0778 3.0785 3.0885 3.0948 3.2857 3.2982 3.3010 3.3135 4.5785 4.6513 4.6564 4.7277 4.7892 4.7913 4.8678 4.8742 4.9536 4.9650 5.2455 5.3533 5.3770 5.4068 5.7061 5.7606 5.8542 5.8737 6.2916 6.3093 6.7241 6.7280 7.1234 7.1381 7.2260 7.2315 7.4412 7.4580 7.5023 7.5199 8.5287 8.5300 10.1174 10.1229 10.8707 10.8906 11.3458 11.3518 k = 0.4605 0.3300 0.6729 ( 5314 PWs) bands (ev): -7.5029 -7.5028 -6.5821 -6.5774 -6.5430 -6.5423 -6.4897 -6.4865 -1.6387 -1.6382 0.6569 0.6585 1.0180 1.0222 1.5440 1.5467 2.0524 2.0615 2.6848 2.6983 2.9063 2.9273 3.0211 3.0217 3.0727 3.0762 3.0873 3.0895 3.2890 3.2989 3.3042 3.3148 4.5742 4.6487 4.6542 4.7288 4.7847 4.7863 4.8637 4.8719 4.9538 4.9660 5.2513 5.3642 5.3697 5.4008 5.6938 5.7525 5.8479 5.8689 6.2888 6.3065 6.7352 6.7381 7.1133 7.1277 7.2281 7.2304 7.4340 7.4461 7.4990 7.5159 8.5353 8.5371 10.1107 10.1165 10.8983 10.9190 11.3384 11.3451 k = 0.4737 0.3394 0.6613 ( 5303 PWs) bands (ev): -7.5043 -7.5042 -6.5865 -6.5814 -6.5393 -6.5386 -6.4908 -6.4873 -1.6323 -1.6319 0.6660 0.6676 1.0322 1.0368 1.5663 1.5690 2.0298 2.0395 2.6817 2.6955 2.8993 2.9216 3.0156 3.0183 3.0673 3.0723 3.0861 3.0873 3.2923 3.2984 3.3077 3.3151 4.5703 4.6460 4.6518 4.7301 4.7805 4.7821 4.8592 4.8694 4.9540 4.9671 5.2576 5.3625 5.3757 5.3958 5.6815 5.7446 5.8401 5.8625 6.2856 6.3032 6.7458 6.7478 7.1021 7.1160 7.2270 7.2283 7.4263 7.4335 7.4962 7.5121 8.5460 8.5482 10.1093 10.1150 10.9229 10.9441 11.3266 11.3342 k = 0.4868 0.3488 0.6497 ( 5298 PWs) bands (ev): -7.5061 -7.5060 -6.5914 -6.5861 -6.5352 -6.5344 -6.4912 -6.4874 -1.6259 -1.6255 0.6778 0.6793 1.0467 1.0516 1.5795 1.5822 2.0157 2.0261 2.6805 2.6946 2.8891 2.9122 3.0100 3.0150 3.0626 3.0673 3.0842 3.0877 3.2957 3.2971 3.3113 3.3145 4.5670 4.6432 4.6490 4.7314 4.7766 4.7785 4.8544 4.8668 4.9542 4.9680 5.2641 5.3560 5.3870 5.3915 5.6695 5.7372 5.8311 5.8547 6.2818 6.2994 6.7551 6.7567 7.0899 7.1033 7.2215 7.2268 7.4182 7.4202 7.4939 7.5086 8.5601 8.5625 10.1125 10.1179 10.9439 10.9652 11.3101 11.3186 k = 0.5000 0.3583 0.6381 ( 5302 PWs) bands (ev): -7.5083 -7.5081 -6.5969 -6.5915 -6.5307 -6.5300 -6.4907 -6.4869 -1.6197 -1.6193 0.6920 0.6935 1.0616 1.0668 1.5826 1.5853 2.0111 2.0221 2.6809 2.6953 2.8761 2.8992 3.0049 3.0120 3.0585 3.0617 3.0830 3.0882 3.2951 3.2989 3.3131 3.3149 4.5642 4.6403 4.6460 4.7328 4.7730 4.7753 4.8493 4.8641 4.9544 4.9688 5.2708 5.3495 5.3876 5.3984 5.6582 5.7307 5.8213 5.8459 6.2775 6.2950 6.7627 6.7641 7.0767 7.0896 7.2142 7.2238 7.4069 7.4101 7.4924 7.5058 8.5767 8.5793 10.1198 10.1244 10.9606 10.9815 11.2885 11.2980 k = 0.5000 0.3583 0.6381 ( 5302 PWs) bands (ev): -7.5083 -7.5081 -6.5969 -6.5915 -6.5307 -6.5300 -6.4907 -6.4869 -1.6197 -1.6193 0.6920 0.6935 1.0616 1.0668 1.5826 1.5853 2.0111 2.0221 2.6809 2.6953 2.8761 2.8992 3.0049 3.0120 3.0585 3.0617 3.0830 3.0882 3.2951 3.2989 3.3131 3.3149 4.5642 4.6403 4.6460 4.7328 4.7730 4.7753 4.8493 4.8641 4.9544 4.9688 5.2708 5.3495 5.3876 5.3984 5.6582 5.7307 5.8213 5.8459 6.2775 6.2950 6.7627 6.7641 7.0767 7.0896 7.2142 7.2238 7.4069 7.4101 7.4924 7.5058 8.5767 8.5793 10.1198 10.1244 10.9606 10.9815 11.2885 11.2980 k = 0.5000 0.3583 0.6181 ( 5302 PWs) bands (ev): -7.5127 -7.5125 -6.6071 -6.6015 -6.5225 -6.5217 -6.4889 -6.4850 -1.6091 -1.6087 0.7194 0.7208 1.0886 1.0944 1.5787 1.5816 2.0116 2.0236 2.6825 2.6977 2.8495 2.8715 2.9975 3.0072 3.0528 3.0529 3.0821 3.0894 3.2909 3.3035 3.3109 3.3210 4.5605 4.6351 4.6406 4.7354 4.7673 4.7701 4.8403 4.8591 4.9546 4.9699 5.2826 5.3381 5.3816 5.4184 5.6393 5.7200 5.8043 5.8303 6.2699 6.2871 6.7725 6.7739 7.0527 7.0649 7.1988 7.2154 7.3871 7.3987 7.4902 7.5014 8.6081 8.6109 10.1346 10.1373 10.9815 11.0005 11.2439 11.2550 k = 0.5000 0.3583 0.5982 ( 5302 PWs) bands (ev): -7.5176 -7.5174 -6.6178 -6.6122 -6.5137 -6.5130 -6.4863 -6.4825 -1.5986 -1.5983 0.7488 0.7500 1.1178 1.1241 1.5739 1.5769 2.0122 2.0253 2.6839 2.6994 2.8196 2.8399 2.9916 3.0030 3.0458 3.0490 3.0820 3.0910 3.2866 