Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18:14:29 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Li4FeN2.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 90 90 25 2374 2374 346 Max 91 91 26 2377 2377 348 Sum 3275 3275 907 85531 85531 12487 bravais-lattice index = 14 lattice parameter (alat) = 9.9853 a.u. unit-cell volume = 604.9821 (a.u.)^3 number of atoms/cell = 7 number of atomic types = 3 number of electrons = 30.00 number of Kohn-Sham states= 38 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 412.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.985283 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.753513 celldm(5)= -0.263506 celldm(6)= 0.017018 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.017018 0.999855 0.000000 ) a(3) = ( -0.263506 -0.749137 0.607749 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.017021 0.412596 ) b(2) = ( 0.000000 1.000145 1.232820 ) b(3) = ( 0.000000 0.000000 1.645416 ) PseudoPot. # 1 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. # 2 for Li read from file: /users/gautes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Fe 8.00 55.84500 Fe( 1.00) Li 3.00 6.94100 Li( 1.00) N 5.00 14.00670 N( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 393 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025445 k( 2) = ( -0.0058602 0.0059608 0.0144491), wk = 0.0025445 k( 3) = ( -0.0117204 0.0119216 0.0288983), wk = 0.0025445 k( 4) = ( -0.0175806 0.0178824 0.0433474), wk = 0.0025445 k( 5) = ( -0.0234408 0.0238432 0.0577966), wk = 0.0025445 k( 6) = ( -0.0293010 0.0298040 0.0722457), wk = 0.0025445 k( 7) = ( -0.0351612 0.0357648 0.0866949), wk = 0.0025445 k( 8) = ( -0.0410214 0.0417256 0.1011440), wk = 0.0025445 k( 9) = ( -0.0468816 0.0476864 0.1155932), wk = 0.0025445 k( 10) = ( -0.0527418 0.0536472 0.1300423), wk = 0.0025445 k( 11) = ( -0.0586020 0.0596080 0.1444915), wk = 0.0025445 k( 12) = ( -0.0644622 0.0655687 0.1589406), wk = 0.0025445 k( 13) = ( -0.0703224 0.0715296 0.1733898), wk = 0.0025445 k( 14) = ( -0.0761826 0.0774903 0.1878389), wk = 0.0025445 k( 15) = ( -0.0820428 0.0834511 0.2022880), wk = 0.0025445 k( 16) = ( -0.0879030 0.0894119 0.2167372), wk = 0.0025445 k( 17) = ( -0.0937632 0.0953727 0.2311863), wk = 0.0025445 k( 18) = ( -0.0996234 0.1013335 0.2456355), wk = 0.0025445 k( 19) = ( -0.1054836 0.1072943 0.2600846), wk = 0.0025445 k( 20) = ( -0.1113438 0.1132551 0.2745338), wk = 0.0025445 k( 21) = ( -0.1172040 0.1192159 0.2889829), wk = 0.0025445 k( 22) = ( -0.1230642 0.1251767 0.3034321), wk = 0.0025445 k( 23) = ( -0.1289244 0.1311375 0.3178812), wk = 0.0025445 k( 24) = ( -0.1347847 0.1370983 0.3323304), wk = 0.0025445 k( 25) = ( -0.1406448 0.1430591 0.3467795), wk = 0.0025445 k( 26) = ( -0.1465050 0.1490199 0.3612286), wk = 0.0025445 k( 27) = ( -0.1523653 0.1549807 0.3756778), wk = 0.0025445 k( 28) = ( -0.1582255 0.1609415 0.3901270), wk = 0.0025445 k( 29) = ( -0.1640857 0.1669023 0.4045761), wk = 0.0025445 k( 30) = ( -0.1699459 0.1728631 0.4190252), wk = 0.0025445 k( 31) = ( -0.1758061 0.1788239 0.4334744), wk = 0.0025445 k( 32) = ( -0.1816663 0.1847847 0.4479235), wk = 0.0025445 k( 33) = ( -0.1875265 0.1907455 0.4623727), wk = 0.0025445 k( 34) = ( -0.1933867 0.1967063 0.4768218), wk = 0.0025445 k( 35) = ( -0.1992469 0.2026670 0.4912710), wk = 0.0025445 k( 36) = ( -0.2051071 0.2086278 0.5057201), wk = 0.0025445 k( 37) = ( -0.2109673 0.2145886 0.5201693), wk = 0.0025445 k( 38) = ( -0.2168275 0.2205494 0.5346184), wk = 0.0025445 k( 39) = ( -0.2226877 0.2265102 0.5490676), wk = 0.0025445 k( 40) = ( -0.2285479 0.2324710 0.5635167), wk = 0.0025445 k( 41) = ( -0.2344081 0.2384318 0.5779658), wk = 0.0025445 k( 42) = ( -0.2402683 0.2443926 0.5924150), wk = 0.0025445 k( 43) = ( -0.2461285 0.2503534 0.6068641), wk = 0.0025445 k( 44) = ( -0.2519887 0.2563142 0.6213133), wk = 0.0025445 k( 45) = ( -0.2578489 0.2622750 0.6357624), wk = 0.0025445 k( 46) = ( -0.2637091 0.2682358 0.6502116), wk = 0.0025445 k( 47) = ( -0.2695693 0.2741966 0.6646607), wk = 0.0025445 k( 48) = ( -0.2754295 0.2801574 0.6791099), wk = 0.0025445 k( 49) = ( -0.2812897 0.2861182 0.6935590), wk = 0.0025445 k( 50) = ( -0.2871499 0.2920790 0.7080082), wk = 0.0025445 k( 51) = ( -0.2930101 0.2980398 0.7224573), wk = 0.0025445 k( 52) = ( -0.2988703 0.3040006 0.7369065), wk = 0.0025445 k( 53) = ( -0.3047305 0.3099614 0.7513556), wk = 0.0025445 k( 54) = ( -0.3105907 0.3159222 0.7658047), wk = 0.0025445 k( 55) = ( -0.3105907 0.3159222 0.7658047), wk = 0.0025445 k( 56) = ( -0.3007397 0.3059020 0.7739338), wk = 0.0025445 k( 57) = ( -0.2908886 0.2958818 0.7820628), wk = 0.0025445 k( 58) = ( -0.2810375 0.2858617 0.7901918), wk = 0.0025445 k( 59) = ( -0.2711865 0.2758415 0.7983208), wk = 0.0025445 k( 60) = ( -0.2613354 0.2658214 0.8064498), wk = 0.0025445 k( 61) = ( -0.2514843 0.2558012 0.8145788), wk = 0.0025445 k( 62) = ( -0.2416333 0.2457810 0.8227079), wk = 0.0025445 k( 63) = ( -0.2416333 0.2457810 0.8227079), wk = 0.0025445 k( 64) = ( -0.2301269 0.2340772 0.8227079), wk = 0.0025445 k( 65) = ( -0.2186206 0.2223733 0.8227079), wk = 0.0025445 k( 66) = ( -0.2071142 0.2106695 0.8227079), wk = 0.0025445 k( 67) = ( -0.1956079 0.1989656 0.8227079), wk = 0.0025445 k( 68) = ( -0.1841016 0.1872617 0.8227079), wk = 0.0025445 k( 69) = ( -0.1725952 0.1755579 0.8227079), wk = 0.0025445 k( 70) = ( -0.1610889 0.1638540 0.8227079), wk = 0.0025445 k( 71) = ( -0.1495825 0.1521502 0.8227079), wk = 0.0025445 k( 72) = ( -0.1380762 0.1404463 0.8227079), wk = 0.0025445 k( 73) = ( -0.1265698 0.1287424 0.8227079), wk = 0.0025445 k( 74) = ( -0.1150635 0.1170386 0.8227079), wk = 0.0025445 k( 75) = ( -0.1035571 0.1053347 0.8227078), wk = 0.0025445 k( 76) = ( -0.0920508 0.0936309 0.8227079), wk = 0.0025445 k( 77) = ( -0.0805444 0.0819270 0.8227079), wk = 0.0025445 k( 78) = ( -0.0690381 0.0702232 0.8227079), wk = 0.0025445 k( 79) = ( -0.0575317 0.0585193 0.8227079), wk = 0.0025445 k( 80) = ( -0.0460254 0.0468154 0.8227079), wk = 0.0025445 k( 81) = ( -0.0345190 0.0351116 0.8227079), wk = 0.0025445 k( 82) = ( -0.0230127 0.0234077 0.8227078), wk = 0.0025445 k( 83) = ( -0.0115064 0.0117039 0.8227079), wk = 0.0025445 k( 84) = ( 0.0000000 0.0000000 0.8227079), wk = 0.0025445 k( 85) = ( 0.0000000 0.0000000 0.8227079), wk = 0.0025445 k( 86) = ( 0.0119048 0.0117039 0.8227079), wk = 0.0025445 k( 87) = ( 0.0238095 0.0234077 0.8227079), wk = 0.0025445 k( 88) = ( 0.0357143 0.0351116 0.8227079), wk = 0.0025445 k( 89) = ( 0.0476191 0.0468154 0.8227079), wk = 0.0025445 k( 90) = ( 0.0595238 0.0585193 0.8227079), wk = 0.0025445 k( 91) = ( 0.0714286 0.0702232 0.8227079), wk = 0.0025445 k( 92) = ( 0.0833333 0.0819270 0.8227079), wk = 0.0025445 k( 93) = ( 0.0952381 0.0936309 0.8227079), wk = 0.0025445 k( 94) = ( 0.1071429 0.1053347 0.8227079), wk = 0.0025445 k( 95) = ( 0.1190476 0.1170386 0.8227079), wk = 0.0025445 k( 96) = ( 0.1309524 0.1287424 0.8227079), wk = 0.0025445 k( 97) = ( 0.1428571 0.1404463 0.8227079), wk = 0.0025445 k( 98) = ( 0.1547619 0.1521502 0.8227079), wk = 0.0025445 k( 99) = ( 0.1666667 0.1638540 0.8227079), wk = 0.0025445 k( 100) = ( 0.1785714 0.1755579 0.8227079), wk = 0.0025445 k( 101) = ( 0.1904762 0.1872617 0.8227079), wk = 0.0025445 k( 102) = ( 0.2023810 0.1989656 0.8227079), wk = 0.0025445 k( 103) = ( 0.2142857 0.2106695 0.8227079), wk = 0.0025445 k( 104) = ( 0.2261905 0.2223733 0.8227079), wk = 0.0025445 k( 105) = ( 0.2380952 0.2340772 0.8227079), wk = 0.0025445 k( 106) = ( 0.2500000 0.2457810 0.8227079), wk = 0.0025445 k( 107) = ( 0.2500000 0.2457810 0.8227079), wk = 0.0025445 k( 108) = ( 0.2400000 0.2559527 0.8144559), wk = 0.0025445 k( 109) = ( 0.2300000 0.2661244 0.8062040), wk = 0.0025445 k( 110) = ( 0.2200000 0.2762960 0.7979521), wk = 0.0025445 k( 111) = ( 0.2100000 0.2864677 0.7897002), wk = 0.0025445 k( 112) = ( 0.2000000 0.2966393 0.7814483), wk = 0.0025445 k( 113) = ( 0.1900000 0.3068110 0.7731963), wk = 0.0025445 k( 114) = ( 0.1800000 0.3169826 0.7649444), wk = 0.0025445 k( 115) = ( 0.1700000 0.3271543 0.7566925), wk = 0.0025445 k( 116) = ( 0.1600000 0.3373259 0.7484406), wk = 0.0025445 k( 117) = ( 0.1500000 0.3474976 0.7401887), wk = 0.0025445 k( 118) = ( 0.1400000 0.3576692 0.7319368), wk = 0.0025445 k( 119) = ( 0.1300000 0.3678409 0.7236848), wk = 0.0025445 k( 120) = ( 0.1200000 0.3780126 0.7154329), wk = 0.0025445 k( 121) = ( 0.1100000 0.3881842 0.7071810), wk = 0.0025445 k( 122) = ( 0.1000000 0.3983559 0.6989291), wk = 0.0025445 k( 123) = ( 0.0900000 0.4085275 0.6906772), wk = 0.0025445 k( 124) = ( 0.0800000 0.4186992 0.6824252), wk = 0.0025445 k( 125) = ( 0.0700000 0.4288708 0.6741733), wk = 0.0025445 k( 126) = ( 0.0600000 0.4390425 0.6659214), wk = 0.0025445 k( 127) = ( 0.0500000 0.4492141 0.6576695), wk = 0.0025445 k( 128) = ( 0.0400000 0.4593858 0.6494176), wk = 0.0025445 k( 129) = ( 0.0300000 0.4695575 0.6411656), wk = 0.0025445 k( 130) = ( 0.0200000 0.4797291 0.6329137), wk = 0.0025445 k( 131) = ( 0.0100000 0.4899008 0.6246618), wk = 0.0025445 k( 132) = ( 0.0000000 0.5000724 0.6164099), wk = 0.0025445 k( 133) = ( 0.0000000 0.5000724 0.6164099), wk = 0.0025445 k( 134) = ( 0.0129413 0.5077453 0.6101851), wk = 0.0025445 k( 135) = ( 0.0258826 0.5154183 0.6039603), wk = 0.0025445 k( 136) = ( 0.0388238 0.5230912 0.5977355), wk = 0.0025445 k( 137) = ( 0.0517651 0.5307641 0.5915107), wk = 0.0025445 k( 138) = ( 0.0647064 0.5384371 0.5852860), wk = 0.0025445 k( 139) = ( 0.0776477 0.5461100 0.5790612), wk = 0.0025445 k( 140) = ( 0.0905890 0.5537829 0.5728364), wk = 0.0025445 k( 141) = ( 0.1035302 0.5614558 0.5666116), wk = 0.0025445 k( 142) = ( 0.1164715 0.5691288 0.5603868), wk = 0.0025445 k( 143) = ( 0.1294128 0.5768017 0.5541620), wk = 0.0025445 k( 144) = ( 0.1423541 0.5844746 0.5479372), wk = 0.0025445 k( 145) = ( 0.1552954 0.5921475 0.5417125), wk = 0.0025445 k( 146) = ( 0.1682366 0.5998205 0.5354877), wk = 0.0025445 k( 147) = ( 0.1811779 0.6074934 0.5292629), wk = 0.0025445 k( 148) = ( 0.1941192 0.6151663 0.5230381), wk = 0.0025445 k( 149) = ( 0.2070605 0.6228393 0.5168133), wk = 0.0025445 k( 150) = ( 0.2200017 0.6305122 0.5105885), wk = 0.0025445 k( 151) = ( 0.2329430 0.6381851 0.5043638), wk = 0.0025445 k( 152) = ( 0.2458843 0.6458580 0.4981390), wk = 0.0025445 k( 153) = ( 0.2588256 0.6535310 0.4919142), wk = 0.0025445 k( 154) = ( 0.2717669 0.6612039 0.4856894), wk = 0.0025445 k( 155) = ( 0.2847081 0.6688768 0.4794646), wk = 0.0025445 k( 156) = ( 0.2976494 0.6765498 0.4732398), wk = 0.0025445 k( 157) = ( 0.3105907 0.6842227 0.4670150), wk = 0.0025445 k( 158) = ( 0.3105907 0.6842227 0.4670150), wk = 0.0025445 k( 159) = ( 0.3163304 0.6783845 0.4528631), wk = 0.0025445 k( 160) = ( 0.3220701 0.6725463 0.4387111), wk = 0.0025445 k( 161) = ( 0.3278097 0.6667081 0.4245591), wk = 0.0025445 k( 162) = ( 0.3335494 0.6608699 0.4104072), wk = 0.0025445 k( 163) = ( 0.3392891 0.6550317 0.3962552), wk = 0.0025445 k( 164) = ( 0.3450288 0.6491935 0.3821032), wk = 0.0025445 k( 165) = ( 0.3507684 0.6433553 0.3679512), wk = 0.0025445 k( 166) = ( 0.3565081 0.6375171 0.3537993), wk = 0.0025445 k( 167) = ( 0.3622478 0.6316789 0.3396473), wk = 0.0025445 k( 168) = ( 0.3679875 0.6258407 0.3254953), wk = 0.0025445 k( 169) = ( 0.3737271 0.6200025 0.3113434), wk = 0.0025445 k( 170) = ( 0.3794668 0.6141643 0.2971914), wk = 0.0025445 k( 171) = ( 0.3852065 0.6083261 0.2830394), wk = 0.0025445 k( 172) = ( 0.3909462 0.6024879 0.2688874), wk = 0.0025445 k( 173) = ( 0.3966858 0.5966497 0.2547355), wk = 0.0025445 k( 174) = ( 0.4024255 0.5908115 0.2405835), wk = 0.0025445 k( 175) = ( 0.4081652 0.5849733 0.2264315), wk = 0.0025445 k( 176) = ( 0.4139049 0.5791351 0.2122796), wk = 0.0025445 k( 177) = ( 0.4196445 0.5732969 0.1981276), wk = 0.0025445 k( 178) = ( 0.4253842 0.5674587 0.1839756), wk = 0.0025445 k( 179) = ( 0.4311239 0.5616205 0.1698237), wk = 0.0025445 k( 180) = ( 0.4368636 0.5557823 0.1556717), wk = 0.0025445 k( 181) = ( 0.4426033 0.5499441 0.1415197), wk = 0.0025445 k( 182) = ( 0.4483429 0.5441059 0.1273677), wk = 0.0025445 k( 183) = ( 0.4540826 0.5382677 0.1132158), wk = 0.0025445 k( 184) = ( 0.4598223 0.5324295 0.0990638), wk = 0.0025445 k( 185) = ( 0.4655620 0.5265913 0.0849118), wk = 0.0025445 k( 186) = ( 0.4713016 0.5207531 0.0707599), wk = 0.0025445 k( 187) = ( 0.4770413 0.5149149 0.0566079), wk = 0.0025445 k( 188) = ( 0.4827810 0.5090767 0.0424559), wk = 0.0025445 k( 189) = ( 0.4885207 0.5032385 0.0283039), wk = 0.0025445 k( 190) = ( 0.4942603 0.4974003 0.0141520), wk = 0.0025445 k( 191) = ( 0.5000000 0.4915621 0.0000000), wk = 0.0025445 k( 192) = ( 0.5000000 0.4915621 0.0000000), wk = 0.0025445 k( 193) = ( 0.4880952 0.4798582 0.0000000), wk = 0.0025445 k( 194) = ( 0.4761905 0.4681544 0.0000000), wk = 0.0025445 k( 195) = ( 0.4642857 0.4564505 0.0000000), wk = 0.0025445 k( 196) = ( 0.4523810 0.4447466 0.0000000), wk = 0.0025445 k( 197) = ( 0.4404762 0.4330428 0.0000000), wk = 0.0025445 k( 198) = ( 0.4285714 0.4213389 0.0000000), wk = 0.0025445 k( 199) = ( 0.4166667 0.4096351 0.0000000), wk = 0.0025445 k( 200) = ( 0.4047619 0.3979312 0.0000000), wk = 0.0025445 k( 201) = ( 