3.3029 3.3138 3.3273 4.5580 4.6295 4.6347 4.7378 4.7619 4.7643 4.8315 4.8541 4.9544 4.9702 5.2936 5.3264 5.3771 5.4388 5.6194 5.7085 5.7883 5.8156 6.2630 6.2796 6.7792 6.7800 7.0279 7.0393 7.1806 7.2022 7.3735 7.3913 7.4873 7.4968 8.6417 8.6445 10.1471 10.1475 10.9943 11.0105 11.1939 11.2064 k = 0.5000 0.3583 0.5783 ( 5312 PWs) bands (ev): -7.5231 -7.5228 -6.6291 -6.6234 -6.5044 -6.5038 -6.4830 -6.4793 -1.5885 -1.5883 0.7799 0.7810 1.1490 1.1559 1.5679 1.5711 2.0130 2.0270 2.6846 2.7000 2.7879 2.8060 2.9869 2.9996 3.0403 3.0460 3.0825 3.0930 3.2826 3.2993 3.3198 3.3336 4.5567 4.6234 4.6282 4.7394 4.7573 4.7578 4.8230 4.8489 4.9538 4.9700 5.3020 5.3147 5.3761 5.4597 5.5989 5.6961 5.7736 5.8018 6.2567 6.2724 6.7823 6.7827 7.0026 7.0131 7.1605 7.1839 7.3663 7.3876 7.4837 7.4916 8.6772 8.6801 10.1541 10.1562 10.9991 11.0110 11.1395 11.1531 k = 0.5000 0.3583 0.5583 ( 5310 PWs) bands (ev): -7.5291 -7.5287 -6.6408 -6.6351 -6.4946 -6.4943 -6.4788 -6.4754 -1.5790 -1.5789 0.8128 0.8135 1.1822 1.1897 1.5608 1.5641 2.0140 2.0288 2.6834 2.6973 2.7573 2.7721 2.9832 2.9968 3.0359 3.0435 3.0836 3.0953 3.2793 3.2955 3.3264 3.3399 4.5567 4.6168 4.6213 4.7394 4.7505 4.7547 4.8152 4.8437 4.9527 4.9691 5.3031 5.3057 5.3807 5.4810 5.5778 5.6831 5.7602 5.7891 6.2510 6.2658 6.7806 6.7829 6.9769 6.9867 7.1395 7.1618 7.3646 7.3870 7.4793 7.4859 8.7145 8.7172 10.1563 10.1612 10.9951 11.0014 11.0833 11.0971 k = 0.5000 0.3583 0.5384 ( 5300 PWs) bands (ev): -7.5356 -7.5352 -6.6528 -6.6472 -6.4847 -6.4844 -6.4734 -6.4707 -1.5701 -1.5701 0.8473 0.8477 1.2171 1.2252 1.5524 1.5558 2.0152 2.0308 2.6773 2.6847 2.7349 2.7417 2.9802 2.9946 3.0322 3.0411 3.0851 3.0981 3.2769 3.2921 3.3334 3.3464 4.5577 4.6098 4.6141 4.7368 4.7421 4.7547 4.8083 4.8386 4.9513 4.9679 5.2920 5.3041 5.3914 5.5025 5.5565 5.6694 5.7481 5.7774 6.2460 6.2597 6.7749 6.7800 6.9512 6.9601 7.1188 7.1375 7.3668 7.3885 7.4742 7.4795 8.7531 8.7555 10.1536 10.1614 10.9751 10.9774 11.0337 11.0453 k = 0.5000 0.3583 0.5184 ( 5304 PWs) bands (ev): -7.5426 -7.5422 -6.6652 -6.6596 -6.4755 -6.4738 -6.4665 -6.4653 -1.5623 -1.5622 0.8833 0.8834 1.2535 1.2624 1.5426 1.5462 2.0166 2.0329 2.6575 2.6595 2.7221 2.7259 2.9778 2.9930 3.0289 3.0385 3.0871 3.1011 3.2758 3.2897 3.3406 3.3528 4.5596 4.6022 4.6066 4.7325 4.7325 4.7565 4.8022 4.8335 4.9494 4.9662 5.2814 5.2988 5.4066 5.5242 5.5351 5.6550 5.7374 5.7670 6.2417 6.2540 6.7652 6.7738 6.9254 6.9334 7.0992 7.1125 7.3715 7.3915 7.4684 7.4723 8.7927 8.7947 10.1458 10.1564 10.9236 10.9339 11.0008 11.0111 k = 0.5000 0.3583 0.4985 ( 5308 PWs) bands (ev): -7.5501 -7.5497 -6.6778 -6.6723 -6.4670 -6.4630 -6.4589 -6.4578 -1.5556 -1.5554 0.9203 0.9210 1.2914 1.3009 1.5315 1.5351 2.0183 2.0352 2.6229 2.6294 2.7141 2.7235 2.9758 2.9920 3.0257 3.0358 3.0895 3.1045 3.2763 3.2884 3.3480 3.3594 4.5623 4.5942 4.5991 4.7219 4.7277 4.7591 4.7970 4.8285 4.9472 4.9643 5.2716 5.2917 5.4244 5.5139 5.5458 5.6402 5.7282 5.7580 6.2378 6.2489 6.7518 6.7645 6.8998 6.9070 7.0812 7.0881 7.3776 7.3954 7.4619 7.4646 8.8327 8.8343 10.1330 10.1463 10.8582 10.8714 10.9745 10.9884 k = 0.5000 0.3583 0.4786 ( 5308 PWs) bands (ev): -7.5581 -7.5576 -6.6905 -6.6852 -6.4589 -6.4526 -6.4511 -6.4477 -1.5501 -1.5497 0.9587 0.9601 1.3303 1.3406 1.5190 1.5227 2.0203 2.0377 2.5861 2.5938 2.7111 2.7226 2.9743 2.9916 3.0226 3.0330 3.0923 3.1082 3.2785 3.2885 3.3556 3.3660 4.5654 4.5855 4.5919 4.7103 4.7228 4.7618 4.7926 4.8237 4.9447 4.9621 5.2628 5.2838 5.4429 5.4937 5.5667 5.6253 5.7206 5.7505 6.2345 6.2442 6.7350 6.7520 6.8745 6.8808 7.0653 7.0653 7.3843 7.3997 7.4548 7.4562 8.8728 8.8739 10.1156 10.1315 10.7880 10.8021 10.9460 10.9650 k = 0.5000 0.3583 0.4586 ( 5298 PWs) bands (ev): -7.5665 -7.5659 -6.7034 -6.6981 -6.4505 -6.4444 -6.4400 -6.4367 -1.5458 -1.5453 0.9984 1.0006 1.3701 1.3813 1.5052 1.5089 2.0226 2.0404 2.5488 2.5566 2.7094 2.7217 2.9732 2.9919 3.0195 3.0302 3.0954 3.1123 3.2825 3.2903 3.3634 3.3727 4.5678 4.5762 4.5860 4.6981 4.7182 4.7646 4.7889 4.8189 4.9419 4.9596 5.2551 5.2759 5.4553 5.4807 5.5846 5.6123 5.7151 5.7452 6.2316 6.2398 6.7154 6.7366 6.8496 6.8551 7.0447 7.0516 7.3907 7.4037 7.4474 7.4477 8.9125 8.9130 10.0945 10.1126 10.7159 10.7303 10.9129 10.9368 k = 0.5000 0.3583 0.4387 ( 5308 PWs) bands (ev): -7.5752 -7.5746 -6.7163 -6.7112 -6.4417 -6.4358 -6.4285 -6.4254 -1.5428 -1.5423 1.0392 1.0423 1.4103 1.4226 1.4903 1.4938 2.0251 2.0432 2.5119 2.5192 2.7075 2.7200 2.9724 2.9927 3.0167 3.0278 3.0988 3.1167 3.2882 3.2939 3.3713 3.3795 4.5662 4.5671 4.5836 4.6855 4.7138 4.7672 4.7854 4.8141 4.9388 4.9571 5.2485 5.2684 5.4438 5.4920 5.5851 5.6144 5.7117 5.7428 6.2289 6.2357 6.6935 6.7183 6.8251 6.8298 7.0267 7.0401 7.3959 7.4063 7.4397 7.4405 8.9512 8.9512 10.0703 10.0904 10.6433 10.6578 10.8745 10.9024 k = 0.5000 0.3583 0.4187 ( 5304 PWs) bands (ev): -7.5841 -7.5835 -6.7291 -6.7241 -6.4323 -6.4266 -6.4168 -6.4138 -1.5413 -1.5406 1.0811 1.0853 1.4491 1.4638 1.4760 1.4780 2.0280 2.0461 2.4756 2.4823 2.7046 2.7172 2.9719 2.9940 3.0143 3.0260 3.1026 3.1215 3.2956 3.2992 3.3794 3.3864 4.5556 4.5624 4.5857 4.6729 4.7100 4.7696 4.7822 4.8093 4.9356 4.9544 5.2432 5.2614 5.4244 5.5110 5.5706 5.6283 5.7111 5.7445 6.2265 6.2319 6.6697 6.6975 6.8011 6.8053 7.0116 7.0308 7.3982 7.4055 7.4344 7.4355 8.9880 8.9885 10.0440 10.0658 10.5710 10.5854 10.8308 10.8621 k = 0.5000 0.3583 0.3988 ( 5302 PWs) bands (ev): -7.5933 -7.5927 -6.7418 -6.7370 -6.4223 -6.4168 -6.4050 -6.4022 -1.5411 -1.5403 1.1240 1.1293 1.4535 1.4596 1.4951 1.5067 2.0311 2.0492 2.4405 2.4463 2.7004 2.7129 2.9719 2.9957 3.0127 3.0250 3.1065 3.1264 3.3045 3.3062 3.3877 3.3935 4.5444 4.5560 4.5892 4.6610 4.7068 4.7717 4.7790 4.8047 4.9324 4.9516 5.2392 5.2552 5.4044 5.5297 5.5538 5.6399 5.7140 5.7518 6.2242 6.2282 6.6448 6.6745 6.7778 6.7814 6.9993 7.0234 7.3954 7.3992 7.4337 7.4345 9.0230 9.0240 10.0164 10.0398 10.4997 10.5139 10.7826 10.8165 k = 0.5000 0.3583 0.3789 ( 5306 PWs) bands (ev): -7.6027 -7.6020 -6.7543 -6.7497 -6.4119 -6.4065 -6.3933 -6.3905 -1.5423 -1.5414 1.1677 1.1744 1.4361 1.4412 1.5347 1.5482 2.0344 2.0523 2.4066 2.4115 2.6944 2.7068 2.9724 2.9977 3.0123 3.0250 3.1106 3.1314 3.3148 3.3148 3.3962 3.4007 4.5326 4.5490 4.5924 4.6506 4.7044 4.7734 4.7757 4.8000 4.9292 4.9488 5.2362 5.2495 5.3846 5.5361 5.5463 5.6467 5.7211 5.7653 6.2220 6.2245 6.6190 6.6498 6.7552 6.7584 6.9899 7.0180 7.3877 7.3889 7.4362 7.4372 9.0559 9.0573 9.9881 10.0129 10.4300 10.4439 10.7305 10.7665 k = 0.5000 0.3583 0.3589 ( 5302 PWs) bands (ev): -7.6121 -7.6114 -6.7666 -6.7622 -6.4010 -6.3958 -6.3816 -6.3789 -1.5448 -1.5439 1.2123 1.2204 1.4171 1.4221 1.5747 1.5893 2.0378 2.0555 2.3743 2.3781 2.6865 2.6987 2.9737 2.9998 3.0133 3.0260 3.1148 3.1365 3.3248 3.3263 3.4048 3.4080 4.5202 4.5418 4.5938 4.6433 4.7027 4.7724 4.7746 4.7956 4.9263 4.9459 5.2343 5.2442 5.3658 5.5181 5.5598 5.6492 5.7332 5.7844 6.2197 6.2208 6.5930 6.6241 6.7335 6.7362 6.9832 7.0145 7.3764 7.3769 7.4399 7.4419 9.0864 9.0882 9.9597 9.9859 10.3625 10.3760 10.6753 10.7132 k = 0.5000 0.3583 0.3390 ( 5302 PWs) bands (ev): -7.6215 -7.6207 -6.7786 -6.7743 -6.3899 -6.3848 -6.3701 -6.3675 -1.5486 -1.5475 1.2575 1.2671 1.3975 1.4023 1.6139 1.6294 2.0413 2.0587 2.3438 2.3464 2.6766 2.6885 2.9759 3.0023 3.0157 3.0280 3.1189 3.1416 3.3359 3.3386 3.4135 3.4154 4.5074 4.5339 4.5926 4.6402 4.7019 4.7687 4.7754 4.7913 4.9237 4.9430 5.2331 5.2386 5.3485 5.4999 5.5698 5.6487 5.7504 5.8075 6.2169 6.2172 6.5670 6.5976 6.7127 6.7150 6.9791 7.0129 7.3627 7.3645 7.4439 7.4471 9.1144 9.1165 9.9317 9.9593 10.2974 10.3105 10.6179 10.6572 k = 0.5000 0.3583 0.3190 ( 5310 PWs) bands (ev): -7.6308 -7.6301 -6.7902 -6.7862 -6.3785 -6.3735 -6.3588 -6.3563 -1.5534 -1.5523 1.3031 1.3143 1.3775 1.3821 1.6519 1.6683 2.0450 2.0618 2.3151 2.3165 2.6646 2.6762 2.9791 3.0053 3.0193 3.0308 3.1230 3.1465 3.3480 3.3517 3.4223 3.4230 4.4942 4.5250 4.5894 4.6411 4.7019 4.7648 