0.3928571 0.3862273 0.0000000), wk = 0.0025445 k( 202) = ( 0.3809524 0.3745235 0.0000000), wk = 0.0025445 k( 203) = ( 0.3690476 0.3628196 0.0000000), wk = 0.0025445 k( 204) = ( 0.3571429 0.3511158 0.0000000), wk = 0.0025445 k( 205) = ( 0.3452381 0.3394119 0.0000000), wk = 0.0025445 k( 206) = ( 0.3333333 0.3277081 0.0000000), wk = 0.0025445 k( 207) = ( 0.3214286 0.3160042 0.0000000), wk = 0.0025445 k( 208) = ( 0.3095238 0.3043003 0.0000000), wk = 0.0025445 k( 209) = ( 0.2976190 0.2925965 0.0000000), wk = 0.0025445 k( 210) = ( 0.2857143 0.2808926 0.0000000), wk = 0.0025445 k( 211) = ( 0.2738095 0.2691888 0.0000000), wk = 0.0025445 k( 212) = ( 0.2619048 0.2574849 0.0000000), wk = 0.0025445 k( 213) = ( 0.2500000 0.2457810 0.0000000), wk = 0.0025445 k( 214) = ( 0.2380952 0.2340772 0.0000000), wk = 0.0025445 k( 215) = ( 0.2261905 0.2223733 0.0000000), wk = 0.0025445 k( 216) = ( 0.2142857 0.2106695 0.0000000), wk = 0.0025445 k( 217) = ( 0.2023810 0.1989656 0.0000000), wk = 0.0025445 k( 218) = ( 0.1904762 0.1872617 0.0000000), wk = 0.0025445 k( 219) = ( 0.1785714 0.1755579 0.0000000), wk = 0.0025445 k( 220) = ( 0.1666667 0.1638540 0.0000000), wk = 0.0025445 k( 221) = ( 0.1547619 0.1521502 0.0000000), wk = 0.0025445 k( 222) = ( 0.1428571 0.1404463 0.0000000), wk = 0.0025445 k( 223) = ( 0.1309524 0.1287424 0.0000000), wk = 0.0025445 k( 224) = ( 0.1190476 0.1170386 0.0000000), wk = 0.0025445 k( 225) = ( 0.1071429 0.1053347 0.0000000), wk = 0.0025445 k( 226) = ( 0.0952381 0.0936309 0.0000000), wk = 0.0025445 k( 227) = ( 0.0833333 0.0819270 0.0000000), wk = 0.0025445 k( 228) = ( 0.0714286 0.0702232 0.0000000), wk = 0.0025445 k( 229) = ( 0.0595238 0.0585193 0.0000000), wk = 0.0025445 k( 230) = ( 0.0476191 0.0468154 0.0000000), wk = 0.0025445 k( 231) = ( 0.0357143 0.0351116 0.0000000), wk = 0.0025445 k( 232) = ( 0.0238095 0.0234077 0.0000000), wk = 0.0025445 k( 233) = ( 0.0119048 0.0117039 0.0000000), wk = 0.0025445 k( 234) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025445 k( 235) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025445 k( 236) = ( 0.0100243 -0.0101963 0.0082719), wk = 0.0025445 k( 237) = ( 0.0200485 -0.0203926 0.0165439), wk = 0.0025445 k( 238) = ( 0.0300727 -0.0305890 0.0248158), wk = 0.0025445 k( 239) = ( 0.0400970 -0.0407853 0.0330877), wk = 0.0025445 k( 240) = ( 0.0501212 -0.0509816 0.0413596), wk = 0.0025445 k( 241) = ( 0.0601455 -0.0611779 0.0496316), wk = 0.0025445 k( 242) = ( 0.0701697 -0.0713742 0.0579035), wk = 0.0025445 k( 243) = ( 0.0801940 -0.0815705 0.0661754), wk = 0.0025445 k( 244) = ( 0.0902182 -0.0917669 0.0744473), wk = 0.0025445 k( 245) = ( 0.1002425 -0.1019632 0.0827193), wk = 0.0025445 k( 246) = ( 0.1102667 -0.1121595 0.0909912), wk = 0.0025445 k( 247) = ( 0.1202909 -0.1223558 0.0992631), wk = 0.0025445 k( 248) = ( 0.1303152 -0.1325521 0.1075350), wk = 0.0025445 k( 249) = ( 0.1403394 -0.1427484 0.1158070), wk = 0.0025445 k( 250) = ( 0.1503637 -0.1529448 0.1240789), wk = 0.0025445 k( 251) = ( 0.1603879 -0.1631411 0.1323508), wk = 0.0025445 k( 252) = ( 0.1704122 -0.1733374 0.1406227), wk = 0.0025445 k( 253) = ( 0.1804364 -0.1835337 0.1488947), wk = 0.0025445 k( 254) = ( 0.1904607 -0.1937300 0.1571666), wk = 0.0025445 k( 255) = ( 0.2004849 -0.2039263 0.1654385), wk = 0.0025445 k( 256) = ( 0.2105092 -0.2141227 0.1737104), wk = 0.0025445 k( 257) = ( 0.2205334 -0.2243190 0.1819824), wk = 0.0025445 k( 258) = ( 0.2305577 -0.2345153 0.1902543), wk = 0.0025445 k( 259) = ( 0.2405819 -0.2447116 0.1985262), wk = 0.0025445 k( 260) = ( 0.2506062 -0.2549079 0.2067982), wk = 0.0025445 k( 261) = ( 0.2606304 -0.2651042 0.2150701), wk = 0.0025445 k( 262) = ( 0.2706546 -0.2753006 0.2233420), wk = 0.0025445 k( 263) = ( 0.2806789 -0.2854969 0.2316139), wk = 0.0025445 k( 264) = ( 0.2907031 -0.2956932 0.2398859), wk = 0.0025445 k( 265) = ( 0.3007274 -0.3058895 0.2481578), wk = 0.0025445 k( 266) = ( 0.3107516 -0.3160858 0.2564297), wk = 0.0025445 k( 267) = ( 0.3207759 -0.3262822 0.2647016), wk = 0.0025445 k( 268) = ( 0.3308001 -0.3364785 0.2729736), wk = 0.0025445 k( 269) = ( 0.3408244 -0.3466748 0.2812455), wk = 0.0025445 k( 270) = ( 0.3508486 -0.3568711 0.2895174), wk = 0.0025445 k( 271) = ( 0.3608729 -0.3670674 0.2977893), wk = 0.0025445 k( 272) = ( 0.3708971 -0.3772637 0.3060613), wk = 0.0025445 k( 273) = ( 0.3809213 -0.3874601 0.3143332), wk = 0.0025445 k( 274) = ( 0.3909456 -0.3976564 0.3226051), wk = 0.0025445 k( 275) = ( 0.4009698 -0.4078527 0.3308770), wk = 0.0025445 k( 276) = ( 0.4109941 -0.4180490 0.3391490), wk = 0.0025445 k( 277) = ( 0.4210183 -0.4282453 0.3474209), wk = 0.0025445 k( 278) = ( 0.4310426 -0.4384416 0.3556928), wk = 0.0025445 k( 279) = ( 0.4310426 -0.4384416 0.3556928), wk = 0.0025445 k( 280) = ( 0.4335053 -0.4230869 0.3503573), wk = 0.0025445 k( 281) = ( 0.4359681 -0.4077323 0.3450218), wk = 0.0025445 k( 282) = ( 0.4384309 -0.3923776 0.3396862), wk = 0.0025445 k( 283) = ( 0.4408936 -0.3770229 0.3343507), wk = 0.0025445 k( 284) = ( 0.4433564 -0.3616682 0.3290152), wk = 0.0025445 k( 285) = ( 0.4458192 -0.3463135 0.3236796), wk = 0.0025445 k( 286) = ( 0.4482819 -0.3309588 0.3183441), wk = 0.0025445 k( 287) = ( 0.4507447 -0.3156041 0.3130086), wk = 0.0025445 k( 288) = ( 0.4532075 -0.3002494 0.3076730), wk = 0.0025445 k( 289) = ( 0.4556702 -0.2848947 0.3023375), wk = 0.0025445 k( 290) = ( 0.4581330 -0.2695401 0.2970020), wk = 0.0025445 k( 291) = ( 0.4605958 -0.2541854 0.2916664), wk = 0.0025445 k( 292) = ( 0.4630585 -0.2388307 0.2863309), wk = 0.0025445 k( 293) = ( 0.4655213 -0.2234760 0.2809954), wk = 0.0025445 k( 294) = ( 0.4679840 -0.2081213 0.2756599), wk = 0.0025445 k( 295) = ( 0.4704468 -0.1927666 0.2703243), wk = 0.0025445 k( 296) = ( 0.4729096 -0.1774119 0.2649888), wk = 0.0025445 k( 297) = ( 0.4753723 -0.1620572 0.2596533), wk = 0.0025445 k( 298) = ( 0.4778351 -0.1467025 0.2543177), wk = 0.0025445 k( 299) = ( 0.4802979 -0.1313479 0.2489822), wk = 0.0025445 k( 300) = ( 0.4827606 -0.1159932 0.2436467), wk = 0.0025445 k( 301) = ( 0.4852234 -0.1006385 0.2383111), wk = 0.0025445 k( 302) = ( 0.4876862 -0.0852838 0.2329756), wk = 0.0025445 k( 303) = ( 0.4901489 -0.0699291 0.2276401), wk = 0.0025445 k( 304) = ( 0.4926117 -0.0545744 0.2223046), wk = 0.0025445 k( 305) = ( 0.4950745 -0.0392197 0.2169690), wk = 0.0025445 k( 306) = ( 0.4975372 -0.0238650 0.2116335), wk = 0.0025445 k( 307) = ( 0.5000000 -0.0085103 0.2062980), wk = 0.0025445 k( 308) = ( 0.5000000 -0.0085103 0.2062980), wk = 0.0025445 k( 309) = ( 0.4941860 -0.0025966 0.2206331), wk = 0.0025445 k( 310) = ( 0.4883721 0.0033172 0.2349682), wk = 0.0025445 k( 311) = ( 0.4825581 0.0092309 0.2493033), wk = 0.0025445 k( 312) = ( 0.4767442 0.0151447 0.2636384), wk = 0.0025445 k( 313) = ( 0.4709302 0.0210584 0.2779735), wk = 0.0025445 k( 314) = ( 0.4651163 0.0269722 0.2923086), wk = 0.0025445 k( 315) = ( 0.4593023 0.0328859 0.3066437), wk = 0.0025445 k( 316) = ( 0.4534884 0.0387997 0.3209789), wk = 0.0025445 k( 317) = ( 0.4476744 0.0447134 0.3353140), wk = 0.0025445 k( 318) = ( 0.4418605 0.0506272 0.3496491), wk = 0.0025445 k( 319) = ( 0.4360465 0.0565409 0.3639842), wk = 0.0025445 k( 320) = ( 0.4302326 0.0624547 0.3783193), wk = 0.0025445 k( 321) = ( 0.4244186 0.0683685 0.3926545), wk = 0.0025445 k( 322) = ( 0.4186047 0.0742822 0.4069896), wk = 0.0025445 k( 323) = ( 0.4127907 0.0801960 0.4213247), wk = 0.0025445 k( 324) = ( 0.4069767 0.0861097 0.4356598), wk = 0.0025445 k( 325) = ( 0.4011628 0.0920235 0.4499949), wk = 0.0025445 k( 326) = ( 0.3953488 0.0979372 0.4643300), wk = 0.0025445 k( 327) = ( 0.3895349 0.1038510 0.4786651), wk = 0.0025445 k( 328) = ( 0.3837209 0.1097647 0.4930002), wk = 0.0025445 k( 329) = ( 0.3779070 0.1156785 0.5073353), wk = 0.0025445 k( 330) = ( 0.3720930 0.1215922 0.5216705), wk = 0.0025445 k( 331) = ( 0.3662791 0.1275060 0.5360056), wk = 0.0025445 k( 332) = ( 0.3604651 0.1334197 0.5503407), wk = 0.0025445 k( 333) = ( 0.3546512 0.1393335 0.5646758), wk = 0.0025445 k( 334) = ( 0.3488372 0.1452472 0.5790109), wk = 0.0025445 k( 335) = ( 0.3430233 0.1511610 0.5933460), wk = 0.0025445 k( 336) = ( 0.3372093 0.1570747 0.6076812), wk = 0.0025445 k( 337) = ( 0.3313953 0.1629885 0.6220163), wk = 0.0025445 k( 338) = ( 0.3255814 0.1689022 0.6363514), wk = 0.0025445 k( 339) = ( 0.3197674 0.1748160 0.6506865), wk = 0.0025445 k( 340) = ( 0.3139535 0.1807298 0.6650216), wk = 0.0025445 k( 341) = ( 0.3081395 0.1866435 0.6793567), wk = 0.0025445 k( 342) = ( 0.3023256 0.1925573 0.6936918), wk = 0.0025445 k( 343) = ( 0.2965116 0.1984710 0.7080269), wk = 0.0025445 k( 344) = ( 0.2906977 0.2043848 0.7223621), wk = 0.0025445 k( 345) = ( 0.2848837 0.2102985 0.7366972), wk = 0.0025445 k( 346) = ( 0.2790698 0.2162123 0.7510323), wk = 0.0025445 k( 347) = ( 0.2732558 0.2221260 0.7653674), wk = 0.0025445 k( 348) = ( 0.2674419 0.2280398 0.7797025), wk = 0.0025445 k( 349) = ( 0.2616279 0.2339535 0.7940376), wk = 0.0025445 k( 350) = ( 0.2558140 0.2398673 0.8083728), wk = 0.0025445 k( 351) = ( 0.2500000 0.2457810 0.8227079), wk = 0.0025445 k( 352) = ( 0.2416333 -0.2457810 0.8227079), wk = 0.0025445 k( 353) = ( 0.2473730 -0.2516192 0.8085559), wk = 0.0025445 k( 354) = ( 0.2531126 -0.2574574 0.7944039), wk = 0.0025445 k( 355) = ( 0.2588523 -0.2632956 0.7802519), wk = 0.0025445 k( 356) = ( 0.2645920 -0.2691338 0.7661000), wk = 0.0025445 k( 357) = ( 0.2703317 -0.2749720 0.7519480), wk = 0.0025445 k( 358) = ( 0.2760713 -0.2808102 0.7377960), wk = 0.0025445 k( 359) = ( 0.2818110 -0.2866484 0.7236441), wk = 0.0025445 k( 360) = ( 0.2875507 -0.2924866 0.7094921), wk = 0.0025445 k( 361) = ( 0.2932904 -0.2983248 0.6953401), wk = 0.0025445 k( 362) = ( 0.2990300 -0.3041630 0.6811882), wk = 0.0025445 k( 363) = ( 0.3047697 -0.3100012 0.6670362), wk = 0.0025445 k( 364) = ( 0.3105094 -0.3158394 0.6528842), wk = 0.0025445 k( 365) = ( 0.3162491 -0.3216776 0.6387322), wk = 0.0025445 k( 366) = ( 0.3219887 -0.3275158 0.6245803), wk = 0.0025445 k( 367) = ( 0.3277284 -0.3333540 0.6104283), wk = 0.0025445 k( 368) = ( 0.3334681 -0.3391922 0.5962763), wk = 0.0025445 k( 369) = ( 0.3392078 -0.3450304 0.5821244), wk = 0.0025445 k( 370) = ( 0.3449474 -0.3508686 0.5679724), wk = 0.0025445 k( 371) = ( 0.3506871 -0.3567068 0.5538204), wk = 0.0025445 k( 372) = ( 0.3564268 -0.3625450 0.5396684), wk = 0.0025445 k( 373) = ( 0.3621665 -0.3683832 0.5255165), wk = 0.0025445 k( 374) = ( 0.3679061 -0.3742214 0.5113645), wk = 0.0025445 k( 375) = ( 0.3736458 -0.3800596 0.4972125), wk = 0.0025445 k( 376) = ( 0.3793855 -0.3858978 0.4830606), wk = 0.0025445 k( 377) = ( 0.3851252 -0.3917360 0.4689086), wk = 0.0025445 k( 378) = ( 0.3908648 -0.3975742 0.4547566), wk = 0.0025445 k( 379) = ( 0.3966045 -0.4034124 0.4406046), wk = 0.0025445 k( 380) = ( 0.4023442 -0.4092506 0.4264527), wk = 0.0025445 k( 381) = ( 0.4080839 -0.4150888 0.4123007), wk = 0.0025445 k( 382) = ( 0.4138235 -0.4209270 0.3981487), wk = 0.0025445 k( 383) = ( 0.4195632 -0.4267652 0.3839968), wk = 0.0025445 k( 384) = ( 0.4253029 -0.4326034 0.3698448), wk = 0.0025445 k( 385) = ( 0.4310426 -0.4384416 0.3556928), wk = 0.0025445 k( 386) = ( 0.5689574 0.4214210 0.0569031), wk = 0.0025445 k( 387) = ( 0.5591064 0.4314411 0.0487741), wk = 0.0025445 k( 388) = ( 0.5492553 0.4414613 0.0406451), wk = 0.0025445 k( 389) = ( 0.5394043 0.4514814 0.0325161), wk = 0.0025445 k( 390) = ( 0.5295532 0.4615016 0.0243870), wk = 0.0025445 k( 391) = ( 0.5197021 0.4715218 0.0162580), wk = 0.0025445 k( 392) = ( 0.5098511 0.4815419 0.0081290), wk = 0.0025445 k( 393) = ( 0.5000000 0.4915621 0.0000000), wk = 0.0025445 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025445 k( 2) = ( -0.0058602 0.0058602 0.0058602), wk = 0.0025445 k( 3) = ( -0.0117204 0.0117204 0.0117204), wk = 0.0025445 k( 4) = ( -0.0175806 0.0175806 0.0175806), wk = 0.0025445 k( 5) = ( -0.0234408 0.0234408 0.0234408), wk = 0.0025445 k( 6) = ( -0.0293010 0.0293010 0.0293010), wk = 0.0025445 k( 7) = ( -0.0351612 0.0351612 0.0351612), wk = 0.0025445 k( 8) = ( -0.0410214 0.0410214 0.0410214), wk = 0.0025445 k( 9) = ( -0.0468816 0.0468816 0.0468816), wk = 0.0025445 k( 10) = ( -0.0527418 0.0527418 0.0527418), wk = 0.0025445 k( 11) = ( -0.0586020 0.0586020 0.0586020), wk = 0.0025445 k( 12) = ( -0.0644622 0.0644622 0.0644622), wk = 0.0025445 k( 13) = ( -0.0703224 0.0703224 0.0703224), wk = 0.0025445 k( 14) = ( -0.0761826 0.0761826 0.0761826), wk = 0.0025445 k( 15) = ( -0.0820428 0.0820428 0.0820428), wk = 0.0025445 k( 16) = ( -0.0879030 0.0879030 0.0879030), wk = 0.0025445 k( 17) = ( -0.0937632 0.0937632 0.0937632), wk = 0.0025445 k( 18) = ( -0.0996234 0.0996234 0.0996234), wk = 0.0025445 k( 19) = ( -0.1054836 0.1054836 0.1054836), wk = 0.0025445 k( 20) = ( -0.1113438 0.1113438 0.1113438), wk = 0.0025445 k( 21) = ( -0.1172040 0.1172040 0.1172040), wk = 0.0025445 k( 22) = ( -0.1230642 0.1230642 0.1230642), wk = 0.0025445 k( 23) = ( -0.1289244 0.1289244 0.1289244), wk = 0.0025445 k( 24) = ( -0.1347847 0.1347847 0.1347847), wk = 0.0025445 k( 25) = ( -0.1406448 0.1406448 0.1406448), wk = 0.0025445 k( 26) = ( -0.1465050 0.1465050 0.1465050), wk = 0.0025445 k( 27) = ( -0.1523653 