4.7756 4.7876 4.9216 4.9400 5.2318 5.2323 5.3337 5.4819 5.5766 5.6463 5.7721 5.8331 6.2129 6.2146 6.5414 6.5709 6.6929 6.6948 6.9776 7.0130 7.3482 7.3509 7.4478 7.4522 9.1398 9.1420 9.9043 9.9332 10.2351 10.2478 10.5588 10.5995 k = 0.5000 0.3583 0.2991 ( 5302 PWs) bands (ev): -7.6399 -7.6392 -6.8014 -6.7976 -6.3670 -6.3622 -6.3478 -6.3453 -1.5592 -1.5580 1.3489 1.3547 1.3621 1.3646 1.6884 1.7055 2.0486 2.0650 2.2885 2.2886 2.6508 2.6620 2.9833 3.0090 3.0238 3.0344 3.1269 3.1512 3.3608 3.3654 3.4307 3.4311 4.4807 4.5147 4.5864 4.6447 4.7027 4.7606 4.7752 4.7845 4.9202 4.9369 5.2228 5.2316 5.3224 5.4644 5.5809 5.6429 5.7974 5.8603 6.2086 6.2116 6.5163 6.5444 6.6742 6.6758 6.9787 7.0151 7.3332 7.3366 7.4514 7.4570 9.1626 9.1648 9.8777 9.9081 10.1760 10.1881 10.4988 10.5405 k = 0.5000 0.3583 0.2792 ( 5308 PWs) bands (ev): -7.6489 -7.6482 -6.8121 -6.8085 -6.3555 -6.3508 -6.3371 -6.3347 -1.5659 -1.5646 1.3366 1.3413 1.3955 1.4107 1.7229 1.7407 2.0521 2.0680 2.2626 2.2644 2.6353 2.6460 2.9884 3.0134 3.0291 3.0385 3.1306 3.1555 3.3742 3.3793 3.4384 3.4398 4.4670 4.5028 4.5849 4.6497 4.7040 4.7561 4.7744 4.7823 4.9193 4.9337 5.2107 5.2303 5.3152 5.4475 5.5833 5.6388 5.8253 5.8884 6.2040 6.2083 6.4921 6.5183 6.6567 6.6578 6.9821 7.0191 7.3179 7.3218 7.4545 7.4613 9.1829 9.1851 9.8522 9.8839 10.1202 10.1319 10.4382 10.4809 k = 0.5000 0.3583 0.2592 ( 5298 PWs) bands (ev): -7.6575 -7.6568 -6.8223 -6.8189 -6.3441 -6.3396 -6.3268 -6.3244 -1.5731 -1.5719 1.3169 1.3214 1.4418 1.4588 1.7551 1.7733 2.0555 2.0709 2.2389 2.2425 2.6184 2.6284 2.9942 3.0183 3.0350 3.0432 3.1340 3.1594 3.3880 3.3934 3.4462 3.4484 4.4533 4.4895 4.5857 4.6553 4.7056 4.7515 4.7733 4.7812 4.9192 4.9303 5.1955 5.2279 5.3122 5.4320 5.5846 5.6345 5.8548 5.9167 6.1990 6.2047 6.4689 6.4931 6.6404 6.6412 6.9880 7.0252 7.3026 7.3068 7.4570 7.4648 9.2009 9.2030 9.8277 9.8608 10.0680 10.0792 10.3776 10.4210 k = 0.5000 0.3583 0.2393 ( 5302 PWs) bands (ev): -7.6658 -7.6651 -6.8319 -6.8287 -6.3329 -6.3287 -6.3169 -6.3147 -1.5809 -1.5797 1.2975 1.3018 1.4879 1.5069 1.7846 1.8030 2.0587 2.0737 2.2175 2.2232 2.6003 2.6095 3.0007 3.0236 3.0413 3.0482 3.1371 3.1629 3.4018 3.4074 3.4540 3.4569 4.4397 4.4754 4.5889 4.6612 4.7072 4.7467 4.7720 4.7814 4.9198 4.9266 5.1778 5.2237 5.3128 5.4183 5.5850 5.6299 5.8850 5.9449 6.1938 6.2007 6.4469 6.4688 6.6254 6.6259 6.9961 7.0331 7.2872 7.2916 7.4587 7.4674 9.2169 9.2187 9.8043 9.8388 10.0195 10.0301 10.3176 10.3615 k = 0.5000 0.3583 0.2193 ( 5300 PWs) bands (ev): -7.6736 -7.6730 -6.8409 -6.8380 -6.3222 -6.3181 -6.3076 -6.3054 -1.5889 -1.5877 1.2789 1.2830 1.5337 1.5547 1.8112 1.8293 2.0617 2.0764 2.1985 2.2065 2.5815 2.5896 3.0075 3.0292 3.0480 3.0536 3.1398 3.1657 3.4156 3.4210 3.4617 3.4651 4.4265 4.4608 4.5945 4.6672 4.7082 4.7418 4.7704 4.7837 4.9211 4.9226 5.1585 5.2169 5.3159 5.4069 5.5851 5.6254 5.9153 5.9724 6.1883 6.1963 6.4261 6.4458 6.6118 6.6119 7.0066 7.0430 7.2723 7.2767 7.4594 7.4689 9.2311 9.2326 9.7821 9.8179 9.9747 9.9849 10.2585 10.3028 k = 0.5000 0.3583 0.1994 ( 5308 PWs) bands (ev): -7.6810 -7.6804 -6.8492 -6.8466 -6.3118 -6.3080 -6.2989 -6.2968 -1.5970 -1.5959 1.2612 1.2650 1.5789 1.6020 1.8346 1.8519 2.0643 2.0789 2.1819 2.1924 2.5622 2.5690 3.0144 3.0347 3.0550 3.0591 3.1422 3.1680 3.4290 3.4342 3.4693 3.4729 4.4138 4.4460 4.6022 4.6731 4.7085 4.7369 4.7683 4.7885 4.9183 4.9232 5.1383 5.2070 5.3209 5.3983 5.5849 5.6208 5.9450 5.9987 6.1827 6.1918 6.4069 6.4243 6.5994 6.5995 7.0193 7.0547 7.2578 7.2621 7.4590 7.4692 9.2439 9.2449 9.7614 9.7984 9.9339 9.9436 10.2009 10.2451 k = 0.5000 0.3583 0.1795 ( 5310 PWs) bands (ev): -7.6878 -7.6873 -6.8568 -6.8545 -6.3021 -6.2985 -6.2908 -6.2888 -1.6051 -1.6040 1.2447 1.2481 1.6233 1.6485 1.8545 1.8707 2.0664 2.0814 2.1675 2.1807 2.5429 2.5481 3.0214 3.0401 3.0620 3.0646 3.1444 3.1697 3.4418 3.4465 3.4768 3.4803 4.4017 4.4315 4.6121 4.6788 4.7080 4.7322 4.7657 4.7955 4.9139 4.9258 5.1178 5.1939 5.3272 