0.1523653 0.1523652), wk = 0.0025445 k( 28) = ( -0.1582255 0.1582255 0.1582255), wk = 0.0025445 k( 29) = ( -0.1640857 0.1640857 0.1640857), wk = 0.0025445 k( 30) = ( -0.1699459 0.1699459 0.1699459), wk = 0.0025445 k( 31) = ( -0.1758061 0.1758061 0.1758061), wk = 0.0025445 k( 32) = ( -0.1816663 0.1816663 0.1816663), wk = 0.0025445 k( 33) = ( -0.1875265 0.1875265 0.1875265), wk = 0.0025445 k( 34) = ( -0.1933867 0.1933867 0.1933867), wk = 0.0025445 k( 35) = ( -0.1992469 0.1992469 0.1992469), wk = 0.0025445 k( 36) = ( -0.2051071 0.2051071 0.2051071), wk = 0.0025445 k( 37) = ( -0.2109673 0.2109673 0.2109673), wk = 0.0025445 k( 38) = ( -0.2168275 0.2168275 0.2168275), wk = 0.0025445 k( 39) = ( -0.2226877 0.2226877 0.2226877), wk = 0.0025445 k( 40) = ( -0.2285479 0.2285479 0.2285479), wk = 0.0025445 k( 41) = ( -0.2344081 0.2344081 0.2344081), wk = 0.0025445 k( 42) = ( -0.2402683 0.2402683 0.2402683), wk = 0.0025445 k( 43) = ( -0.2461285 0.2461285 0.2461285), wk = 0.0025445 k( 44) = ( -0.2519887 0.2519887 0.2519887), wk = 0.0025445 k( 45) = ( -0.2578489 0.2578489 0.2578489), wk = 0.0025445 k( 46) = ( -0.2637091 0.2637091 0.2637091), wk = 0.0025445 k( 47) = ( -0.2695693 0.2695693 0.2695693), wk = 0.0025445 k( 48) = ( -0.2754295 0.2754295 0.2754295), wk = 0.0025445 k( 49) = ( -0.2812897 0.2812897 0.2812897), wk = 0.0025445 k( 50) = ( -0.2871499 0.2871499 0.2871499), wk = 0.0025445 k( 51) = ( -0.2930101 0.2930101 0.2930101), wk = 0.0025445 k( 52) = ( -0.2988703 0.2988703 0.2988703), wk = 0.0025445 k( 53) = ( -0.3047305 0.3047305 0.3047305), wk = 0.0025445 k( 54) = ( -0.3105907 0.3105907 0.3105907), wk = 0.0025445 k( 55) = ( -0.3105907 0.3105907 0.3105907), wk = 0.0025445 k( 56) = ( -0.3007397 0.3007397 0.3204418), wk = 0.0025445 k( 57) = ( -0.2908886 0.2908886 0.3302928), wk = 0.0025445 k( 58) = ( -0.2810375 0.2810375 0.3401439), wk = 0.0025445 k( 59) = ( -0.2711865 0.2711865 0.3499950), wk = 0.0025445 k( 60) = ( -0.2613354 0.2613354 0.3598460), wk = 0.0025445 k( 61) = ( -0.2514843 0.2514843 0.3696971), wk = 0.0025445 k( 62) = ( -0.2416333 0.2416333 0.3795481), wk = 0.0025445 k( 63) = ( -0.2416333 0.2416333 0.3795481), wk = 0.0025445 k( 64) = ( -0.2301269 0.2301269 0.3852839), wk = 0.0025445 k( 65) = ( -0.2186206 0.2186206 0.3910197), wk = 0.0025445 k( 66) = ( -0.2071142 0.2071142 0.3967556), wk = 0.0025445 k( 67) = ( -0.1956079 0.1956079 0.4024913), wk = 0.0025445 k( 68) = ( -0.1841016 0.1841015 0.4082271), wk = 0.0025445 k( 69) = ( -0.1725952 0.1725952 0.4139630), wk = 0.0025445 k( 70) = ( -0.1610889 0.1610889 0.4196988), wk = 0.0025445 k( 71) = ( -0.1495825 0.1495825 0.4254346), wk = 0.0025445 k( 72) = ( -0.1380762 0.1380762 0.4311704), wk = 0.0025445 k( 73) = ( -0.1265698 0.1265698 0.4369062), wk = 0.0025445 k( 74) = ( -0.1150635 0.1150635 0.4426420), wk = 0.0025445 k( 75) = ( -0.1035571 0.1035571 0.4483778), wk = 0.0025445 k( 76) = ( -0.0920508 0.0920508 0.4541136), wk = 0.0025445 k( 77) = ( -0.0805444 0.0805444 0.4598494), wk = 0.0025445 k( 78) = ( -0.0690381 0.0690381 0.4655852), wk = 0.0025445 k( 79) = ( -0.0575317 0.0575317 0.4713210), wk = 0.0025445 k( 80) = ( -0.0460254 0.0460254 0.4770568), wk = 0.0025445 k( 81) = ( -0.0345190 0.0345190 0.4827926), wk = 0.0025445 k( 82) = ( -0.0230127 0.0230127 0.4885284), wk = 0.0025445 k( 83) = ( -0.0115064 0.0115064 0.4942642), wk = 0.0025445 k( 84) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025445 k( 85) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025445 k( 86) = ( 0.0119048 0.0119048 0.4880952), wk = 0.0025445 k( 87) = ( 0.0238095 0.0238095 0.4761905), wk = 0.0025445 k( 88) = ( 0.0357143 0.0357143 0.4642857), wk = 0.0025445 k( 89) = ( 0.0476191 0.0476191 0.4523809), wk = 0.0025445 k( 90) = ( 0.0595238 0.0595238 0.4404762), wk = 0.0025445 k( 91) = ( 0.0714286 0.0714286 0.4285714), wk = 0.0025445 k( 92) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0025445 k( 93) = ( 0.0952381 0.0952381 0.4047619), wk = 0.0025445 k( 94) = ( 0.1071429 0.1071429 0.3928571), wk = 0.0025445 k( 95) = ( 0.1190476 0.1190476 0.3809524), wk = 0.0025445 k( 96) = ( 0.1309524 0.1309524 0.3690476), wk = 0.0025445 k( 97) = ( 0.1428571 0.1428571 0.3571429), wk = 0.0025445 k( 98) = ( 0.1547619 0.1547619 0.3452381), wk = 0.0025445 k( 99) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0025445 k( 100) = ( 0.1785714 0.1785714 0.3214286), wk = 0.0025445 k( 101) = ( 0.1904762 0.1904762 0.3095238), wk = 0.0025445 k( 102) = ( 0.2023810 0.2023810 0.2976190), wk = 0.0025445 k( 103) = ( 0.2142857 0.2142857 0.2857143), wk = 0.0025445 k( 104) = ( 0.2261905 0.2261905 0.2738095), wk = 0.0025445 k( 105) = ( 0.2380952 0.2380952 0.2619048), wk = 0.0025445 k( 106) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0025445 k( 107) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0025445 k( 108) = ( 0.2400000 0.2600000 0.2400000), wk = 0.0025445 k( 109) = ( 0.2300000 0.2700000 0.2300000), wk = 0.0025445 k( 110) = ( 0.2200000 0.2800000 0.2200000), wk = 0.0025445 k( 111) = ( 0.2100000 0.2900000 0.2100000), wk = 0.0025445 k( 112) = ( 0.2000000 0.3000000 0.2000000), wk = 0.0025445 k( 113) = ( 0.1900000 0.3100000 0.1900000), wk = 0.0025445 k( 114) = ( 0.1800000 0.3200000 0.1800000), wk = 0.0025445 k( 115) = ( 0.1700000 0.3300000 0.1700000), wk = 0.0025445 k( 116) = ( 0.1600000 0.3400000 0.1600000), wk = 0.0025445 k( 117) = ( 0.1500000 0.3500000 0.1500000), wk = 0.0025445 k( 118) = ( 0.1400000 0.3600000 0.1400000), wk = 0.0025445 k( 119) = ( 0.1300000 0.3700000 0.1300000), wk = 0.0025445 k( 120) = ( 0.1200000 0.3800000 0.1200000), wk = 0.0025445 k( 121) = ( 0.1100000 0.3900000 0.1100000), wk = 0.0025445 k( 122) = ( 0.1000000 0.4000000 0.1000000), wk = 0.0025445 k( 123) = ( 0.0900000 0.4100000 0.0900000), wk = 0.0025445 k( 124) = ( 0.0800000 0.4200000 0.0800000), wk = 0.0025445 k( 125) = ( 0.0700000 0.4300000 0.0700000), wk = 0.0025445 k( 126) = ( 0.0600000 0.4400000 0.0600000), wk = 0.0025445 k( 127) = ( 0.0500000 0.4500000 0.0500000), wk = 0.0025445 k( 128) = ( 0.0400000 0.4600000 0.0400000), wk = 0.0025445 k( 129) = ( 0.0300000 0.4700000 0.0300000), wk = 0.0025445 k( 130) = ( 0.0200000 0.4800000 0.0200000), wk = 0.0025445 k( 131) = ( 0.0100000 0.4900000 0.0100000), wk = 0.0025445 k( 132) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025445 k( 133) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025445 k( 134) = ( 0.0129413 0.5078921 -0.0129413), wk = 0.0025445 k( 135) = ( 0.0258826 0.5157841 -0.0258826), wk = 0.0025445 k( 136) = ( 0.0388238 0.5236762 -0.0388238), wk = 0.0025445 k( 137) = ( 0.0517651 0.5315682 -0.0517651), wk = 0.0025445 k( 138) = ( 0.0647064 0.5394603 -0.0647064), wk = 0.0025445 k( 139) = ( 0.0776477 0.5473523 -0.0776477), wk = 0.0025445 k( 140) = ( 0.0905890 0.5552444 -0.0905890), wk = 0.0025445 k( 141) = ( 0.1035302 0.5631364 -0.1035302), wk = 0.0025445 k( 142) = ( 0.1164715 0.5710285 -0.1164715), wk = 0.0025445 k( 143) = ( 0.1294128 0.5789205 -0.1294128), wk = 0.0025445 k( 144) = ( 0.1423541 0.5868126 -0.1423541), wk = 0.0025445 k( 145) = ( 0.1552954 0.5947046 -0.1552954), wk = 0.0025445 k( 146) = ( 0.1682366 0.6025967 -0.1682366), wk = 0.0025445 k( 147) = ( 0.1811779 0.6104888 -0.1811779), wk = 0.0025445 k( 148) = ( 0.1941192 0.6183808 -0.1941192), wk = 0.0025445 k( 149) = ( 0.2070605 0.6262729 -0.2070605), wk = 0.0025445 k( 150) = ( 0.2200017 0.6341649 -0.2200018), wk = 0.0025445 k( 151) = ( 0.2329430 0.6420570 -0.2329430), wk = 0.0025445 k( 152) = ( 0.2458843 0.6499490 -0.2458843), wk = 0.0025445 k( 153) = ( 0.2588256 0.6578411 -0.2588256), wk = 0.0025445 k( 154) = ( 0.2717669 0.6657331 -0.2717669), wk = 0.0025445 k( 155) = ( 0.2847081 0.6736252 -0.2847081), wk = 0.0025445 k( 156) = ( 0.2976494 0.6815172 -0.2976494), wk = 0.0025445 k( 157) = ( 0.3105907 0.6894093 -0.3105907), wk = 0.0025445 k( 158) = ( 0.3105907 0.6894093 -0.3105907), wk = 0.0025445 k( 159) = ( 0.3163304 0.6836696 -0.3163304), wk = 0.0025445 k( 160) = ( 0.3220701 0.6779299 -0.3220701), wk = 0.0025445 k( 161) = ( 0.3278097 0.6721903 -0.3278097), wk = 0.0025445 k( 162) = ( 0.3335494 0.6664506 -0.3335494), wk = 0.0025445 k( 163) = ( 0.3392891 0.6607109 -0.3392891), wk = 0.0025445 k( 164) = ( 0.3450288 0.6549712 -0.3450288), wk = 0.0025445 k( 165) = ( 0.3507684 0.6492316 -0.3507684), wk = 0.0025445 k( 166) = ( 0.3565081 0.6434919 -0.3565081), wk = 0.0025445 k( 167) = ( 0.3622478 0.6377522 -0.3622478), wk = 0.0025445 k( 168) = ( 0.3679875 0.6320125 -0.3679875), wk = 0.0025445 k( 169) = ( 0.3737271 0.6262729 -0.3737271), wk = 0.0025445 k( 170) = ( 0.3794668 0.6205332 -0.3794668), wk = 0.0025445 k( 171) = ( 0.3852065 0.6147935 -0.3852065), wk = 0.0025445 k( 172) = ( 0.3909462 0.6090538 -0.3909462), wk = 0.0025445 k( 173) = ( 0.3966858 0.6033142 -0.3966858), wk = 0.0025445 k( 174) = ( 0.4024255 0.5975745 -0.4024255), wk = 0.0025445 k( 175) = ( 0.4081652 0.5918348 -0.4081652), wk = 0.0025445 k( 176) = ( 0.4139049 0.5860951 -0.4139049), wk = 0.0025445 k( 177) = ( 0.4196445 0.5803555 -0.4196445), wk = 0.0025445 k( 178) = ( 0.4253842 0.5746158 -0.4253842), wk = 0.0025445 k( 179) = ( 0.4311239 0.5688761 -0.4311239), wk = 0.0025445 k( 180) = ( 0.4368636 0.5631364 -0.4368636), wk = 0.0025445 k( 181) = ( 0.4426033 0.5573968 -0.4426033), wk = 0.0025445 k( 182) = ( 0.4483429 0.5516571 -0.4483429), wk = 0.0025445 k( 183) = ( 0.4540826 0.5459174 -0.4540826), wk = 0.0025445 k( 184) = ( 0.4598223 0.5401777 -0.4598223), wk = 0.0025445 k( 185) = ( 0.4655620 0.5344380 -0.4655620), wk = 0.0025445 k( 186) = ( 0.4713016 0.5286984 -0.4713016), wk = 0.0025445 k( 187) = ( 0.4770413 0.5229587 -0.4770413), wk = 0.0025445 k( 188) = ( 0.4827810 0.5172190 -0.4827810), wk = 0.0025445 k( 189) = ( 0.4885207 0.5114794 -0.4885207), wk = 0.0025445 k( 190) = ( 0.4942603 0.5057397 -0.4942603), wk = 0.0025445 k( 191) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0025445 k( 192) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0025445 k( 193) = ( 0.4880952 0.4880952 -0.4880952), wk = 0.0025445 k( 194) = ( 0.4761905 0.4761905 -0.4761905), wk = 0.0025445 k( 195) = ( 0.4642857 0.4642857 -0.4642857), wk = 0.0025445 k( 196) = ( 0.4523810 0.4523809 -0.4523810), wk = 0.0025445 k( 197) = ( 0.4404762 0.4404762 -0.4404762), wk = 0.0025445 k( 198) = ( 0.4285714 0.4285714 -0.4285714), wk = 0.0025445 k( 199) = ( 0.4166667 0.4166667 -0.4166667), wk = 0.0025445 k( 200) = ( 0.4047619 0.4047619 -0.4047619), wk = 0.0025445 k( 201) = ( 0.3928571 0.3928571 -0.3928571), wk = 0.0025445 k( 202) = ( 0.3809524 0.3809524 -0.3809524), wk = 0.0025445 k( 203) = ( 0.3690476 0.3690476 -0.3690476), wk = 0.0025445 k( 204) = ( 0.3571429 0.3571429 -0.3571429), wk = 0.0025445 k( 205) = ( 0.3452381 0.3452381 -0.3452381), wk = 0.0025445 k( 206) = ( 0.3333333 0.3333333 -0.3333333), wk = 0.0025445 k( 207) = ( 0.3214286 0.3214286 -0.3214286), wk = 0.0025445 k( 208) = ( 0.3095238 0.3095238 -0.3095238), wk = 0.0025445 k( 209) = ( 0.2976190 0.2976190 -0.2976190), wk = 0.0025445 k( 210) = ( 0.2857143 0.2857143 -0.2857143), wk = 0.0025445 k( 211) = ( 0.2738095 0.2738095 -0.2738095), wk = 0.0025445 k( 212) = ( 0.2619048 0.2619048 -0.2619048), wk = 0.0025445 k( 213) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0025445 k( 214) = ( 0.2380952 0.2380952 -0.2380952), wk = 0.0025445 k( 215) = ( 0.2261905 0.2261905 -0.2261905), wk = 0.0025445 k( 216) = ( 0.2142857 0.2142857 -0.2142857), wk = 0.0025445 k( 217) = ( 0.2023810 0.2023810 -0.2023810), wk = 0.0025445 k( 218) = ( 0.1904762 0.1904762 -0.1904762), wk = 0.0025445 k( 219) = ( 0.1785714 0.1785714 -0.1785714), wk = 0.0025445 k( 220) = ( 0.1666667 0.1666667 -0.1666667), wk = 0.0025445 k( 221) = ( 0.1547619 0.1547619 -0.1547619), wk = 0.0025445 k( 222) = ( 0.1428571 0.1428571 -0.1428571), wk = 0.0025445 k( 223) = ( 0.1309524 0.1309524 -0.1309524), wk = 0.0025445 k( 224) = ( 0.1190476 0.1190476 -0.1190476), wk = 0.0025445 k( 225) = ( 0.1071429 0.1071429 -0.1071429), wk = 0.0025445 k( 226) = ( 0.0952381 0.0952381 -0.0952381), wk = 0.0025445 k( 227) = ( 0.0833333 0.0833333 -0.0833333), wk = 0.0025445 k( 228) = ( 0.0714286 0.0714286 -0.0714286), wk = 0.0025445 k( 229) = ( 0.0595238 0.0595238 -0.0595238), wk = 0.0025445 k( 230) = ( 0.0476191 0.0476191 -0.0476191), wk = 0.0025445 k( 231) = ( 0.0357143 0.0357143 -0.0357143), wk = 0.0025445 k( 232) = ( 0.0238095 0.0238095 -0.0238095), wk = 0.0025445 k( 233) = ( 0.0119048 0.0119048 -0.0119048), wk = 0.0025445 k( 234) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025445 k( 235) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025445 k( 236) = ( 0.0100243 -0.0100243 0.0100242), wk = 0.0025445 k( 237) = ( 0.0200485 -0.0200485 0.0200485), wk = 0.0025445 k( 238) = ( 0.0300727 -0.0300727 0.0300727), wk = 0.0025445 k( 239) = ( 0.0400970 -0.0400970 0.0400970), wk = 0.0025445 k( 240) = ( 0.0501212 -0.0501212 0.0501212), wk = 0.0025445 k( 241) = ( 0.0601455 -0.0601455 0.0601455), wk = 0.0025445 k( 242) = ( 0.0701697 -0.0701697 0.0701697), wk = 0.0025445 k( 243) = ( 0.0801940 -0.0801940 0.0801940), wk = 0.0025445 k( 244) = ( 0.0902182 -0.0902182 0.0902182), wk = 0.0025445 k( 