5.3926 5.5846 5.6164 5.9733 6.0234 6.1771 6.1871 6.3891 6.4043 6.5882 6.5885 7.0340 7.0682 7.2440 7.2481 7.4574 7.4682 9.2553 9.2557 9.7425 9.7806 9.8969 9.9062 10.1451 10.1891 k = 0.5000 0.3583 0.1595 ( 5306 PWs) bands (ev): -7.6941 -7.6936 -6.8637 -6.8616 -6.2931 -6.2898 -6.2833 -6.2814 -1.6128 -1.6118 1.2294 1.2325 1.6668 1.6940 1.8709 1.8855 2.0681 2.0837 2.1552 2.1709 2.5238 2.5274 3.0282 3.0452 3.0689 3.0701 3.1463 3.1707 3.4540 3.4579 3.4841 3.4873 4.3905 4.4176 4.6239 4.6843 4.7069 4.7278 4.7626 4.8042 4.9094 4.9292 5.0975 5.1777 5.3343 5.3893 5.5844 5.6122 5.9999 6.0459 6.1720 6.1826 6.3730 6.3860 6.5785 6.5789 7.0505 7.0831 7.2312 7.2348 7.4546 7.4658 9.2653 9.2654 9.7257 9.7647 9.8639 9.8729 10.0917 10.1349 k = 0.5000 0.3583 0.1396 ( 5306 PWs) bands (ev): -7.6997 -7.6992 -6.8699 -6.8680 -6.2849 -6.2819 -6.2765 -6.2748 -1.6201 -1.6191 1.2155 1.2183 1.7089 1.7380 1.8840 1.8966 2.0692 2.0859 2.1447 2.1626 2.5055 2.5073 3.0347 3.0500 3.0754 3.0754 3.1479 3.1712 3.4650 3.4680 3.4912 3.4937 4.3802 4.4044 4.6374 4.6895 4.7054 4.7238 4.7592 4.8132 4.9057 4.9331 5.0778 5.1589 5.3418 5.3878 5.5843 5.6081 6.0242 6.0656 6.1676 6.1784 6.3586 6.3696 6.5701 6.5706 7.0684 7.0989 7.2195 7.2225 7.4505 7.4620 9.2737 9.2744 9.7118 9.7516 9.8348 9.8435 10.0408 10.0831 k = 0.5000 0.3583 0.1196 ( 5298 PWs) bands (ev): -7.7046 -7.7042 -6.8753 -6.8736 -6.2776 -6.2750 -6.2704 -6.2689 -1.6268 -1.6259 1.2032 1.2057 1.7494 1.7801 1.8939 1.9045 2.0696 2.0879 2.1356 2.1547 2.4883 2.4886 3.0407 3.0542 3.0804 3.0814 3.1495 3.1710 3.4748 3.4768 3.4979 3.4996 4.3712 4.3922 4.6525 4.6944 4.7038 4.7204 4.7555 4.8205 4.9044 4.9376 5.0592 5.1380 5.3495 5.3876 5.5843 5.6044 6.0455 6.0819 6.1644 6.1749 6.3461 6.3551 6.5631 6.5637 7.0873 7.1151 7.2094 7.2115 7.4453 7.4569 9.2809 9.2820 9.7014 9.7418 9.8096 9.8181 9.9928 10.0339 k = 0.5000 0.3583 0.0997 ( 5306 PWs) bands (ev): -7.7088 -7.7085 -6.8798 -6.8785 -6.2714 -6.2691 -6.2651 -6.2638 -1.6326 -1.6319 1.1927 1.1947 1.7879 1.8195 1.9012 1.9096 2.0692 2.0895 2.1275 2.1465 2.4716 2.4728 3.0463 3.0577 3.0850 3.0866 3.1511 3.1704 3.4832 3.4842 3.5041 3.5050 4.3636 4.3812 4.6688 4.6984 4.7023 4.7180 4.7516 4.8233 4.9075 4.9427 5.0420 5.1156 5.3569 5.3880 5.5845 5.6009 6.0634 6.0940 6.1632 6.1724 6.3353 6.3426 6.5573 6.5578 7.1064 7.1308 7.2009 7.2019 7.4392 7.4505 9.2867 9.2882 9.6953 9.7360 9.7882 9.7968 9.9482 9.9876 k = 0.5000 0.3583 0.0798 ( 5302 PWs) bands (ev): -7.7123 -7.7121 -6.8835 -6.8825 -6.2661 -6.2644 -6.2605 -6.2596 -1.6376 -1.6370 1.1839 1.1856 1.8238 1.8555 1.9064 1.9128 2.0681 2.0908 2.1203 2.1371 2.4572 2.4593 3.0513 3.0606 3.0890 3.0909 3.1528 3.1692 3.4899 3.4901 3.5096 3.5098 4.3574 4.3717 4.6859 4.7010 4.7016 4.7174 4.7475 4.8199 4.9168 4.9483 5.0264 5.0921 5.3640 5.3885 5.5848 5.5978 6.0777 6.1016 6.1641 6.1712 6.3266 6.3322 6.5527 6.5532 7.1248 7.1448 7.1941 7.1946 7.4327 7.4433 9.2912 9.2929 9.6939 9.7348 9.7706 9.7796 9.9073 9.9447 k = 0.5000 0.3583 0.0598 ( 5298 PWs) bands (ev): -7.7151 -7.7148 -6.8864 -6.8856 -6.2620 -6.2608 -6.2568 -6.2562 -1.6416 -1.6412 1.1771 1.1783 1.8563 1.8861 1.9099 1.9144 2.0666 2.0914 2.1142 2.1263 2.4458 2.4482 3.0555 3.0627 3.0923 3.0943 3.1546 3.1676 3.4946 3.4950 3.5139 3.5142 4.3529 4.3636 4.6991 4.7000 4.7076 4.7191 4.7432 4.8106 4.9315 4.9545 5.0127 5.0681 5.3704 5.3886 5.5854 5.5951 6.0882 6.1053 6.1666 6.1711 6.3198 6.3240 6.5492 6.5496 7.1414 7.1554 7.1884 7.1910 7.4267 7.4358 9.2945 9.2961 9.6976 9.7379 9.7567 9.7664 9.8711 9.9056 k = 0.5000 0.3583 0.0399 ( 5310 PWs) bands (ev): -7.7170 -7.7169 -6.8885 -6.8879 -6.2591 -6.2583 -6.2541 -6.2537 -1.6445 -1.6442 1.1722 1.1730 1.8844 1.9088 1.9124 1.9151 2.0661 2.0904 2.1094 2.1151 2.4378 2.4398 3.0590 3.0638 3.0949 3.0965 3.1566 3.1656 3.4979 3.4983 3.5171 3.5175 4.3500 4.3572 4.6995 4.7006 4.7205 4.7266 4.7388 4.7971 4.9495 4.9611 5.0008 5.0439 5.3759 5.3880 5.5863 5.5927 6.0955 6.1061 6.1695 6.1719 6.3151 6.3178 