245) = ( 0.1002425 -0.1002425 0.1002425), wk = 0.0025445 k( 246) = ( 0.1102667 -0.1102667 0.1102667), wk = 0.0025445 k( 247) = ( 0.1202909 -0.1202909 0.1202909), wk = 0.0025445 k( 248) = ( 0.1303152 -0.1303152 0.1303152), wk = 0.0025445 k( 249) = ( 0.1403394 -0.1403394 0.1403394), wk = 0.0025445 k( 250) = ( 0.1503637 -0.1503637 0.1503637), wk = 0.0025445 k( 251) = ( 0.1603879 -0.1603879 0.1603879), wk = 0.0025445 k( 252) = ( 0.1704122 -0.1704122 0.1704122), wk = 0.0025445 k( 253) = ( 0.1804364 -0.1804364 0.1804364), wk = 0.0025445 k( 254) = ( 0.1904607 -0.1904607 0.1904607), wk = 0.0025445 k( 255) = ( 0.2004849 -0.2004849 0.2004849), wk = 0.0025445 k( 256) = ( 0.2105092 -0.2105092 0.2105092), wk = 0.0025445 k( 257) = ( 0.2205334 -0.2205334 0.2205334), wk = 0.0025445 k( 258) = ( 0.2305577 -0.2305576 0.2305576), wk = 0.0025445 k( 259) = ( 0.2405819 -0.2405819 0.2405819), wk = 0.0025445 k( 260) = ( 0.2506062 -0.2506062 0.2506062), wk = 0.0025445 k( 261) = ( 0.2606304 -0.2606304 0.2606304), wk = 0.0025445 k( 262) = ( 0.2706546 -0.2706546 0.2706546), wk = 0.0025445 k( 263) = ( 0.2806789 -0.2806789 0.2806789), wk = 0.0025445 k( 264) = ( 0.2907031 -0.2907031 0.2907031), wk = 0.0025445 k( 265) = ( 0.3007274 -0.3007274 0.3007274), wk = 0.0025445 k( 266) = ( 0.3107516 -0.3107516 0.3107516), wk = 0.0025445 k( 267) = ( 0.3207759 -0.3207759 0.3207759), wk = 0.0025445 k( 268) = ( 0.3308001 -0.3308001 0.3308001), wk = 0.0025445 k( 269) = ( 0.3408244 -0.3408244 0.3408244), wk = 0.0025445 k( 270) = ( 0.3508486 -0.3508486 0.3508486), wk = 0.0025445 k( 271) = ( 0.3608729 -0.3608728 0.3608729), wk = 0.0025445 k( 272) = ( 0.3708971 -0.3708971 0.3708971), wk = 0.0025445 k( 273) = ( 0.3809213 -0.3809213 0.3809213), wk = 0.0025445 k( 274) = ( 0.3909456 -0.3909456 0.3909456), wk = 0.0025445 k( 275) = ( 0.4009698 -0.4009698 0.4009698), wk = 0.0025445 k( 276) = ( 0.4109941 -0.4109941 0.4109941), wk = 0.0025445 k( 277) = ( 0.4210183 -0.4210183 0.4210183), wk = 0.0025445 k( 278) = ( 0.4310426 -0.4310426 0.4310426), wk = 0.0025445 k( 279) = ( 0.4310426 -0.4310426 0.4310426), wk = 0.0025445 k( 280) = ( 0.4335053 -0.4156482 0.4156482), wk = 0.0025445 k( 281) = ( 0.4359681 -0.4002538 0.4002538), wk = 0.0025445 k( 282) = ( 0.4384309 -0.3848594 0.3848594), wk = 0.0025445 k( 283) = ( 0.4408936 -0.3694651 0.3694651), wk = 0.0025445 k( 284) = ( 0.4433564 -0.3540707 0.3540707), wk = 0.0025445 k( 285) = ( 0.4458192 -0.3386763 0.3386763), wk = 0.0025445 k( 286) = ( 0.4482819 -0.3232819 0.3232819), wk = 0.0025445 k( 287) = ( 0.4507447 -0.3078875 0.3078875), wk = 0.0025445 k( 288) = ( 0.4532075 -0.2924932 0.2924932), wk = 0.0025445 k( 289) = ( 0.4556702 -0.2770988 0.2770988), wk = 0.0025445 k( 290) = ( 0.4581330 -0.2617044 0.2617044), wk = 0.0025445 k( 291) = ( 0.4605958 -0.2463100 0.2463100), wk = 0.0025445 k( 292) = ( 0.4630585 -0.2309157 0.2309157), wk = 0.0025445 k( 293) = ( 0.4655213 -0.2155213 0.2155213), wk = 0.0025445 k( 294) = ( 0.4679840 -0.2001269 0.2001269), wk = 0.0025445 k( 295) = ( 0.4704468 -0.1847325 0.1847325), wk = 0.0025445 k( 296) = ( 0.4729096 -0.1693381 0.1693381), wk = 0.0025445 k( 297) = ( 0.4753723 -0.1539438 0.1539438), wk = 0.0025445 k( 298) = ( 0.4778351 -0.1385494 0.1385494), wk = 0.0025445 k( 299) = ( 0.4802979 -0.1231550 0.1231550), wk = 0.0025445 k( 300) = ( 0.4827606 -0.1077606 0.1077606), wk = 0.0025445 k( 301) = ( 0.4852234 -0.0923663 0.0923663), wk = 0.0025445 k( 302) = ( 0.4876862 -0.0769719 0.0769719), wk = 0.0025445 k( 303) = ( 0.4901489 -0.0615775 0.0615775), wk = 0.0025445 k( 304) = ( 0.4926117 -0.0461831 0.0461831), wk = 0.0025445 k( 305) = ( 0.4950745 -0.0307888 0.0307888), wk = 0.0025445 k( 306) = ( 0.4975372 -0.0153944 0.0153944), wk = 0.0025445 k( 307) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0025445 k( 308) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0025445 k( 309) = ( 0.4941860 0.0058140 0.0058139), wk = 0.0025445 k( 310) = ( 0.4883721 0.0116279 0.0116279), wk = 0.0025445 k( 311) = ( 0.4825581 0.0174419 0.0174419), wk = 0.0025445 k( 312) = ( 0.4767442 0.0232558 0.0232558), wk = 0.0025445 k( 313) = ( 0.4709302 0.0290698 0.0290698), wk = 0.0025445 k( 314) = ( 0.4651163 0.0348837 0.0348837), wk = 0.0025445 k( 315) = ( 0.4593023 0.0406977 0.0406977), wk = 0.0025445 k( 316) = ( 0.4534884 0.0465116 0.0465116), wk = 0.0025445 k( 317) = ( 0.4476744 0.0523256 0.0523256), wk = 0.0025445 k( 318) = ( 0.4418605 0.0581395 0.0581395), wk = 0.0025445 k( 319) = ( 0.4360465 0.0639535 0.0639535), wk = 0.0025445 k( 320) = ( 0.4302326 0.0697674 0.0697674), wk = 0.0025445 k( 321) = ( 0.4244186 0.0755814 0.0755814), wk = 0.0025445 k( 322) = ( 0.4186047 0.0813953 0.0813953), wk = 0.0025445 k( 323) = ( 0.4127907 0.0872093 0.0872093), wk = 0.0025445 k( 324) = ( 0.4069767 0.0930233 0.0930233), wk = 0.0025445 k( 325) = ( 0.4011628 0.0988372 0.0988372), wk = 0.0025445 k( 326) = ( 0.3953488 0.1046512 0.1046512), wk = 0.0025445 k( 327) = ( 0.3895349 0.1104651 0.1104651), wk = 0.0025445 k( 328) = ( 0.3837209 0.1162791 0.1162791), wk = 0.0025445 k( 329) = ( 0.3779070 0.1220930 0.1220930), wk = 0.0025445 k( 330) = ( 0.3720930 0.1279070 0.1279070), wk = 0.0025445 k( 331) = ( 0.3662791 0.1337209 0.1337209), wk = 0.0025445 k( 332) = ( 0.3604651 0.1395349 0.1395349), wk = 0.0025445 k( 333) = ( 0.3546512 0.1453488 0.1453488), wk = 0.0025445 k( 334) = ( 0.3488372 0.1511628 0.1511628), wk = 0.0025445 k( 335) = ( 0.3430233 0.1569767 0.1569767), wk = 0.0025445 k( 336) = ( 0.3372093 0.1627907 0.1627907), wk = 0.0025445 k( 337) = ( 0.3313953 0.1686046 0.1686046), wk = 0.0025445 k( 338) = ( 0.3255814 0.1744186 0.1744186), wk = 0.0025445 k( 339) = ( 0.3197674 0.1802326 0.1802326), wk = 0.0025445 k( 340) = ( 0.3139535 0.1860465 0.1860465), wk = 0.0025445 k( 341) = ( 0.3081395 0.1918605 0.1918605), wk = 0.0025445 k( 342) = ( 0.3023256 0.1976744 0.1976744), wk = 0.0025445 k( 343) = ( 0.2965116 0.2034884 0.2034884), wk = 0.0025445 k( 344) = ( 0.2906977 0.2093023 0.2093023), wk = 0.0025445 k( 345) = ( 0.2848837 0.2151163 0.2151163), wk = 0.0025445 k( 346) = ( 0.2790698 0.2209302 0.2209302), wk = 0.0025445 k( 347) = ( 0.2732558 0.2267442 0.2267442), wk = 0.0025445 k( 348) = ( 0.2674419 0.2325581 0.2325581), wk = 0.0025445 k( 349) = ( 0.2616279 0.2383721 0.2383721), wk = 0.0025445 k( 350) = ( 0.2558140 0.2441860 0.2441860), wk = 0.0025445 k( 351) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0025445 k( 352) = ( 0.2416333 -0.2416333 0.6204519), wk = 0.0025445 k( 353) = ( 0.2473730 -0.2473730 0.6147122), wk = 0.0025445 k( 354) = ( 0.2531126 -0.2531126 0.6089725), wk = 0.0025445 k( 355) = ( 0.2588523 -0.2588523 0.6032328), wk = 0.0025445 k( 356) = ( 0.2645920 -0.2645920 0.5974932), wk = 0.0025445 k( 357) = ( 0.2703317 -0.2703317 0.5917535), wk = 0.0025445 k( 358) = ( 0.2760713 -0.2760713 0.5860138), wk = 0.0025445 k( 359) = ( 0.2818110 -0.2818110 0.5802741), wk = 0.0025445 k( 360) = ( 0.2875507 -0.2875507 0.5745345), wk = 0.0025445 k( 361) = ( 0.2932904 -0.2932904 0.5687948), wk = 0.0025445 k( 362) = ( 0.2990300 -0.2990300 0.5630551), wk = 0.0025445 k( 363) = ( 0.3047697 -0.3047697 0.5573154), wk = 0.0025445 k( 364) = ( 0.3105094 -0.3105094 0.5515758), wk = 0.0025445 k( 365) = ( 0.3162491 -0.3162491 0.5458361), wk = 0.0025445 k( 366) = ( 0.3219887 -0.3219887 0.5400964), wk = 0.0025445 k( 367) = ( 0.3277284 -0.3277284 0.5343567), wk = 0.0025445 k( 368) = ( 0.3334681 -0.3334681 0.5286171), wk = 0.0025445 k( 369) = ( 0.3392078 -0.3392078 0.5228774), wk = 0.0025445 k( 370) = ( 0.3449474 -0.3449474 0.5171377), wk = 0.0025445 k( 371) = ( 0.3506871 -0.3506871 0.5113980), wk = 0.0025445 k( 372) = ( 0.3564268 -0.3564268 0.5056584), wk = 0.0025445 k( 373) = ( 0.3621665 -0.3621665 0.4999187), wk = 0.0025445 k( 374) = ( 0.3679061 -0.3679061 0.4941790), wk = 0.0025445 k( 375) = ( 0.3736458 -0.3736458 0.4884393), wk = 0.0025445 k( 376) = ( 0.3793855 -0.3793855 0.4826996), wk = 0.0025445 k( 377) = ( 0.3851252 -0.3851252 0.4769600), wk = 0.0025445 k( 378) = ( 0.3908648 -0.3908648 0.4712203), wk = 0.0025445 k( 379) = ( 0.3966045 -0.3966045 0.4654806), wk = 0.0025445 k( 380) = ( 0.4023442 -0.4023442 0.4597409), wk = 0.0025445 k( 381) = ( 0.4080839 -0.4080839 0.4540013), wk = 0.0025445 k( 382) = ( 0.4138235 -0.4138235 0.4482616), wk = 0.0025445 k( 383) = ( 0.4195632 -0.4195632 0.4425219), wk = 0.0025445 k( 384) = ( 0.4253029 -0.4253029 0.4367822), wk = 0.0025445 k( 385) = ( 0.4310426 -0.4310426 0.4310426), wk = 0.0025445 k( 386) = ( 0.5689574 0.4310426 -0.4310426), wk = 0.0025445 k( 387) = ( 0.5591064 0.4408936 -0.4408936), wk = 0.0025445 k( 388) = ( 0.5492553 0.4507447 -0.4507447), wk = 0.0025445 k( 389) = ( 0.5394043 0.4605957 -0.4605958), wk = 0.0025445 k( 390) = ( 0.5295532 0.4704468 -0.4704468), wk = 0.0025445 k( 391) = ( 0.5197021 0.4802979 -0.4802979), wk = 0.0025445 k( 392) = ( 0.5098511 0.4901489 -0.4901489), wk = 0.0025445 k( 393) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0025445 Dense grid: 85531 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.35 Mb ( 606, 38) NL pseudopotentials 0.55 Mb ( 303, 118) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2374) G-vector shells 0.02 Mb ( 2205) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.41 Mb ( 606, 152) Each subspace H/S matrix 0.02 Mb ( 38, 38) Each matrix 0.14 Mb ( 118, 2, 38) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./Li4FeN2.save/charge-density.dat Starting wfc are 74 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.7 secs Computing kpt #: 2 total cpu time spent up to now is 3.3 secs Computing kpt #: 3 total cpu time spent up to now is 3.8 secs Computing kpt #: 4 total cpu time spent up to now is 4.3 secs Computing kpt #: 5 total cpu time spent up to now is 4.8 secs Computing kpt #: 6 total cpu time spent up to now is 5.3 secs Computing kpt #: 7 total cpu time spent up to now is 5.8 secs Computing kpt #: 8 total cpu time spent up to now is 6.3 secs Computing kpt #: 9 total cpu time spent up to now is 6.8 secs Computing kpt #: 10 total cpu time spent up to now is 7.4 secs Computing kpt #: 11 total cpu time spent up to now is 7.9 secs Computing kpt #: 12 total cpu time spent up to now is 8.4 secs Computing kpt #: 13 total cpu time spent up to now is 8.9 secs Computing kpt #: 14 total cpu time spent up to now is 9.4 secs Computing kpt #: 15 total cpu time spent up to now is 9.9 secs Computing kpt #: 16 total cpu time spent up to now is 10.4 secs Computing kpt #: 17 total cpu time spent up to now is 10.9 secs Computing kpt #: 18 total cpu time spent up to now is 11.5 secs Computing kpt #: 19 total cpu time spent up to now is 12.0 secs Computing kpt #: 20 total cpu time spent up to now is 12.6 secs Computing kpt #: 21 total cpu time spent up to now is 13.1 secs Computing kpt #: 22 total cpu time spent up to now is 13.7 secs Computing kpt #: 23 total cpu time spent up to now is 14.3 secs Computing kpt #: 24 total cpu time spent up to now is 14.9 secs Computing kpt #: 25 total cpu time spent up to now is 15.4 secs Computing kpt #: 26 total cpu time spent up to now is 16.0 secs Computing kpt #: 27 total cpu time spent up to now is 16.6 secs Computing kpt #: 28 total cpu time spent up to now is 17.2 secs Computing kpt #: 29 total cpu time spent up to now is 18.0 secs Computing kpt #: 30 total cpu time spent up to now is 18.9 secs Computing kpt #: 31 total cpu time spent up to now is 19.5 secs Computing kpt #: 32 total cpu time spent up to now is 20.2 secs Computing kpt #: 33 total cpu time spent up to now is 20.8 secs Computing kpt #: 34 total cpu time spent up to now is 21.4 secs Computing kpt #: 35 total cpu time spent up to now is 22.1 secs Computing kpt #: 36 total cpu time spent up to now is 22.8 secs Computing kpt #: 37 total cpu time spent up to now is 23.5 secs Computing kpt #: 38 total cpu time spent up to now is 24.2 secs Computing kpt #: 39 total cpu time spent up to now is 24.9 secs Computing kpt #: 40 total cpu time spent up to now is 25.6 secs Computing kpt #: 41 total cpu time spent up to now is 26.4 secs Computing kpt #: 42 total cpu time spent up to now is 27.1 secs Computing kpt #: 43 total cpu time spent up to now is 27.8 secs Computing kpt #: 44 total cpu time spent up to now is 28.5 secs Computing kpt #: 45 total cpu time spent up to now is 29.3 secs Computing kpt #: 46 total cpu time spent up to now is 30.0 secs Computing kpt #: 47 total cpu time spent up to now is 30.8 secs Computing kpt #: 48 total cpu time spent up to now is 31.5 secs Computing kpt #: 49 total cpu time spent up to now is 32.3 secs Computing kpt #: 50 total cpu time spent up to now is 33.1 secs Computing kpt #: 51 total cpu time spent up to now is 33.8 secs Computing kpt #: 52 total cpu time spent up to now is 34.4 secs Computing kpt #: 53 total cpu time spent up to now is 35.0 secs Computing kpt #: 54 total cpu time spent up to now is 35.6 secs Computing kpt #: 55 total cpu time spent up to now is 36.3 secs Computing kpt #: 56 total cpu time spent up to now is 36.9 secs Computing kpt #: 57 total cpu time spent up to now is 37.5 secs Computing kpt #: 58 