6.5467 6.5470 7.1541 7.1614 7.1856 7.1903 7.4219 7.4288 9.2968 9.2980 9.7057 9.7425 9.7479 9.7577 9.8417 9.8712 k = 0.5000 0.3583 0.0199 ( 5302 PWs) bands (ev): -7.7182 -7.7181 -6.8896 -6.8894 -6.2572 -6.2569 -6.2524 -6.2523 -1.6462 -1.6461 1.1693 1.1697 1.9064 1.9135 1.9150 1.9210 2.0689 2.0854 2.1063 2.1072 2.4332 2.4344 3.0616 3.0641 3.0967 3.0976 3.1588 3.1635 3.4999 3.5002 3.5193 3.5195 4.3491 4.3527 4.6994 4.7001 4.7254 4.7343 4.7446 4.7810 4.9682 4.9683 4.9922 5.0203 5.3805 5.3866 5.5875 5.5906 6.1003 6.1054 6.1718 6.1727 6.3125 6.3139 6.5454 6.5455 7.1613 7.1636 7.1866 7.1905 7.4195 7.4232 9.2982 9.2988 9.7167 9.7362 9.7521 9.7536 9.8239 9.8430 k = 0.5000 0.3583-0.0000 ( 5290 PWs) bands (ev): -7.7185 -7.7185 -6.8899 -6.8899 -6.2565 -6.2565 -6.2518 -6.2518 -1.6467 -1.6467 1.1685 1.1685 1.9146 1.9146 1.9197 1.9197 2.0764 2.0764 2.1051 2.1051 2.4322 2.4322 3.0633 3.0633 3.0977 3.0977 3.1612 3.1612 3.5007 3.5007 3.5201 3.5201 4.3500 4.3500 4.6997 4.6997 4.7299 4.7299 4.7633 4.7633 4.9745 4.9745 4.9989 4.9989 5.3842 5.3842 5.5889 5.5889 6.1034 6.1034 6.1729 6.1729 6.3122 6.3122 6.5450 6.5450 7.1636 7.1636 7.1892 7.1892 7.4200 7.4200 9.2988 9.2988 9.7275 9.7275 9.7534 9.7534 9.8249 9.8249 k = 0.0000 0.0000 0.8585 ( 5320 PWs) bands (ev): -7.4882 -7.4882 -6.5768 -6.5768 -6.5360 -6.5360 -6.4900 -6.4900 -1.6929 -1.6929 0.5380 0.5380 0.9183 0.9183 1.5945 1.5945 2.0114 2.0114 2.6725 2.6725 2.9638 2.9638 3.0489 3.0489 3.0928 3.0928 3.2576 3.2576 3.2656 3.2656 3.2713 3.2713 4.6487 4.6487 4.6908 4.6908 4.8147 4.8147 4.9054 4.9054 4.9344 4.9344 5.2371 5.2371 5.4257 5.4257 5.7760 5.7760 5.9872 5.9872 6.3531 6.3531 6.6015 6.6015 7.2060 7.2060 7.2865 7.2865 7.4939 7.4939 7.6221 7.6221 8.4020 8.4020 10.0041 10.0041 10.6448 10.6448 11.4573 11.4573 k = 0.0167 0.0119 0.8585 ( 5314 PWs) bands (ev): -7.4882 -7.4882 -6.5767 -6.5767 -6.5361 -6.5361 -6.4900 -6.4900 -1.6928 -1.6928 0.5397 0.5397 0.9176 0.9176 1.5844 1.5844 2.0214 2.0214 2.6745 2.6745 2.9626 2.9626 3.0490 3.0490 3.0927 3.0927 3.2571 3.2571 3.2649 3.2649 3.2712 3.2712 4.6488 4.6488 4.6907 4.6907 4.8153 4.8153 4.9054 4.9054 4.9344 4.9344 5.2371 5.2371 5.4266 5.4266 5.7763 5.7763 5.9851 5.9851 6.3527 6.3527 6.6023 6.6023 7.2041 7.2041 7.2859 7.2859 7.4940 7.4940 7.6215 7.6215 8.4051 8.4051 10.0087 10.0087 10.6437 10.6437 11.4562 11.4562 k = 0.0333 0.0239 0.8585 ( 5324 PWs) bands (ev): -7.4882 -7.4882 -6.5763 -6.5763 -6.5364 -6.5364 -6.4900 -6.4900 -1.6925 -1.6925 0.5446 0.5446 0.9157 0.9157 1.5565 1.5565 2.0488 2.0488 2.6804 2.6804 2.9591 2.9591 3.0490 3.0490 3.0924 3.0924 3.2547 3.2547 3.2634 3.2634 3.2710 3.2710 4.6491 4.6491 4.6901 4.6901 4.8170 4.8170 4.9052 4.9052 4.9344 4.9344 5.2368 5.2368 5.4292 5.4292 5.7768 5.7768 5.9788 5.9788 6.3514 6.3514 6.6046 6.6046 7.1981 7.1981 7.2843 7.2843 7.4944 7.4944 7.6194 7.6194 8.4141 8.4141 10.0226 10.0226 10.6403 10.6403 11.4528 11.4528 k = 0.0500 0.0358 0.8585 ( 5318 PWs) bands (ev): -7.4882 -7.4882 -6.5758 -6.5758 -6.5370 -6.5370 -6.4900 -6.4900 -1.6920 -1.6920 0.5529 0.5529 0.9125 0.9125 1.5164 1.5164 2.0883 2.0883 2.6902 2.6902 2.9532 2.9532 3.0491 3.0491 3.0918 3.0918 3.2494 3.2494 3.2624 3.2624 3.2708 3.2708 4.6496 4.6496 4.6893 4.6893 4.8197 4.8197 4.9050 4.9050 4.9344 4.9344 5.2366 5.2366 5.4336 5.4336 5.7777 5.7777 5.9687 5.9687 6.3493 6.3493 6.6084 6.6084 7.1879 7.1879 7.2824 7.2824 7.4949 7.4949 7.6162 7.6162 8.4287 8.4287 10.0455 10.0455 10.6347 10.6347 11.4465 11.4465 k = 0.0667 0.0478 0.8585 ( 5326 PWs) bands (ev): -7.4882 -7.4882 -6.5751 -6.5751 -6.5377 -6.5377 -6.4901 -6.4901 -1.6914 -1.6914 0.5644 0.5644 0.9083 0.9083 1.4686 1.4686 2.1351 2.1351 2.7036 2.7036 2.9449 2.9449 3.0494 3.0494 3.0911 3.0911 3.2408 3.2408 3.2619 3.2619 3.2705 3.2705 4.6503 4.6503 4.6881 4.6881 4.8234 4.8234 4.9047 4.9047 4.9344 4.9344 5.2362 5.2362 5.4398 5.4398 5.7788 5.7788 5.9547 5.9547 6.3466 6.3466 6.6136 6.6136 7.1734 7.1734 7.2809 7.2809 7.4958 7.4958 7.6119 7.6119 8.4480 8.4480 10.0770 10.0770 10.6272 10.6272 11.4366 11.4366 k = 0.0833 0.0597 0.8585 ( 5318 PWs) bands (ev): -7.4881 -7.4881 -6.5741 -6.5741 -6.5387 -6.5387 -6.4901 -6.4901 -1.6907 -1.6907 0.5791 0.5791 0.9033 0.9033 1.4165 1.4165 2.1860 2.1860 2.7204 2.7204 2.9341 2.9341 3.0498 3.0498 3.0901 3.0901 3.2294 3.2294 3.2619 3.2619 3.2701 3.2701 4.6511 4.6511 4.6867 4.6867 4.8279 4.8279 4.9044 4.9044 4.9344 4.9344 5.2358 5.2358 5.4479 5.4479 5.7801 5.7801 5.9373 5.9373 6.3432 6.3432 6.6203 6.6203 7.1550 7.1550 7.2800 7.2800 7.4969 7.4969 7.6067 7.6067 8.4709 8.4709 10.1168 10.1168 10.6179 10.6179 11.4219 11.4219 k = 0.1000 0.0717 0.8585 ( 5322 PWs) bands (ev): -7.4881 -7.4881 -6.5730 -6.5730 -6.5399 -6.5399 -6.4902 -6.4902 -1.6898 -1.6898 0.5971 0.5971 0.8977 0.8977 1.3621 1.3621 2.2388 2.2388 2.7402 2.7402 2.9207 2.9207 3.0503 3.0503 3.0890 3.0890 3.2154 3.2154 3.2620 3.2620 3.2697 3.2697 4.6521 4.6521 4.6851 4.6851 4.8330 4.8330 4.9040 4.9040 4.9343 4.9343 5.2353 5.2353 5.4580 5.4580 5.7813 5.7813 5.9170 5.9170 6.3394 6.3394 6.6283 6.6283 7.1335 7.1335 7.2797 7.2797 7.4983 7.4983 7.6008 7.6008 8.4965 8.4965 10.1641 10.1641 10.6071 10.6071 11.4006 11.4006 k = 0.1167 0.0836 0.8585 ( 5318 PWs) bands (ev): -7.4881 -7.4881 -6.5717 -6.5717 -6.5412 -6.5412 -6.4902 -6.4902 -1.6889 -1.6889 0.6182 0.6182 0.8917 0.8917 1.3066 1.3066 2.2922 2.2922 2.7626 2.7626 2.9048 2.9048 3.0509 3.0509 3.0879 3.0879 3.1990 3.1990 3.2622 3.2622 3.2693 3.2693 4.6533 4.6533 4.6833 4.6833 4.8386 4.8386 4.9034 4.9034 4.9342 4.9342 5.2348 5.2348 5.4700 5.4700 5.7821 5.7821 5.8945 5.8945 6.3354 6.3354 6.6376 6.6376 7.1098 7.1098 7.2800 7.2800 7.5000 7.5000 7.5945 7.5945 8.5235 8.5235 10.2184 10.2184 10.5953 10.5953 11.3712 11.3712 k = 0.1333 0.0955 0.8585 ( 5310 PWs) bands (ev): -7.4881 -7.4881 -6.5702 -6.5702 -6.5427 -6.5427 -6.4903 -6.4903 -1.6880 -1.6880 0.6424 0.6424 0.8857 0.8857 1.2510 1.2510 2.3455 2.3455 2.7871 2.7871 2.8865 2.8865 3.0517 3.0517 3.0866 3.0866 3.1803 3.1803 3.2624 3.2624 3.2689 3.2689 4.6547 4.6547 4.6815 4.6815 4.8445 4.8445 4.9028 4.9028 4.9341 4.9341 5.2343 5.2343 5.4842 5.4842 5.7818 5.7818 5.8708 5.8708 6.3312 6.3312 6.6479 6.6479 7.0849 7.0849 7.2807 7.2807 7.5019 7.5019 7.5881 7.5881 8.5507 8.5507 10.2790 10.2790 10.5831 10.5831 11.3322 11.3322 k = 0.1500 0.1075 0.8585 ( 5320 PWs) bands (ev): -7.4880 -7.4880 -6.5686 -6.5686 -6.5444 -6.5444 -6.4904 -6.4904 -1.6871 -1.6871 0.6696 0.6696 0.8798 0.8798 1.1958 1.1958 2.3979 2.3979 2.8125 2.8125 2.8664 2.8664 3.0525 3.0525 3.0853 3.0853 3.1594 3.1594 3.2627 3.2627 3.2683 3.2684 4.6562 4.6562 4.6795 4.6795 4.8504 4.8504 4.9020 4.9020 4.9339 4.9339 5.2338 5.2338 5.5004 5.5004 5.7788 5.7788 5.8478 5.8478 6.3271 6.3271 6.6591 6.6591 7.0597 7.0597 7.2817 7.2817 7.5039 7.5039 7.5815 7.5815 8.5771 8.5771 10.3448 10.3448 10.5712 10.5712 11.2828 11.2828 k = 0.1667 0.1194 0.8585 ( 5320 PWs) bands (ev): -7.4880 -7.4880 -6.5669 -6.5669 -6.5461 -6.5461 -6.4904 -6.4904 -1.6863 -1.6863 0.6998 0.6998 0.8744 0.8744 1.1415 1.1415 2.4489 2.4489 2.8284 2.8284 2.8547 2.8547 3.0534 3.0534 3.0839 3.0839 3.1367 3.1367 3.2631 3.2631 3.2679 3.2679 4.6577 4.6577 4.6774 4.6774 4.8562 4.8562 4.9011 4.9011 4.9336 4.9336 5.2334 5.2334 5.5188 5.5188 5.7700 5.7700 5.8292 5.8292 6.3233 6.3233 6.6707 6.6707 7.0353 7.0353 7.2827 7.2827 7.5062 7.5062 7.5753 7.5753 8.6015 8.6015 10.4143 10.4143 10.5610 10.5610 11.2233 11.2233 k = 0.1833 0.1314 0.8585 ( 5320 PWs) bands (ev): -7.4880 -7.4880 -6.5651 -6.5651 -6.5480 -6.5480 -6.4905 -6.4905 -1.6855 -1.6855 0.7327 0.7327 0.8697 0.8697 1.0884 1.0884 2.4983 2.4983 2.8092 2.8092 2.8766 2.8766 3.0542 3.0542 3.0823 3.0823 3.1124 3.1124 3.2634 3.2635 3.2674 3.2674 4.6594 4.6594 4.6753 4.6753 4.8616 4.8616 4.9000 4.9000 4.9334 4.9334 5.2330 5.2330 5.5392 5.5392 5.7523 5.7523 5.8184 5.8184 6.3199 6.3199 6.6821 6.6821 7.0127 7.0127 7.2837 7.2837 7.5085 7.5085 7.5695 7.5695 8.6230 8.6230 10.4825 