total cpu time spent up to now is 38.1 secs Computing kpt #: 59 total cpu time spent up to now is 38.8 secs Computing kpt #: 60 total cpu time spent up to now is 39.4 secs Computing kpt #: 61 total cpu time spent up to now is 40.0 secs Computing kpt #: 62 total cpu time spent up to now is 40.6 secs Computing kpt #: 63 total cpu time spent up to now is 41.2 secs Computing kpt #: 64 total cpu time spent up to now is 41.9 secs Computing kpt #: 65 total cpu time spent up to now is 42.5 secs Computing kpt #: 66 total cpu time spent up to now is 43.1 secs Computing kpt #: 67 total cpu time spent up to now is 43.7 secs Computing kpt #: 68 total cpu time spent up to now is 44.3 secs Computing kpt #: 69 total cpu time spent up to now is 44.9 secs Computing kpt #: 70 total cpu time spent up to now is 45.6 secs Computing kpt #: 71 total cpu time spent up to now is 46.2 secs Computing kpt #: 72 total cpu time spent up to now is 46.8 secs Computing kpt #: 73 total cpu time spent up to now is 47.4 secs Computing kpt #: 74 total cpu time spent up to now is 48.0 secs Computing kpt #: 75 total cpu time spent up to now is 48.6 secs Computing kpt #: 76 total cpu time spent up to now is 49.2 secs Computing kpt #: 77 total cpu time spent up to now is 49.8 secs Computing kpt #: 78 total cpu time spent up to now is 50.4 secs Computing kpt #: 79 total cpu time spent up to now is 51.0 secs Computing kpt #: 80 total cpu time spent up to now is 51.6 secs Computing kpt #: 81 total cpu time spent up to now is 52.2 secs Computing kpt #: 82 total cpu time spent up to now is 52.8 secs Computing kpt #: 83 total cpu time spent up to now is 53.4 secs Computing kpt #: 84 total cpu time spent up to now is 54.0 secs Computing kpt #: 85 total cpu time spent up to now is 54.6 secs Computing kpt #: 86 total cpu time spent up to now is 55.1 secs Computing kpt #: 87 total cpu time spent up to now is 55.7 secs Computing kpt #: 88 total cpu time spent up to now is 56.3 secs Computing kpt #: 89 total cpu time spent up to now is 56.9 secs Computing kpt #: 90 total cpu time spent up to now is 57.5 secs Computing kpt #: 91 total cpu time spent up to now is 58.1 secs Computing kpt #: 92 total cpu time spent up to now is 58.7 secs Computing kpt #: 93 total cpu time spent up to now is 59.2 secs Computing kpt #: 94 total cpu time spent up to now is 59.8 secs Computing kpt #: 95 total cpu time spent up to now is 60.4 secs Computing kpt #: 96 total cpu time spent up to now is 60.9 secs Computing kpt #: 97 total cpu time spent up to now is 61.5 secs Computing kpt #: 98 total cpu time spent up to now is 62.1 secs Computing kpt #: 99 total cpu time spent up to now is 62.6 secs Computing kpt #: 100 total cpu time spent up to now is 63.1 secs Computing kpt #: 101 total cpu time spent up to now is 63.7 secs Computing kpt #: 102 total cpu time spent up to now is 64.2 secs Computing kpt #: 103 total cpu time spent up to now is 64.8 secs Computing kpt #: 104 total cpu time spent up to now is 65.3 secs Computing kpt #: 105 total cpu time spent up to now is 65.9 secs Computing kpt #: 106 total cpu time spent up to now is 66.4 secs Computing kpt #: 107 total cpu time spent up to now is 67.0 secs Computing kpt #: 108 total cpu time spent up to now is 67.5 secs Computing kpt #: 109 total cpu time spent up to now is 68.0 secs Computing kpt #: 110 total cpu time spent up to now is 68.6 secs Computing kpt #: 111 total cpu time spent up to now is 69.2 secs Computing kpt #: 112 total cpu time spent up to now is 69.7 secs Computing kpt #: 113 total cpu time spent up to now is 70.3 secs Computing kpt #: 114 total cpu time spent up to now is 70.8 secs Computing kpt #: 115 total cpu time spent up to now is 71.4 secs Computing kpt #: 116 total cpu time spent up to now is 72.0 secs Computing kpt #: 117 total cpu time spent up to now is 72.5 secs Computing kpt #: 118 total cpu time spent up to now is 73.1 secs Computing kpt #: 119 total cpu time spent up to now is 73.7 secs Computing kpt #: 120 total cpu time spent up to now is 74.3 secs Computing kpt #: 121 total cpu time spent up to now is 74.8 secs Computing kpt #: 122 total cpu time spent up to now is 75.4 secs Computing kpt #: 123 total cpu time spent up to now is 76.0 secs Computing kpt #: 124 total cpu time spent up to now is 76.6 secs Computing kpt #: 125 total cpu time spent up to now is 77.2 secs Computing kpt #: 126 total cpu time spent up to now is 77.8 secs Computing kpt #: 127 total cpu time spent up to now is 78.4 secs Computing kpt #: 128 total cpu time spent up to now is 79.1 secs Computing kpt #: 129 total cpu time spent up to now is 79.7 secs Computing kpt #: 130 total cpu time spent up to now is 80.4 secs Computing kpt #: 131 total cpu time spent up to now is 81.1 secs Computing kpt #: 132 total cpu time spent up to now is 81.9 secs Computing kpt #: 133 total cpu time spent up to now is 82.6 secs Computing kpt #: 134 total cpu time spent up to now is 83.4 secs Computing kpt #: 135 total cpu time spent up to now is 84.2 secs Computing kpt #: 136 total cpu time spent up to now is 85.0 secs Computing kpt #: 137 total cpu time spent up to now is 85.7 secs Computing kpt #: 138 total cpu time spent up to now is 86.5 secs Computing kpt #: 139 total cpu time spent up to now is 87.3 secs Computing kpt #: 140 total cpu time spent up to now is 88.0 secs Computing kpt #: 141 total cpu time spent up to now is 88.8 secs Computing kpt #: 142 total cpu time spent up to now is 89.5 secs Computing kpt #: 143 total cpu time spent up to now is 90.3 secs Computing kpt #: 144 total cpu time spent up to now is 91.1 secs Computing kpt #: 145 total cpu time spent up to now is 91.8 secs Computing kpt #: 146 total cpu time spent up to now is 92.6 secs Computing kpt #: 147 total cpu time spent up to now is 93.3 secs Computing kpt #: 148 total cpu time spent up to now is 94.1 secs Computing kpt #: 149 total cpu time spent up to now is 94.8 secs Computing kpt #: 150 total cpu time spent up to now is 95.6 secs Computing kpt #: 151 total cpu time spent up to now is 96.3 secs Computing kpt #: 152 total cpu time spent up to now is 97.0 secs Computing kpt #: 153 total cpu time spent up to now is 97.7 secs Computing kpt #: 154 total cpu time spent up to now is 98.4 secs Computing kpt #: 155 total cpu time spent up to now is 99.0 secs Computing kpt #: 156 total cpu time spent up to now is 99.6 secs Computing kpt #: 157 total cpu time spent up to now is 100.2 secs Computing kpt #: 158 total cpu time spent up to now is 100.8 secs Computing kpt #: 159 total cpu time spent up to now is 101.5 secs Computing kpt #: 160 total cpu time spent up to now is 102.1 secs Computing kpt #: 161 total cpu time spent up to now is 102.7 secs Computing kpt #: 162 total cpu time spent up to now is 103.2 secs Computing kpt #: 163 total cpu time spent up to now is 103.8 secs Computing kpt #: 164 total cpu time spent up to now is 104.4 secs Computing kpt #: 165 total cpu time spent up to now is 105.0 secs Computing kpt #: 166 total cpu time spent up to now is 105.5 secs Computing kpt #: 167 total cpu time spent up to now is 106.1 secs Computing kpt #: 168 total cpu time spent up to now is 106.7 secs Computing kpt #: 169 total cpu time spent up to now is 107.3 secs Computing kpt #: 170 total cpu time spent up to now is 107.9 secs Computing kpt #: 171 total cpu time spent up to now is 108.5 secs Computing kpt #: 172 total cpu time spent up to now is 109.1 secs Computing kpt #: 173 total cpu time spent up to now is 109.7 secs Computing kpt #: 174 total cpu time spent up to now is 110.3 secs Computing kpt #: 175 total cpu time spent up to now is 111.0 secs Computing kpt #: 176 total cpu time spent up to now is 111.6 secs Computing kpt #: 177 total cpu time spent up to now is 112.2 secs Computing kpt #: 178 total cpu time spent up to now is 112.8 secs Computing kpt #: 179 total cpu time spent up to now is 113.5 secs Computing kpt #: 180 total cpu time spent up to now is 114.1 secs Computing kpt #: 181 total cpu time spent up to now is 114.7 secs Computing kpt #: 182 total cpu time spent up to now is 115.3 secs Computing kpt #: 183 total cpu time spent up to now is 116.0 secs Computing kpt #: 184 total cpu time spent up to now is 116.6 secs Computing kpt #: 185 total cpu time spent up to now is 117.2 secs Computing kpt #: 186 total cpu time spent up to now is 117.8 secs Computing kpt #: 187 total cpu time spent up to now is 118.4 secs Computing kpt #: 188 total cpu time spent up to now is 119.0 secs Computing kpt #: 189 total cpu time spent up to now is 119.6 secs Computing kpt #: 190 total cpu time spent up to now is 120.2 secs Computing kpt #: 191 total cpu time spent up to now is 120.8 secs Computing kpt #: 192 total cpu time spent up to now is 121.4 secs Computing kpt #: 193 total cpu time spent up to now is 122.0 secs Computing kpt #: 194 total cpu time spent up to now is 122.6 secs Computing kpt #: 195 total cpu time spent up to now is 123.2 secs Computing kpt #: 196 total cpu time spent up to now is 123.9 secs Computing kpt #: 197 total cpu time spent up to now is 124.6 secs Computing kpt #: 198 total cpu time spent up to now is 125.3 secs Computing kpt #: 199 total cpu time spent up to now is 126.0 secs Computing kpt #: 200 total cpu time spent up to now is 126.6 secs Computing kpt #: 201 total cpu time spent up to now is 127.3 secs Computing kpt #: 202 total cpu time spent up to now is 128.1 secs Computing kpt #: 203 total cpu time spent up to now is 128.7 secs Computing kpt #: 204 total cpu time spent up to now is 129.3 secs Computing kpt #: 205 total cpu time spent up to now is 129.9 secs Computing kpt #: 206 total cpu time spent up to now is 130.4 secs Computing kpt #: 207 total cpu time spent up to now is 131.0 secs Computing kpt #: 208 total cpu time spent up to now is 131.5 secs Computing kpt #: 209 total cpu time spent up to now is 132.1 secs Computing kpt #: 210 total cpu time spent up to now is 132.6 secs Computing kpt #: 211 total cpu time spent up to now is 133.2 secs Computing kpt #: 212 total cpu time spent up to now is 133.7 secs Computing kpt #: 213 total cpu time spent up to now is 134.3 secs Computing kpt #: 214 total cpu time spent up to now is 134.8 secs Computing kpt #: 215 total cpu time spent up to now is 135.4 secs Computing kpt #: 216 total cpu time spent up to now is 135.9 secs Computing kpt #: 217 total cpu time spent up to now is 136.4 secs Computing kpt #: 218 total cpu time spent up to now is 137.0 secs Computing kpt #: 219 total cpu time spent up to now is 137.5 secs Computing kpt #: 220 total cpu time spent up to now is 138.1 secs Computing kpt #: 221 total cpu time spent up to now is 138.6 secs Computing kpt #: 222 total cpu time spent up to now is 139.1 secs Computing kpt #: 223 total cpu time spent up to now is 139.7 secs Computing kpt #: 224 total cpu time spent up to now is 140.2 secs Computing kpt #: 225 total cpu time spent up to now is 140.7 secs Computing kpt #: 226 total cpu time spent up to now is 141.2 secs Computing kpt #: 227 total cpu time spent up to now is 141.8 secs Computing kpt #: 228 total cpu time spent up to now is 142.3 secs Computing kpt #: 229 total cpu time spent up to now is 142.8 secs Computing kpt #: 230 total cpu time spent up to now is 143.3 secs Computing kpt #: 231 total cpu time spent up to now is 143.8 secs Computing kpt #: 232 total cpu time spent up to now is 144.3 secs Computing kpt #: 233 total cpu time spent up to now is 144.8 secs Computing kpt #: 234 total cpu time spent up to now is 145.3 secs Computing kpt #: 235 total cpu time spent up to now is 145.9 secs Computing kpt #: 236 total cpu time spent up to now is 146.4 secs Computing kpt #: 237 total cpu time spent up to now is 146.9 secs Computing kpt #: 238 total cpu time spent up to now is 147.4 secs Computing kpt #: 239 total cpu time spent up to now is 147.9 secs Computing kpt #: 240 total cpu time spent up to now is 148.4 secs Computing kpt #: 241 total cpu time spent up to now is 149.0 secs Computing kpt #: 242 total cpu time spent up to now is 149.5 secs Computing kpt #: 243 total cpu time spent up to now is 150.0 secs Computing kpt #: 244 total cpu time spent up to now is 150.6 secs Computing kpt #: 245 total cpu time spent up to now is 151.1 secs Computing kpt #: 246 total cpu time spent up to now is 151.6 secs Computing kpt #: 247 total cpu time spent up to now is 152.1 secs Computing kpt #: 248 total cpu time spent up to now is 152.7 secs Computing kpt #: 249 total cpu time spent up to now is 153.2 secs Computing kpt #: 250 total cpu time spent up to now is 153.7 secs Computing kpt #: 251 total cpu time spent up to now is 154.3 secs Computing kpt #: 252 total cpu time spent up to now is 154.8 secs Computing kpt #: 253 total cpu time spent up to now is 155.3 secs Computing kpt #: 254 total cpu time spent up to now is 155.8 secs Computing kpt #: 255 total cpu time spent up to now is 156.4 secs Computing kpt #: 256 total cpu time spent up to now is 156.9 secs Computing kpt #: 257 total cpu time spent up to now is 157.4 secs Computing