10.4825 10.5576 10.5576 11.1552 11.1552 k = 0.2000 0.1433 0.8585 ( 5322 PWs) bands (ev): -7.4880 -7.4880 -6.5632 -6.5632 -6.5499 -6.5499 -6.4905 -6.4905 -1.6849 -1.6849 0.7684 0.7684 0.8659 0.8659 1.0369 1.0369 2.5457 2.5457 2.7806 2.7806 2.9058 2.9058 3.0547 3.0547 3.0785 3.0785 3.0891 3.0891 3.2638 3.2638 3.2669 3.2669 4.6612 4.6612 4.6732 4.6732 4.8664 4.8664 4.8988 4.8988 4.9332 4.9332 5.2327 5.2327 5.5616 5.5616 5.7278 5.7278 5.8139 5.8139 6.3170 6.3170 6.6927 6.6927 6.9930 6.9930 7.2846 7.2846 7.5108 7.5108 7.5645 7.5645 8.6408 8.6408 10.5189 10.5189 10.5911 10.5911 11.0803 11.0803 k = 0.2167 0.1552 0.8585 ( 5300 PWs) bands (ev): -7.4879 -7.4879 -6.5613 -6.5613 -6.5518 -6.5518 -6.4906 -6.4906 -1.6844 -1.6844 0.8065 0.8065 0.8633 0.8633 0.9871 0.9871 2.5908 2.5908 2.7487 2.7487 2.9362 2.9362 3.0513 3.0513 3.0606 3.0606 3.0825 3.0825 3.2643 3.2643 3.2664 3.2664 4.6631 4.6631 4.6711 4.6711 4.8704 4.8704 4.8978 4.8978 4.9330 4.9330 5.2325 5.2325 5.5857 5.5857 5.7005 5.7005 5.8123 5.8123 6.3149 6.3149 6.7016 6.7016 6.9775 6.9775 7.2854 7.2854 7.5127 7.5127 7.5606 7.5606 8.6540 8.6540 10.5202 10.5202 10.6643 10.6643 11.0007 11.0007 k = 0.2333 0.1672 0.8585 ( 5292 PWs) bands (ev): -7.4879 -7.4879 -6.5596 -6.5596 -6.5535 -6.5535 -6.4906 -6.4906 -1.6842 -1.6842 0.8449 0.8449 0.8638 0.8638 0.9395 0.9395 2.6330 2.6330 2.7144 2.7144 2.9668 2.9668 3.0266 3.0266 3.0574 3.0574 3.0815 3.0815 3.2647 3.2647 3.2660 3.2660 4.6649 4.6649 4.6691 4.6691 4.8730 4.8730 4.8969 4.8969 4.9329 4.9329 5.2324 5.2324 5.6105 5.6105 5.6732 5.6732 5.8118 5.8118 6.3136 6.3136 6.7076 6.7076 6.9675 6.9675 7.2858 7.2858 7.5140 7.5140 7.5581 7.5581 8.6622 8.6622 10.5177 10.5177 10.7450 10.7450 10.9190 10.9190 k = 0.2500 0.1791 0.8585 ( 5284 PWs) bands (ev): -7.4879 -7.4879 -6.5587 -6.5587 -6.5544 -6.5544 -6.4906 -6.4906 -1.6841 -1.6841 0.8571 0.8571 0.8902 0.8902 0.8981 0.8981 2.6636 2.6636 2.6864 2.6864 2.9970 2.9970 2.9973 2.9974 3.0573 3.0573 3.0813 3.0813 3.2650 3.2650 3.2657 3.2657 4.6661 4.6661 4.6680 4.6680 4.8740 4.8740 4.8965 4.8965 4.9329 4.9329 5.2324 5.2324 5.6276 5.6276 5.6551 5.6551 5.8117 5.8117 6.3131 6.3131 6.7097 6.7097 6.9640 6.9640 7.2860 7.2860 7.5144 7.5144 7.5573 7.5573 8.6650 8.6650 10.5167 10.5167 10.8107 10.8107 10.8530 10.8530 Writing output data file FeCu2GeS4.save init_run : 1.65s CPU 0.99s WALL ( 1 calls) electrons : 456.13s CPU 330.04s WALL ( 1 calls) Called by init_run: wfcinit : 0.02s CPU 0.02s WALL ( 1 calls) potinit : 0.20s CPU 0.17s WALL ( 1 calls) Called by electrons: c_bands : 456.12s CPU 330.02s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.53s CPU 0.28s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.65s CPU 0.61s WALL ( 289 calls) cegterg : 377.90s CPU 286.51s WALL ( 293 calls) Called by sum_band: Called by *egterg: h_psi : 309.41s CPU 196.10s WALL ( 5662 calls) s_psi : 17.92s CPU 13.49s WALL ( 5662 calls) g_psi : 0.29s CPU 0.34s WALL ( 5080 calls) cdiaghg : 86.89s CPU 83.87s WALL ( 5369 calls) cegterg:over : 11.62s CPU 10.98s WALL ( 5080 calls) cegterg:upda : 10.02s CPU 9.39s WALL ( 5080 calls) cegterg:last : 4.08s CPU 4.16s WALL ( 871 calls) cdiaghg:chol : 5.21s CPU 4.88s WALL ( 5369 calls) cdiaghg:inve : 3.51s CPU 3.50s WALL ( 5369 calls) cdiaghg:para : 6.15s CPU 6.12s WALL ( 10738 calls) Called by h_psi: h_psi:vloc : 271.17s CPU 166.86s WALL ( 5662 calls) h_psi:vnl : 37.83s CPU 28.90s WALL ( 5662 calls) add_vuspsi : 21.97s CPU 16.62s WALL ( 5662 calls) General routines calbec : 15.81s CPU 12.26s WALL ( 5662 calls) fft : 0.08s CPU 0.04s WALL ( 19 calls) ffts : 0.03s CPU 0.02s WALL ( 4 calls) fftw : 260.42s CPU 158.68s WALL ( 882772 calls) interpolate : 0.04s CPU 0.02s WALL ( 4 calls) davcio : 0.26s CPU 1.51s WALL ( 578 calls) Parallel routines fft_scatter : 83.97s CPU 62.49s WALL ( 882795 calls) PWSCF : 8m 1.04s CPU 6m11.03s WALL This run was terminated on: 15:53: 6 10Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=