kpt #: 258 total cpu time spent up to now is 158.0 secs Computing kpt #: 259 total cpu time spent up to now is 158.5 secs Computing kpt #: 260 total cpu time spent up to now is 159.0 secs Computing kpt #: 261 total cpu time spent up to now is 159.6 secs Computing kpt #: 262 total cpu time spent up to now is 160.1 secs Computing kpt #: 263 total cpu time spent up to now is 160.7 secs Computing kpt #: 264 total cpu time spent up to now is 161.2 secs Computing kpt #: 265 total cpu time spent up to now is 161.8 secs Computing kpt #: 266 total cpu time spent up to now is 162.3 secs Computing kpt #: 267 total cpu time spent up to now is 162.9 secs Computing kpt #: 268 total cpu time spent up to now is 163.4 secs Computing kpt #: 269 total cpu time spent up to now is 164.0 secs Computing kpt #: 270 total cpu time spent up to now is 164.6 secs Computing kpt #: 271 total cpu time spent up to now is 165.1 secs Computing kpt #: 272 total cpu time spent up to now is 165.7 secs Computing kpt #: 273 total cpu time spent up to now is 166.3 secs Computing kpt #: 274 total cpu time spent up to now is 167.0 secs Computing kpt #: 275 total cpu time spent up to now is 167.7 secs Computing kpt #: 276 total cpu time spent up to now is 168.5 secs Computing kpt #: 277 total cpu time spent up to now is 169.2 secs Computing kpt #: 278 total cpu time spent up to now is 170.0 secs Computing kpt #: 279 total cpu time spent up to now is 170.7 secs Computing kpt #: 280 total cpu time spent up to now is 171.4 secs Computing kpt #: 281 total cpu time spent up to now is 172.2 secs Computing kpt #: 282 total cpu time spent up to now is 173.0 secs Computing kpt #: 283 total cpu time spent up to now is 173.7 secs Computing kpt #: 284 total cpu time spent up to now is 174.4 secs Computing kpt #: 285 total cpu time spent up to now is 175.1 secs Computing kpt #: 286 total cpu time spent up to now is 175.8 secs Computing kpt #: 287 total cpu time spent up to now is 176.5 secs Computing kpt #: 288 total cpu time spent up to now is 177.2 secs Computing kpt #: 289 total cpu time spent up to now is 177.8 secs Computing kpt #: 290 total cpu time spent up to now is 178.4 secs Computing kpt #: 291 total cpu time spent up to now is 179.0 secs Computing kpt #: 292 total cpu time spent up to now is 179.5 secs Computing kpt #: 293 total cpu time spent up to now is 180.1 secs Computing kpt #: 294 total cpu time spent up to now is 180.7 secs Computing kpt #: 295 total cpu time spent up to now is 181.3 secs Computing kpt #: 296 total cpu time spent up to now is 181.8 secs Computing kpt #: 297 total cpu time spent up to now is 182.4 secs Computing kpt #: 298 total cpu time spent up to now is 183.0 secs Computing kpt #: 299 total cpu time spent up to now is 183.5 secs Computing kpt #: 300 total cpu time spent up to now is 184.1 secs Computing kpt #: 301 total cpu time spent up to now is 184.7 secs Computing kpt #: 302 total cpu time spent up to now is 185.2 secs Computing kpt #: 303 total cpu time spent up to now is 185.8 secs Computing kpt #: 304 total cpu time spent up to now is 186.4 secs Computing kpt #: 305 total cpu time spent up to now is 186.9 secs Computing kpt #: 306 total cpu time spent up to now is 187.5 secs Computing kpt #: 307 total cpu time spent up to now is 188.0 secs Computing kpt #: 308 total cpu time spent up to now is 188.6 secs Computing kpt #: 309 total cpu time spent up to now is 189.1 secs Computing kpt #: 310 total cpu time spent up to now is 189.7 secs Computing kpt #: 311 total cpu time spent up to now is 190.3 secs Computing kpt #: 312 total cpu time spent up to now is 190.8 secs Computing kpt #: 313 total cpu time spent up to now is 191.4 secs Computing kpt #: 314 total cpu time spent up to now is 191.9 secs Computing kpt #: 315 total cpu time spent up to now is 192.5 secs Computing kpt #: 316 total cpu time spent up to now is 193.1 secs Computing kpt #: 317 total cpu time spent up to now is 193.6 secs Computing kpt #: 318 total cpu time spent up to now is 194.2 secs Computing kpt #: 319 total cpu time spent up to now is 194.7 secs Computing kpt #: 320 total cpu time spent up to now is 195.3 secs Computing kpt #: 321 total cpu time spent up to now is 195.9 secs Computing kpt #: 322 total cpu time spent up to now is 196.4 secs Computing kpt #: 323 total cpu time spent up to now is 197.0 secs Computing kpt #: 324 total cpu time spent up to now is 197.6 secs Computing kpt #: 325 total cpu time spent up to now is 198.2 secs Computing kpt #: 326 total cpu time spent up to now is 198.7 secs Computing kpt #: 327 total cpu time spent up to now is 199.3 secs Computing kpt #: 328 total cpu time spent up to now is 199.9 secs Computing kpt #: 329 total cpu time spent up to now is 200.4 secs Computing kpt #: 330 total cpu time spent up to now is 201.0 secs Computing kpt #: 331 total cpu time spent up to now is 201.6 secs Computing kpt #: 332 total cpu time spent up to now is 202.2 secs Computing kpt #: 333 total cpu time spent up to now is 202.7 secs Computing kpt #: 334 total cpu time spent up to now is 203.3 secs Computing kpt #: 335 total cpu time spent up to now is 203.9 secs Computing kpt #: 336 total cpu time spent up to now is 204.5 secs Computing kpt #: 337 total cpu time spent up to now is 205.0 secs Computing kpt #: 338 total cpu time spent up to now is 205.6 secs Computing kpt #: 339 total cpu time spent up to now is 206.1 secs Computing kpt #: 340 total cpu time spent up to now is 206.7 secs Computing kpt #: 341 total cpu time spent up to now is 207.3 secs Computing kpt #: 342 total cpu time spent up to now is 207.8 secs Computing kpt #: 343 total cpu time spent up to now is 208.4 secs Computing kpt #: 344 total cpu time spent up to now is 208.9 secs Computing kpt #: 345 total cpu time spent up to now is 209.5 secs Computing kpt #: 346 total cpu time spent up to now is 210.1 secs Computing kpt #: 347 total cpu time spent up to now is 210.6 secs Computing kpt #: 348 total cpu time spent up to now is 211.2 secs Computing kpt #: 349 total cpu time spent up to now is 211.8 secs Computing kpt #: 350 total cpu time spent up to now is 212.3 secs Computing kpt #: 351 total cpu time spent up to now is 212.9 secs Computing kpt #: 352 total cpu time spent up to now is 213.5 secs Computing kpt #: 353 total cpu time spent up to now is 214.1 secs Computing kpt #: 354 total cpu time spent up to now is 214.7 secs Computing kpt #: 355 total cpu time spent up to now is 215.3 secs Computing kpt #: 356 total cpu time spent up to now is 215.9 secs Computing kpt #: 357 total cpu time spent up to now is 216.5 secs Computing kpt #: 358 total cpu time spent up to now is 217.1 secs Computing kpt #: 359 total cpu time spent up to now is 217.6 secs Computing kpt #: 360 total cpu time spent up to now is 218.2 secs Computing kpt #: 361 total cpu time spent up to now is 218.8 secs Computing kpt #: 362 total cpu time spent up to now is 219.3 secs Computing kpt #: 363 total cpu time spent up to now is 219.9 secs Computing kpt #: 364 total cpu time spent up to now is 220.5 secs Computing kpt #: 365 total cpu time spent up to now is 221.1 secs Computing kpt #: 366 total cpu time spent up to now is 221.7 secs Computing kpt #: 367 total cpu time spent up to now is 222.3 secs Computing kpt #: 368 total cpu time spent up to now is 222.9 secs Computing kpt #: 369 total cpu time spent up to now is 223.5 secs Computing kpt #: 370 total cpu time spent up to now is 224.1 secs Computing kpt #: 371 total cpu time spent up to now is 224.7 secs Computing kpt #: 372 total cpu time spent up to now is 225.3 secs Computing kpt #: 373 total cpu time spent up to now is 226.0 secs Computing kpt #: 374 total cpu time spent up to now is 226.7 secs Computing kpt #: 375 total cpu time spent up to now is 227.5 secs Computing kpt #: 376 total cpu time spent up to now is 228.2 secs Computing kpt #: 377 total cpu time spent up to now is 228.9 secs Computing kpt #: 378 total cpu time spent up to now is 229.7 secs Computing kpt #: 379 total cpu time spent up to now is 230.5 secs Computing kpt #: 380 total cpu time spent up to now is 231.2 secs Computing kpt #: 381 total cpu time spent up to now is 231.9 secs Computing kpt #: 382 total cpu time spent up to now is 232.7 secs Computing kpt #: 383 total cpu time spent up to now is 233.4 secs Computing kpt #: 384 total cpu time spent up to now is 234.2 secs Computing kpt #: 385 total cpu time spent up to now is 234.9 secs Computing kpt #: 386 total cpu time spent up to now is 235.6 secs Computing kpt #: 387 total cpu time spent up to now is 236.4 secs Computing kpt #: 388 total cpu time spent up to now is 237.1 secs Computing kpt #: 389 total cpu time spent up to now is 237.7 secs Computing kpt #: 390 total cpu time spent up to now is 238.3 secs Computing kpt #: 391 total cpu time spent up to now is 239.0 secs Computing kpt #: 392 total cpu time spent up to now is 239.6 secs Computing kpt #: 393 total cpu time spent up to now is 240.2 secs ethr = 3.33E-08, avg # of iterations = 17.1 total cpu time spent up to now is 240.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 10695 PWs) bands (ev): -42.5611 -42.5611 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2183 -10.2183 -9.6269 -9.6269 -0.4442 -0.4442 -0.3713 -0.3713 -0.1005 -0.1005 1.4807 1.4807 1.5170 1.5170 1.5332 1.5332 1.5595 1.5595 2.8867 2.8867 3.1323 3.1323 3.5773 3.5773 3.6477 3.6477 4.8699 4.8699 5.9959 5.9959 k =-0.0059 0.0060 0.0144 ( 10703 PWs) bands (ev): -42.5610 -42.5610 -42.4629 -42.4629 -42.3721 -42.3721 -42.2767 -42.2767 -10.2182 -10.2182 -9.6269 -9.6269 -0.4441 -0.4441 -0.3712 -0.3712 -0.1010 -0.1010 1.4757 1.4757 1.4865 1.4865 1.5599 1.5599 1.5678 1.5678 2.8867 2.8867 3.1316 3.1316 3.5772 3.5772 3.6475 3.6475 4.8721 4.8721 5.9970 5.9970 k =-0.0117 0.0119 0.0289 ( 10699 PWs) bands (ev): -42.5608 -42.5608 -42.4627 -42.4627 -42.3722 -42.3722 -42.2769 -42.2769 -10.2180 -10.2180 -9.6268 -9.6268 -0.4439 -0.4439 -0.3707 -0.3707 -0.1028 -0.1028 1.4390 1.4390 1.4786 1.4786 1.5615 1.5615 1.6096 1.6096 2.8868 2.8868 3.1295 3.1295 3.5771 3.5771 3.6469 3.6469 4.8787 4.8787 6.0001 6.0001 k =-0.0176 0.0179 0.0433 ( 10691 PWs) bands (ev): -42.5605 -42.5605 -42.4624 -42.4624 -42.3725 -42.3725 -42.2772 -42.2772 -10.2176 -10.2176 -9.6268 -9.6268 -0.4435 -0.4435 -0.3699 -0.3699 -0.1056 -0.1056 1.3973 1.3973 1.4732 1.4732 1.5641 1.5641 1.6519 1.6519 2.8869 2.8869 3.1260 3.1260 3.5767 3.5767 3.6460 3.6460 4.8898 4.8898 6.0053 6.0053 k =-0.0234 0.0238 0.0578 ( 10683 PWs) bands (ev): -42.5601 -42.5601 -42.4620 -42.4620 -42.3730 -42.3730 -42.2776 -42.2776 -10.2171 -10.2171 -9.6268 -9.6268 -0.4429 -0.4429 -0.3687 -0.3687 -0.1096 -0.1096 1.3552 1.3552 1.4661 1.4661 1.5677 1.5677 1.6947 1.6947 2.8870 2.8870 3.1212 3.1212 3.5763 3.5763 3.6448 3.6448 4.9051 4.9051 6.0125 6.0125 k =-0.0293 0.0298 0.0722 ( 10667 PWs) bands (ev): -42.5595 -42.5595 -42.4614 -42.4614 -42.3735 -42.3735 -42.2782 -42.2782 -10.2165 -10.2165 -9.6267 -9.6267 -0.4422 -0.4422 -0.3672 -0.3672 -0.1147 -0.1147 1.3129 1.3129 1.4571 1.4571 1.5723 1.5723 1.7379 1.7379 2.8871 2.8871 3.1151 3.1151 3.5757 3.5757 3.6432 3.6432 4.9247 4.9247 6.0217 6.0217 k =-0.0352 0.0358 0.0867 ( 10671 PWs) bands (ev): -42.5588 -42.5588 -42.4607 -42.4607 -42.3742 -42.3742 -42.2789 -42.2789 -10.2156 -10.2156 -9.6267 -9.6267 -0.4414 -0.4414 -0.3655 -0.3655 -0.1209 -0.1209 1.2704 1.2704 1.4461 1.4461 1.5780 1.5780 1.7816 1.7816 2.8873 2.8873 3.1080 3.1080 3.5750 3.5750 3.6412 3.6412 4.9484 4.9484 6.0329 6.0329 k =-0.0410 0.0417 0.1011 ( 10667 PWs) bands (ev): -42.5579 -42.5579 -42.4599 -42.4599 -42.3751 -42.3751 -42.2797 -42.2797 -10.2147 -10.2147 -9.6266 -9.6266 -0.4403 -0.4403 -0.3634 -0.3634 -0.1280 -0.1280 1.2277 1.2277 1.4334 1.4334 1.5846 1.5846 1.8259 1.8259 2.8874 2.8874 3.0999 3.0999 3.5742 3.5742 3.6390 3.6390 4.9762 4.9762 6.0459 6.0459 k =-0.0469 0.0477 0.1156 ( 10673 PWs) bands (ev): -42.5570 -42.5570 -42.4589 -42.4589 -42.3760 -42.3760 -42.2806 -42.2806 -10.2136 -10.2136 -9.6265 -9.6265 -0.4391 -0.4391 -0.3611 -0.3611 -0.1361 -0.1361 1.1848 1.1848 1.4188 1.4188 1.5922 1.5922 1.8709 1.8709 2.8875 2.8875 3.0910 3.0910 3.5732 3.5732 3.6365 3.6365 5.0078 5.0078 6.0607 6.0607 k =-0.0527 0.0536 0.1300 ( 10669 PWs) bands (ev): -42.5559 -42.5559 -42.4579 -42.4579 -42.3770 -42.3770 -42.2817 -42.2817 -10.2124 -10.2124 -9.6264 -9.6264 -0.4377 -0.4377 -0.3585 -0.3585 -0.1450 -0.1450 1.1418 1.1418 1.4025 1.4025 1.6007 1.6007 1.9166 1.9166 2.8875 2.8875 3.0814 3.0814 3.5720 3.5720 3.6338 3.6338 5.0432 5.0432 6.0773 6.0773 k =-0.0586 0.0596 0.1445 ( 10681 PWs) bands (ev): -42.5547 -42.5547 -42.4567 -42.4567 -42.3782 -42.3782 -42.2829 -42.2829 -10.2110 -10.2110 -9.6263 -9.6263 -0.4361 -0.4361 -0.3557 -0.3557 -0.1548 -0.1548 1.0987 1.0987 1.3845 1.3845 1.6102 1.6102 1.9632 1.9632 2.8875 2.8875 3.0713 3.0713 3.5707 3.5707 3.6309 3.6309 5.0822 5.0822 6.0954 6.0954 k =-0.0645 0.0656 0.1589 ( 10673 PWs) bands (ev): -42.5534 -42.5534 -42.4554 -42.4554 -42.3795 -42.3795 -42.2842 -42.2842 -10.2096 -10.2096 -9.6262 -9.6262 -0.4344 -0.4344 -0.3527 -0.3527 -0.1653 -0.1653 1.0555 1.0555 1.3650 1.3650 1.6206 1.6206 2.0107 2.0107 2.8873 2.8873 3.0608 3.0608 3.5692 3.5692 3.6278 3.6278 5.1248 5.1248 6.1151 6.1151 k =-0.0703 0.0715 0.1734 ( 10659 PWs) bands (ev): -42.5519 -42.5519 -42.4540 -42.4540 -42.3809 -42.3809 -42.2855 -42.2855 -10.2080 -10.2080 -9.6261 -9.6261 -0.4324 -0.4324 -0.3495 -0.3495 -0.1765 -0.1765 1.0123 1.0123 1.3439 1.3439 1.6318 1.6318 2.0592 2.0592 2.8869 2.8869 3.0502 3.0502 3.5674 3.5674 3.6246 3.6246 5.1707 5.1707 6.1361 6.1361 k =-0.0762 0.0775 0.1878 ( 10651 PWs) bands (ev): -42.5503 -42.5503 -42.4524 -42.4524 -42.3824 -42.3824 -42.2871 -42.2871 -10.2063 -10.2063 -9.6259 -9.6259 -0.4302 -0.4302 -0.3461 -0.3461 -0.1882 -0.1882 0.9692 0.9692 1.3215 1.3215 1.6439 1.6439 2.1087 2.1087 2.8863 2.8863 3.0395 3.0395 3.5655 3.5655 3.6213 3.6213 5.2199 5.2199 6.1582 6.1582 k =-0.0820 0.0835 0.2023 ( 10643 PWs) bands (ev): -42.5487 -42.5487 -42.4508 -42.4508 -42.3841 -42.3841 -42.2887 -42.2887 -10.2046 -10.2046 -9.6258 -9.6258 -0.4278 -0.4278 -0.3426 -0.3426 -0.2004 -0.2004 0.9262 0.9262 1.2977 1.2977 1.6567 1.6567 2.1592 2.1592 2.8855 2.8855 3.0289 3.0289 3.5633 3.5633 3.6180 3.6180 5.2722 5.2722 6.1813 6.1813 k =-0.0879 0.0894 0.2167 ( 10643 PWs) bands (ev): -42.5469 -42.5469 -42.4490 -42.4490 -42.3858 -42.3858 -42.2904 -42.2904 -10.2027 -10.2027 -9.6257 -9.6257 -0.4251 -0.4251 -0.3391 -0.3391 -0.2130 -0.2130 0.8835 0.8835 1.2727 1.2727 1.6704 1.6704 2.2108 2.2108 2.8843 2.8843 3.0186 3.0186 3.5608 3.5608 3.6147 3.6147 5.3276 5.3276 6.2050 6.2050 k =-0.0938 0.0954 0.2312 ( 10663 PWs) bands (ev): -42.5450 -42.5450 -42.4472 -42.4472 -42.3877 -42.3877 -42.2923 -42.2923 -10.2007 -10.2007 -9.6256 -9.6256 -0.4222 -0.4222 -0.3355 -0.3355 -0.2259 -0.2259 0.8409 0.8409 1.2466 1.2466 1.6848 1.6848 2.2634 2.2634 2.8827 2.8827 3.0087 3.0087 3.5580 3.5580 3.6115 3.6115 5.3859 5.3859 6.2289 6.2289 k =-0.0996 0.1013 0.2456 ( 10663 PWs) bands (ev): -42.5430 -42.5430 -42.4452 -42.4452 -42.3896 -42.3896 -42.2942 -42.2942 -10.1987 -10.1987 -9.6254 -9.6254 -0.4191 -0.4191 -0.3319 -0.3319 -0.2390 -0.2390 0.7988 0.7988 1.2195 1.2195 1.6998 1.6998 2.3170 2.3170 2.8808 2.8808 2.9995 2.9995 3.5550 3.5550 3.6083 3.6083 5.4471 5.4471 6.2525 6.2525 k =-0.1055 0.1073 0.2601 ( 10671 PWs) bands (ev): -42.5409 -42.5409 -42.4431 -42.4431 -42.3917 -42.3917 -42.2963 -42.2963 -10.1966 -10.1966 -9.6253 -9.6253 -0.4157 -0.4157 -0.3283 -0.3283 -0.2521 -0.2521 0.7571 0.7571 1.1914 1.1914 1.7155 1.7155 2.3714 2.3714 2.8783 2.8783 2.9911 2.9911 3.5516 3.5516 3.6054 3.6054 5.5111 5.5111 6.2749 6.2749 k =-0.1113 0.1133 0.2745 ( 10673 PWs) bands (ev): -42.5387 -42.5387 -42.4409 -42.4409 -42.3939 -42.3939 -42.2985 -42.2985 -10.1944 -10.1944 -9.6252 -9.6252 -0.4120 -0.4120 -0.3249 -0.3249 -0.2651 -0.2651 0.7159 0.7159 1.1625 1.1625 1.7318 1.7318 2.4265 2.4265 2.8754 2.8754 2.9837 2.9837 3.5479 3.5479 3.6026 3.6026 5.5778 5.5778 6.2950 6.2950 k =-0.1172 0.1192 0.2890 ( 10687 PWs) bands (ev): -42.5364 -42.5364 -42.4387 -42.4387 -42.3961 -42.3961 -42.3007 -42.3007 -10.1922 -10.1922 -9.6251 -9.6251 -0.4080 -0.4080 -0.3219 -0.3219 -0.2777 -0.2777 0.6754 0.6754 1.1329 1.1329 1.7487 1.7487 2.4821 2.4821 2.8721 2.8721 2.9774 2.9774 3.5440 3.5440 3.6000 3.6000 5.6472 5.6472 6.3112 6.3112 k =-0.1231 0.1252 0.3034 ( 10695 PWs) bands (ev): -42.5340 -42.5340 -42.4363 -42.4363 -42.3985 -42.3985 -42.3031 -42.3031 -10.1900 -10.1900 -9.6250 -9.6250 -0.4038 -0.4038 -0.3197 -0.3197 -0.2894 -0.2894 0.6356 0.6356 1.1026 1.1026 1.7661 1.7661 2.5376 2.5376 2.8684 2.8684 2.9727 2.9727 3.5398 3.5398 3.5977 3.5977 5.7191 5.7191 6.3208 6.3208 k =-0.1289 0.1311 0.3179 ( 10679 PWs) bands (ev): -42.5315 -42.5315 -42.4338 -42.4338 -42.4010 -42.4010 -42.3055 -42.3055 -10.1877 -10.1877 -9.6249 -9.6249 -0.3993 -0.3993 -0.3198 -0.3198 -0.2986 -0.2986 0.5965 0.5965 1.0718 1.0718 1.7839 1.7839 2.5925 2.5925 2.8645 2.8645 2.9698 2.9698 3.5353 3.5353 3.5955 3.5955 5.7935 5.7935 6.3205 6.3205 k =-0.1348 0.1371 0.3323 ( 10673 PWs) bands (ev): -42.5289 -42.5289 -42.4313 -42.4313 -42.4035 -42.4035 -42.3080 -42.3080 -10.1854 -10.1854 -9.6248 -9.6248 -0.3946 -0.3946 -0.3250 -0.3250 -0.3025 -0.3025 0.5584 0.5584 1.0406 1.0406 1.8021 1.8021 2.6455 2.6455 2.8608 2.8608 2.9694 2.9694 3.5307 3.5307 3.5936 3.5936 5.8704 5.8704 6.3058 6.3058 k =-0.1406 0.1431 0.3468 ( 10669 PWs) bands (ev): -42.5262 -42.5262 -42.4287 -42.4287 -42.4061 -42.4061 -42.3106 -42.3106 -10.1831 -10.1831 -9.6247 -9.6247 -0.3897 -0.3897 -0.3340 -0.3340 -0.3021 -0.3021 0.5212 0.5212 1.0090 1.0090 1.8207 1.8207 2.6947 2.6947 2.8578 2.8578 2.9729 2.9729 3.5260 3.5260 3.5918 3.5918 5.9497 5.9497 6.2728 6.2728 k =-0.1465 0.1490 0.3612 ( 10649 PWs) bands (ev): -42.5235 -42.5235 -42.4260 -42.4260 -42.4088 -42.4088 -42.3133 -42.3133 -10.1808 -10.1808 -9.6247 -9.6247 -0.3849 -0.3849 -0.3437 -0.3437 -0.3002 -0.3002 0.4850 0.4850 0.9771 0.9771 1.8395 1.8395 2.7368 2.7368 2.8562 2.8562 2.9825 2.9825 3.5212 3.5212 3.5902 3.5902 6.0313 6.0313 6.2201 6.2201 k =-0.1524 0.1550 0.3757 ( 10665 PWs) bands (ev): -42.5206 -42.5206 -42.4232 -42.4232 -42.4116 -42.4116 -42.3161 -42.3161 -10.1784 -10.1784 -9.6247 -9.6247 -0.3809 -0.3809 -0.3523 -0.3523 -0.2981 -0.2981 0.4499 0.4499 0.9450 0.9450 1.8586 1.8586 2.7675 2.7675 2.8569 2.8569 3.0012 3.0012 3.5165 3.5165 3.5888 3.5888 6.1144 6.1144 6.1507 6.1507 k =-0.1582 0.1609 0.3901 ( 10669 PWs) bands (ev): -42.5178 -42.5178 -42.4203 -42.4203 -42.4144 -42.4144 -42.3189 -42.3189 -10.1761 -10.1761 -9.6247 -9.6247 -0.3797 -0.3797 -0.3572 -0.3572 -0.2960 -0.2960 0.4159 0.4159 0.9127 0.9127 1.8778 1.8778 2.7847 2.7847 2.8596 2.8596 3.0312 3.0312 3.5118 3.5118 3.5876 3.5876 6.0664 6.0664 6.2021 6.2021 k =-0.1641 0.1669 0.4046 ( 10665 PWs) bands (ev): -42.5148 -42.5148 -42.4174 -42.4174 -42.4173 -42.4173 -42.3218 -42.3218 -10.1738 -10.1738 -9.6247 -9.6247 -0.3836 -0.3836 -0.3562 -0.3562 -0.2940 -0.2940 0.3831 0.3831 0.8805 0.8805 1.8971 1.8971 2.7910 2.7910 2.8621 2.8621 3.0714 3.0714 3.5072 3.5072 3.5865 3.5865 5.9766 5.9766 6.2905 6.2905 k =-0.1699 0.1729 0.4190 ( 10661 PWs) bands (ev): -42.5118 -42.5118 -42.4203 -42.4203 -42.4144 -42.4144 -42.3248 -42.3248 -10.1716 -10.1716 -9.6247 -9.6247 -0.3903 -0.3903 -0.3512 -0.3512 -0.2923 -0.2923 0.3516 0.3516 0.8482 0.8482 1.9165 1.9165 2.7910 2.7910 2.8628 2.8628 3.1185 3.1185 3.5028 3.5028 3.5856 3.5856 5.8840 5.8840 6.3811 6.3811 k =-0.1758 0.1788 0.4335 ( 10663 PWs) bands (ev): -42.5087 -42.5087 -42.4234 -42.4234 -42.4114 -42.4114 -42.3278 -42.3278 -10.1694 -10.1694 -9.6248 -9.6248 -0.3974 -0.3974 -0.3446 -0.3446 -0.2909 -0.2909 0.3214 0.3214 0.8161 0.8161 1.9358 1.9358 2.7877 2.7877 2.8613 2.8613 3.1689 3.1689 3.4988 3.4988 3.5848 3.5848 5.7922 5.7922 6.4738 6.4738 k =-0.1817 0.1848 0.4479 ( 10643 PWs) bands (ev): -42.5055 -42.5055 -42.4265 -42.4265 -42.4083 -42.4083 -42.3309 -42.3309 -10.1672 -10.1672 -9.6249 -9.6249 -0.4041 -0.4041 -0.3371 -0.3371 -0.2897 -0.2897 0.2926 0.2926 0.7841 0.7841 1.9550 1.9550 2.7824 2.7824 2.8583 2.8583 3.2200 3.2200 3.4953 3.4953 3.5841 3.5841 5.7040 5.7040 6.5686 6.5686 k =-0.1875 0.1907 0.4624 ( 10637 PWs) bands (ev): -42.5023 -42.5023 -42.4297 -42.4297 -42.4051 -42.4051 -42.3341 -42.3341 -10.1651 -10.1651 -9.6251 -9.6251 -0.4100 -0.4100 -0.3292 -0.3292 -0.2888 -0.2888 0.2651 0.2651 0.7523 0.7523 1.9741 1.9741 2.7755 2.7755 2.8542 2.8542 3.2696 3.2696 3.4925 3.4925 3.5836 3.5836 5.6216 5.6216 6.6653 6.6653 k =-0.1934 0.1967 0.4768 ( 10639 PWs) bands (ev): -42.4991 -42.4991 -42.4329 -42.4329 -42.4019 -42.4019 -42.3373 -42.3373 -10.1630 -10.1630 -9.6253 -9.6253 -0.4151 -0.4151 -0.3210 -0.3210 -0.2879 -0.2879 0.2390 0.2390 0.7208 0.7208 1.9929 1.9929 2.7672 2.7672 2.8495 2.8495 3.3159 3.3159 3.4907 3.4907 3.5833 3.5833 5.5468 5.5468 6.7639 6.7639 k =-0.1992 0.2027 0.4913 ( 10651 PWs) bands (ev): -42.4958 -42.4958 -42.4361 -42.4361 -42.3986 -42.3986 -42.3405 -42.3405 -10.1610 -10.1610 -9.6255 -9.6255 -0.4191 -0.4191 -0.3128 -0.3128 -0.2869 -0.2869 0.2143 0.2143 0.6896 0.6896 2.0114 2.0114 2.7571 2.7571 2.8448 2.8448 3.3571 3.3571 3.4906 3.4906 3.5831 3.5831 5.4813 5.4813 6.8642 6.8642 k =-0.2051 0.2086 0.5057 ( 10645 PWs) bands (ev): -42.4924 -42.4924 -42.4394 -42.4394 -42.3954 -42.3954 -42.3438 -42.3438 -10.1590 -10.1590 -9.6257 -9.6257 -0.4220 -0.4220 -0.3057 -0.3057 -0.2849 -0.2849 0.1911 0.1911 0.6587 0.6587 2.0295 2.0295 2.7450 2.7450 2.8404 2.8404 3.3909 3.3909 3.4930 3.4930 3.5831 3.5831 5.4269 5.4269 6.9662 6.9662 k =-0.2110 0.2146 0.5202 ( 10643 PWs) bands (ev): -42.4891 -42.4891 -42.4428 -42.4428 -42.3920 -42.3920 -42.3471 -42.3471 -10.1572 -10.1572 -9.6260 -9.6260 -0.4238 -0.4238 -0.3012 -0.3012 -0.2802 -0.2802 0.1693 0.1693 0.6283 0.6283 2.0471 2.0471 2.7304 2.7304 2.8366 2.8366 3.4153 3.4153 3.4989 3.4989 3.5833 3.5833 5.3848 5.3848 7.0696 7.0696 k =-0.2168 0.2205 0.5346 ( 10649 PWs) bands (ev): -42.4857 -42.4857 -42.4461 -42.4461 -42.3887 -42.3887 -42.3505 -42.3505 -10.1554 -10.1554 -9.6264 -9.6264 -0.4244 -0.4244 -0.3000 -0.3000 -0.2723 -0.2723 0.1490 0.1490 0.5983 0.5983 2.0642 2.0642 2.7132 2.7132 2.8337 2.8337 3.4300 3.4300 3.5079 3.5079 3.5836 3.5836 5.3562 5.3562 7.1742 7.1742 k =-0.2227 0.2265 0.5491 ( 10653 PWs) bands (ev): -42.4823 -42.4823 -42.4495 -42.4495 -42.3853 -42.3853 -42.3538 -42.3538 -10.1537 -10.1537 -9.6268 -9.6268 -0.4238 -0.4238 -0.3009 -0.3009 -0.2624 -0.2624 0.1302 0.1302 0.5688 0.5688 2.0807 2.0807 2.6931 2.6931 2.8318 2.8318 3.4374 3.4374 3.5170 3.5170 3.5842 3.5842 5.3419 5.3419 7.2799 7.2799 k =-0.2285 0.2325 0.5635 ( 10643 PWs) bands (ev): -42.4788 -42.4788 -42.4529 -42.4529 -42.3819 -42.3819 -42.3572 -42.3572 -10.1521 -10.1521 -9.6272 -9.6272 -0.4219 -0.4219 -0.3031 -0.3031 -0.2512 -0.2512 0.1130 0.1130 0.5398 0.5398 2.0966 2.0966 2.6700 2.6700 2.8309 2.8309 3.4406 3.4406 3.5230 3.5230 3.5850 3.5850 5.3423 5.3423 7.3863 7.3863 k =-0.2344 0.2384 0.5780 ( 10659 PWs) bands (ev): -42.4754 -42.4754 -42.4564 -42.4564 -42.3785 -42.3785 -42.3607 -42.3607 -10.1506 -10.1506 -9.6277 -9.6277 -0.4187 -0.4187 -0.3062 -0.3062 -0.2393 -0.2393 0.0973 0.0973 0.5114 0.5114 2.1117 2.1117 2.6439 2.6439 2.8310 2.8310 3.4415 3.4415 3.5242 3.5242 3.5860 3.5860 5.3571 5.3571 7.4929 7.4929 k =-0.2403 0.2444 0.5924 ( 10655 PWs) bands (ev): -42.4719 -42.4719 -42.4598 -42.4598 -42.3751 -42.3751 -42.3641 -42.3641 -10.1492 -10.1492 -9.6283 -9.6283 -0.4143 -0.4143 -0.3102 -0.3102 -0.2268 -0.2268 0.0833 0.0833 0.4835 0.4835 2.1261 2.1261 2.6147 2.6147 2.8320 2.8320 3.4409 3.4409 3.5209 3.5209 3.5872 3.5872 5.3858 5.3858 7.5994 7.5994 k =-0.2461 0.2504 0.6069 ( 10655 PWs) bands (ev): -42.4684 -42.4684 -42.4633 -42.4633 -42.3716 -42.3716 -42.3675 -42.3675 -10.1479 -10.1479 -9.6289 -9.6289 -0.4085 -0.4085 -0.3150 -0.3150 -0.2138 -0.2138 0.0709 0.0709 0.4562 0.4562 2.1397 2.1397 2.5824 2.5824 2.8339 2.8339 3.4387 3.4387 3.5141 3.5141 3.5884 3.5884 5.4273 5.4273 7.7051 7.7051 k =-0.2520 0.2563 0.6213 ( 10663 PWs) bands (ev): -42.4668 -42.4668 -42.4650 -42.4650 -42.3710 -42.3710 -42.3682 -42.3682 -10.1466 -10.1466 -9.6295 -9.6295 -0.4015 -0.4015 -0.3206 -0.3206 -0.2002 -0.2002 0.0602 0.0602 0.4296 0.4296 2.1524 2.1524 2.5472 2.5472 2.8367 2.8367 3.4342 3.4342 3.5056 3.5056 3.5898 3.5898 5.4804 5.4804 7.8091 7.8091 k =-0.2578 0.2623 0.6358 ( 10659 PWs) bands (ev): -42.4702 -42.4702 -42.4615 -42.4615 -42.3744 -42.3744 -42.3648 -42.3648 -10.1455 -10.1455 -9.6302 -9.6302 -0.3933 -0.3933 -0.3270 -0.3270 -0.1862 -0.1862 0.0513 0.0513 0.4035 0.4035 2.1642 2.1642 2.5091 2.5091 2.8402 2.8402 3.4264 3.4264 3.4978 3.4978 3.5915 3.5915 5.5438 5.5438 7.9104 7.9104 k =-0.2637 0.2682 0.6502 ( 10665 PWs) bands (ev): -42.4737 -42.4737 -42.4580 -42.4580 -42.3778 -42.3778 -42.3613 -42.3613 -10.1445 -10.1445 -9.6310 -9.6310 -0.3840 -0.3840 -0.3342 -0.3342 -0.1718 -0.1718 0.0442 0.0442 0.3782 0.3782 2.1750 2.1750 2.4685 2.4685 2.8445 2.8445 3.4143 3.4143 3.4927 3.4927 3.5933 3.5933 5.6161 5.6161 8.0077 8.0077 k =-0.2696 0.2742 0.6647 ( 10675 PWs) bands (ev): -42.4772 -42.4772 -42.4546 -42.4546 -42.3813 -42.3813 -42.3579 -42.3579 -10.1436 -10.1436 -9.6318 -9.6318 -0.3743 -0.3743 -0.3416 -0.3416 -0.1569 -0.1569 0.0390 0.0390 0.3534 0.3534 2.1849 2.1849 2.4256 2.4256 2.8496 2.8496 3.3983 3.3983 3.4907 3.4907 3.5954 3.5954 5.6961 5.6961 8.0993 8.0993 k =-0.2754 0.2802 0.6791 ( 10667 PWs) bands (ev): -42.4806 -42.4806 -42.4512 -42.4512 -42.3847 -42.3847 -42.3545 -42.3545 -10.1427 -10.1427 -9.6326 -9.6326 -0.3672 -0.3672 -0.3462 -0.3462 -0.1417 -0.1417 0.0357 0.0357 0.3294 0.3294 2.1938 2.1938 2.3807 2.3807 2.8552 2.8552 3.3796 3.3796 3.4915 3.4915 3.5978 3.5978 5.7827 5.7827 8.1833 8.1833 k =-0.2813 0.2861 0.6936 ( 10671 PWs) bands (ev): -42.4840 -42.4840 -42.4478 -42.4478 -42.3881 -42.3881 -42.3511 -42.3511 -10.1420 -10.1420 -9.6335 -9.6335 -0.3706 -0.3706 -0.3401 -0.3401 -0.1261 -0.1261 0.0344 0.0344 0.3060 0.3060 2.2017 2.2017 2.3341 2.3341 2.8615 2.8615 3.3595 3.3595 3.4942 3.4942 3.6004 3.6004 5.8749 5.8749 8.2577 8.2577 k =-0.2871 0.2921 0.7080 ( 10667 PWs) bands (ev): -42.4874 -42.4874 -42.4444 -42.4444 -42.3914 -42.3914 -42.3478 -42.3478 -10.1414 -10.1414 -9.6345 -9.6345 -0.3810 -0.3810 -0.3270 -0.3270 -0.1102 -0.1102 0.0350 0.0350 0.2834 0.2834 2.2085 2.2085 2.2863 2.2863 2.8684 2.8684 3.3387 3.3387 3.4985 3.4985 3.6032 3.6032 5.9718 5.9718 8.3204 8.3204 k =-0.2930 0.2980 0.7225 ( 10677 PWs) bands (ev): -42.4908 -42.4908 -42.4410 -42.4410 -42.3948 -42.3948 -42.3444 -42.3444 -10.1408 -10.1408 -9.6354 -9.6354 -0.3938 -0.3938 -0.3114 -0.3114 -0.0940 -0.0940 0.0376 0.0376 0.2614 0.2614 2.2139 2.2139 2.2381 2.2381 2.8758 2.8758 3.3179 3.3179 3.5041 3.5041 3.6064 3.6064 6.0728 6.0728 8.3700 8.3700 k =-0.2989 0.3040 0.7369 ( 10681 PWs) bands (ev): -42.4941 -42.4941 -42.4377 -42.4377 -42.3981 -42.3981 -42.3412 -42.3412 -10.1404 -10.1404 -9.6365 -9.6365 -0.4081 -0.4081 -0.2943 -0.2943 -0.0775 -0.0775 0.0422 0.0422 0.2401 0.2401 2.1871 2.1871 2.2204 2.2204 2.8837 2.8837 3.2973 3.2973 3.5107 3.5107 3.6099 3.6099 6.1770 6.1770 8.4058 8.4058 k =-0.3047 0.3100 0.7514 ( 10673 PWs) bands (ev): -42.4974 -42.4974 -42.4344 -42.4344 -42.4013 -42.4013 -42.3379 -42.3379 -10.1400 -10.1400 -9.6375 -9.6375 -0.4238 -0.4238 -0.2758 -0.2758 -0.0608 -0.0608 0.0486 0.0486 0.2196 0.2196 2.1378 2.1378 2.2241 2.2241 2.8920 2.8920 3.2772 3.2772 3.5182 3.5182 3.6137 3.6137 6.2839 6.2839 8.4280 8.4280 k =-0.3106 0.3159 0.7658 ( 10675 PWs) bands (ev): -42.5007 -42.5007 -42.4312 -42.4312 -42.4046 -42.4046 -42.3347 -42.3347 -10.1397 -10.1397 -9.6386 -9.6386 -0.4405 -0.4405 -0.2562 -0.2562 -0.0439 -0.0439 0.0568 0.0568 0.1997 0.1997 2.0882 2.0882 2.2272 2.2272 2.9008 2.9008 3.2577 3.2577 3.5265 3.5265 3.6178 3.6178 6.3930 6.3930 8.4379 8.4379 k =-0.3106 0.3159 0.7658 ( 10675 PWs) bands (ev): -42.5007 -42.5007 -42.4312 -42.4312 -42.4046 -42.4046 -42.3347 -42.3347 -10.1397 -10.1397 -9.6386 -9.6386 -0.4405 -0.4405 -0.2562 -0.2562 -0.0439 -0.0439 0.0568 0.0568 0.1997 0.1997 2.0882 2.0882 2.2272 2.2272 2.9008 2.9008 3.2577 3.2577 3.5265 3.5265 3.6178 3.6178 6.3930 6.3930 8.4379 8.4379 k =-0.3007 0.3059 0.7739 ( 10672 PWs) bands (ev): -42.5006 -42.5006 -42.4314 -42.4314 -42.4043 -42.4043 -42.3347 -42.3347 -10.1398 -10.1398 -9.6386 -9.6386 -0.4403 -0.4403 -0.2566 -0.2566 -0.0439 -0.0439 0.0547 0.0547 0.2026 0.2026 2.0888 2.0888 2.2270 2.2270 2.9007 2.9007 3.2576 3.2576 3.5264 3.5264 3.6177 3.6177 6.3899 6.3899 8.4307 8.4307 k =-0.2909 0.2959 0.7821 ( 10672 PWs) bands (ev): -42.5005 -42.5005 -42.4321 -42.4321 -42.4036 -42.4036 -42.3348 -42.3348 -10.1398 -10.1398 -9.6386 -9.6386 -0.4395 -0.4395 -0.2579 -0.2579 -0.0439 -0.0439 0.0491 0.0491 0.2105 0.2105 2.0906 2.0906 2.2264 2.2264 2.9004 2.9004 3.2573 3.2573 3.5262 3.5262 3.6177 3.6177 6.3807 6.3807 8.4104 8.4104 k =-0.2810 0.2859 0.7902 ( 10668 PWs) bands (ev): -42.5003 -42.5003 -42.4332 -42.4332 -42.4026 -42.4026 -42.3350 -42.3350 -10.1399 -10.1399 -9.6385 -9.6385 -0.4383 -0.4383 -0.2601 -0.2601 -0.0438 -0.0438 0.0408 0.0408 0.2225 0.2225 2.0935 2.0935 2.2254 2.2254 2.8999 2.8999 3.2569 3.2569 3.5258 3.5258 3.6175 3.6175 6.3655 6.3655 8.3795 8.3795 k =-0.2712 0.2758 0.7983 ( 10670 PWs) bands (ev): -42.5000 -42.5000 -42.4346 -42.4346 -42.4012 -42.4012 -42.3353 -42.3353 -10.1401 -10.1401 -9.6384 -9.6384 -0.4367 -0.4367 -0.2631 -0.2631 -0.0438 -0.0438 0.0310 0.0310 0.2376 0.2376 2.0976 2.0976 2.2239 2.2239 2.8993 2.8993 3.2564 3.2564 3.5253 3.5253 3.6173 3.6173 6.3446 6.3446 8.3407 8.3407 k =-0.2613 0.2658 0.8064 ( 10676 PWs) bands (ev): -42.4997 -42.4997 -42.4362 -42.4362 -42.3995 -42.3995 -42.3357 -42.3357 -10.1403 -10.1403 -9.6382 -9.6382 -0.4346 -0.4346 -0.2668 -0.2668 -0.0439 -0.0439 0.0206 0.0206 0.2548 0.2548 2.1029 2.1029 2.2221 2.2221 2.8985 2.8985 3.2556 3.2556 3.5247 3.5247 3.6171 3.6171 6.3184 6.3184 8.2961 8.2961 k =-0.2515 0.2558 0.8146 ( 10680 PWs) bands (ev): -42.4993 -42.4993 -42.4380 -42.4380 -42.3978 -42.3978 -42.3361 -42.3361 -10.1405 -10.1405 -9.6381 -9.6381 -0.4321 -0.4321 -0.2712 -0.2712 -0.0440 -0.0440 0.0099 0.0099 0.2737 0.2737 2.1094 2.1094 2.2198 2.2198 2.8975 2.8975 3.2547 3.2547 3.5239 3.5239 3.6168 3.6168 6.2873 6.2873 8.2473 8.2473 k =-0.2416 0.2458 0.8227 ( 10690 PWs) bands (ev): -42.4988 -42.4988 -42.4400 -42.4400 -42.3958 -42.3958 -42.3366 -42.3366 -10.1407 -10.1407 -9.6379 -9.6379 -0.4291 -0.4291 -0.2763 -0.2763 -0.0443 -0.0443 -0.0005 -0.0005 0.2937 0.2937 2.1170 2.1170 2.2172 2.2172 2.8963 2.8963 3.2537 3.2537 3.5230 3.5230 3.6165 3.6165 6.2519 6.2519 8.1952 8.1952 k =-0.2416 0.2458 0.8227 ( 10690 PWs) bands (ev): -42.4988 -42.4988 -42.4400 -42.4400 -42.3958 -42.3958 -42.3366 -42.3366 -10.1407 -10.1407 -9.6379 -9.6379 -0.4291 -0.4291 -0.2763 -0.2763 -0.0443 -0.0443 -0.0005 -0.0005 0.2937 0.2937 2.1170 2.1170 2.2172 2.2172 2.8963 2.8963 3.2537 3.2537 3.5230 3.5230 3.6165 3.6165 6.2519 6.2519 8.1952 8.1952 k =-0.2301 0.2341 0.8227 ( 10687 PWs) bands (ev): -42.4967 -42.4967 -42.4423 -42.4423 -42.3935 -42.3935 -42.3386 -42.3386 -10.1411 -10.1411 -9.6372 -9.6372 -0.4183 -0.4183 -0.2906 -0.2906 -0.0522 -0.0522 -0.0116 -0.0116 0.3182 0.3182 2.1491 2.1491 2.2139 2.2139 2.8909 2.8909 3.2623 3.2623 3.5180 3.5180 3.6143 3.6143 6.1635 6.1635 8.1616 8.1616 k =-0.2186 0.2224 0.8227 ( 10684 PWs) bands (ev): -42.4947 -42.4947 -42.4445 -42.4445 -42.3913 -42.3913 -42.3406 -42.3406 -10.1414 -10.1414 -9.6364 -9.6364 -0.4077 -0.4077 -0.3047 -0.3047 -0.0599 -0.0599 -0.0222 -0.0222 0.3429 0.3429 2.1818 2.1818 2.2106 2.2106 2.8856 2.8856 3.2711 3.2711 3.5131 3.5131 3.6122 3.6122 6.0730 6.0730 8.1294 8.1294 k =-0.2071 0.2107 0.8227 ( 10678 PWs) bands (ev): -42.4925 -42.4925 -42.4466 -42.4466 -42.3892 -42.3892 -42.3427 -42.3427 -10.1418 -10.1418 -9.6357 -9.6357 -0.3975 -0.3975 -0.3185 -0.3185 -0.0673 -0.0673 -0.0322 -0.0322 0.3677 0.3677 2.2047 2.2047 2.2178 2.2178 2.8802 2.8802 3.2801 3.2801 3.5085 3.5085 3.6103 3.6103 5.9809 5.9809 8.0989 8.0989 k =-0.1956 0.1990 0.8227 ( 10688 PWs) bands (ev): -42.4904 -42.4904 -42.4487 -42.4487 -42.3872 -42.3872 -42.3448 -42.3448 -10.1421 -10.1421 -9.6351 -9.6351 -0.3877 -0.3877 -0.3318 -0.3318 -0.0745 -0.0745 -0.0416 -0.0416 0.3924 0.3924 2.2021 2.2021 2.2510 2.2510 2.8750 2.8750 3.2893 3.2893 3.5040 3.5040 3.6086 3.6086 5.8877 5.8877 8.0703 8.0703 k =-0.1841 0.1873 0.8227 ( 10682 PWs) bands (ev): -42.4883 -42.4883 -42.4506 -42.4506 -42.3853 -42.3853 -42.3469 -42.3469 -10.1425 -10.1425 -9.6344 -9.6344 -0.3791 -0.3791 -0.3439 -0.3439 -0.0813 -0.0813 -0.0504 -0.0504 0.4169 0.4169 2.1984 2.1984 2.2858 2.2858 2.8700 2.8700 3.2989 3.2989 3.4997 3.4997 3.6070 3.6070 5.7939 5.7939 8.0436 8.0436 k =-0.1726 0.1756 0.8227 ( 10682 PWs) bands (ev): -42.4862 -42.4862 -42.4524 -42.4524 -42.3834 -42.3834 -42.3490 -42.3490 -10.1428 -10.1428 -9.6337 -9.6337 -0.3741 -0.3741 -0.3524 -0.3524 -0.0879 -0.0879 -0.0587 -0.0587 0.4411 0.4411 2.1946 2.1946 2.3209 2.3209 2.8651 2.8651 3.3089 3.3089 3.4957 3.4957 3.6055 3.6055 5.7000 5.7000 8.0189 8.0189 k =-0.1611 0.1639 0.8227 ( 10684 PWs) bands (ev): -42.4841 -42.4841 -42.4542 -42.4542 -42.3817 -42.3817 -42.3510 -42.3510 -10.1432 -10.1432 -9.6331 -9.6331 -0.3784 -0.3784 -0.3515 -0.3515 -0.0941 -0.0941 -0.0664 -0.0664 0.4646 0.4646 2.1908 2.1908 2.3560 2.3560 2.8605 2.8605 3.3193 3.3193 3.4920 3.4920 3.6042 3.6042 5.6066 5.6066 7.9962 7.9962 k =-0.1496 0.1522 0.8227 ( 10680 PWs) bands (ev): -42.4820 -42.4820 -42.4558 -42.4558 -42.3801 -42.3801 -42.3531 -42.3531 -10.1436 -10.1436 -9.6325 -9.6325 -0.3882 -0.3882 -0.3450 -0.3450 -0.0999 -0.0999 -0.0736 -0.0736 0.4875 0.4875 2.1871 2.1871 2.3909 2.3909 2.8562 2.8562 3.3302 3.3302 3.4886 3.4886 3.6030 3.6030 5.5142 5.5142 7.9755 7.9755 k =-0.1381 0.1404 0.8227 ( 10680 PWs) bands (ev): -42.4800 -42.4800 -42.4573 -42.4573 -42.3786 -42.3786 -42.3551 -42.3551 -10.1439 -10.1439 -9.6319 -9.6319 -0.3989 -0.3989 -0.3374 -0.3374 -0.1054 -0.1054 -0.0802 -0.0802 0.5095 0.5095 2.1834 2.1834 2.4250 2.4250 2.8523 2.8523 3.3418 3.3418 3.4856 3.4856 3.6019 3.6019 5.4234 5.4234 7.9568 7.9568 k =-0.1266 0.1287 0.8227 ( 10678 PWs) bands (ev): -42.4780 -42.4780 -42.4587 -42.4587 -42.3773 -42.3773 -42.3570 -42.3570 -10.1442 -10.1442 -9.6314 -9.6314 -0.4093 -0.4093 -0.3300 -0.3300 -0.1104 -0.1104 -0.0863 -0.0863 0.5304 0.5304 2.1800 2.1800 2.4582 2.4582 2.8489 2.8489 3.3538 3.3538 3.4831 3.4831 3.6009 3.6009 5.3348 5.3348 7.9401 7.9401 k =-0.1151 0.1170 0.8227 ( 10670 PWs) bands (ev): -42.4761 -42.4761 -42.4599 -42.4599 -42.3760 -42.3760 -42.3589 -42.3589 -10.1446 -10.1446 -9.6309 -9.6309 -0.4192 -0.4192 -0.3229 -0.3229 -0.1151 -0.1151 -0.0918 -0.0918 0.5501 0.5501 2.1767 2.1767 2.4898 2.4898 2.8460 2.8460 3.3664 3.3664 3.4813 3.4813 3.6001 3.6001 5.2491 5.2491 7.9253 7.9253 k =-0.1036 0.1053 0.8227 ( 10672 PWs) bands (ev): -42.4743 -42.4743 -42.4611 -42.4611 -42.3748 -42.3748 -42.3607 -42.3607 -10.1449 -10.1449 -9.6304 -9.6304 -0.4283 -0.4283 -0.3163 -0.3163 -0.1194 -0.1194 -0.0968 -0.0968 0.5685 0.5685 2.1736 2.1736 2.5196 2.5196 2.8438 2.8438 3.3792 3.3792 3.4802 3.4802 3.5994 3.5994 5.1669 5.1669 7.9124 7.9124 k =-0.0921 0.0936 0.8227 ( 10666 PWs) bands (ev): -42.4727 -42.4727 -42.4621 -42.4621 -42.3738 -42.3738 -42.3624 -42.3624 -10.1451 -10.1451 -9.6300 -9.6300 -0.4367 -0.4367 -0.3103 -0.3103 -0.1233 -0.1233 -0.1013 -0.1013 0.5854 0.5854 2.1708 2.1708 2.5470 2.5470 2.8423 2.8423 3.3919 3.3919 3.4802 3.4802 3.5988 3.5988 5.0891 5.0891 7.9013 7.9013 k =-0.0805 0.0819 0.8227 ( 10678 PWs) bands (ev): -42.4711 -42.4711 -42.4630 -42.4630 -42.3729 -42.3729 -42.3639 -42.3639 -10.1454 -10.1454 -9.6296 -9.6296 -0.4442 -0.4442 -0.3049 -0.3049 -0.1267 -0.1267 -0.1052 -0.1052 0.6007 0.6007 2.1683 2.1683 2.5715 2.5715 2.8416 2.8416 3.4040 3.4040 3.4817 3.4817 3.5984 3.5984 5.0165 5.0165 7.8920 7.8920 k =-0.0690 0.0702 0.8227 ( 10688 PWs) bands (ev): -42.4697 -42.4697 -42.4638 -42.4638 -42.3721 -42.3721 -42.3653 -42.3653 -10.1456 -10.1456 -9.6293 -9.6293 -0.4507 -0.4507 -0.3002 -0.3002 -0.1297 -0.1297 -0.1087 -0.1087 0.6142 0.6142 2.1660 2.1660 2.5930 2.5930 2.8416 2.8416 3.4145 3.4145 3.4851 3.4851 3.5980 3.5980 4.9500 4.9500 7.8844 7.8844 k =-0.0575 0.0585 0.8227 ( 10689 PWs) bands (ev): -42.4685 -42.4685 -42.4645 -42.4645 -42.3714 -42.3714 -42.3665 -42.3665 -10.1458 -10.1458 -9.6290 -9.6290 -0.4564 -0.4564 -0.2961 -0.2961 -0.1322 -0.1322 -0.1116 -0.1116 0.6258 0.6258 2.1641 2.1641 2.6110 2.6110 2.8422 2.8422 3.4228 3.4228 3.4906 3.4906 3.5978 3.5978 4.8908 4.8908 7.8785 7.8785 k =-0.0460 0.0468 0.8227 ( 10683 PWs) bands (ev): -42.4674 -42.4674 -42.4651 -42.4651 -42.3709 -42.3709 -42.3675 -42.3675 -10.1459 -10.1459 -9.6288 -9.6288 -0.4610 -0.4610 -0.2928 -0.2928 -0.1343 -0.1343 -0.1139 -0.1139 0.6355 0.6355 2.1625 2.1625 2.6256 2.6256 2.8432 2.8432 3.4286 3.4286 3.4977 3.4977 3.5977 3.5977 4.8400 4.8400 7.8739 7.8739 k =-0.0345 0.0351 0.8227 ( 10680 PWs) bands (ev): -42.4666 -42.4666 -42.4655 -42.4655 -42.3704 -42.3704 -42.3684 -42.3684 -10.1460 -10.1460 -9.6286 -9.6286 -0.4647 -0.4647 -0.2901 -0.2901 -0.1359 -0.1359 -0.1158 -0.1158 0.6431 0.6431 2.1612 2.1612 2.6367 2.6367 2.8445 2.8445 3.4323 3.4323 3.5053 3.5053 3.5977 3.5977 4.7989 4.7989 7.8707 7.8707 k =-0.0230 0.0234 0.8227 ( 10678 PWs) bands (ev): -42.4660 -42.4660 -42.4658 -42.4658 -42.3701 -42.3701 -42.3689 -42.3689 -10.1461 -10.1461 -9.6285 -9.6285 -0.4673 -0.4673 -0.2882 -0.2882 -0.1371 -0.1371 -0.1171 -0.1171 0.6486 0.6486 2.1603 2.1603 2.6445 2.6445 2.8457 2.8457 3.4345 3.4345 3.5120 3.5120 3.5977 3.5977 4.7684 4.7684 7.8686 7.8686 k =-0.0115 0.0117 0.8227 ( 10684 PWs) bands (ev): -42.4660 -42.4660 -42.4656 -42.4656 -42.3700 -42.3700 -42.3693 -42.3693 -10.1462 -10.1462 -9.6284 -9.6284 -0.4689 -0.4689 -0.2871 -0.2871 -0.1378 -0.1378 -0.1179 -0.1179 0.6519 0.6519 2.1598 2.1598 2.6490 2.6490 2.8465 2.8465 3.4355 3.4355 3.5166 3.5166 3.5978 3.5978 4.7497 4.7497 7.8674 7.8674 k = 0.0000 0.0000 0.8227 ( 10684 PWs) bands (ev): -42.4661 -42.4661 -42.4655 -42.4655 -42.3699 -42.3699 -42.3694 -42.3694 -10.1462 -10.1462 -9.6284 -9.6284 -0.4694 -0.4694 -0.2867 -0.2867 -0.1380 -0.1380 -0.1182 -0.1182 0.6530 0.6530 2.1596 2.1596 2.6506 2.6506 2.8468 2.8468 3.4359 3.4359 3.5182 3.5182 3.5978 3.5978 4.7434 4.7434 7.8670 7.8670 k = 0.0000 0.0000 0.8227 ( 10684 PWs) bands (ev): -42.4661 -42.4661 -42.4655 -42.4655 -42.3699 -42.3699 -42.3694 -42.3694 -10.1462 -10.1462 -9.6284 -9.6284 -0.4694 -0.4694 -0.2867 -0.2867 -0.1380 -0.1380 -0.1182 -0.1182 0.6530 0.6530 2.1596 2.1596 2.6506 2.6506 2.8468 2.8468 3.4359 3.4359 3.5182 3.5182 3.5978 3.5978 4.7434 4.7434 7.8670 7.8670 k = 0.0119 0.0117 0.8227 ( 10686 PWs) bands (ev): -42.4661 -42.4661 -42.4655 -42.4655 -42.3699 -42.3699 -42.3694 -42.3694 -10.1461 -10.1461 -9.6286 -9.6286 -0.4696 -0.4696 -0.2855 -0.2855 -0.1497 -0.1497 -0.1058 -0.1058 0.6528 0.6528 2.1561 2.1561 2.6516 2.6516 2.8471 2.8471 3.4350 3.4350 3.5181 3.5181 3.5966 3.5966 4.7474 4.7474 7.8621 7.8621 k = 0.0238 0.0234 0.8227 ( 10682 PWs) bands (ev): -42.4661 -42.4661 -42.4655 -42.4655 -42.3699 -42.3699 -42.3694 -42.3694 -10.1456 -10.1456 -9.6292 -9.6292 -0.4703 -0.4703 -0.2819 -0.2819 -0.1670 -0.1670 -0.0863 -0.0863 0.6521 0.6521 2.1458 2.1458 2.6547 2.6547 2.8479 2.8479 3.4322 3.4322 3.5179 3.5179 3.5930 3.5930 4.7591 4.7591 7.8475 7.8475 k = 0.0357 0.0351 0.8227 ( 10674 PWs) bands (ev): -42.4661 -42.4661 -42.4655 -42.4655 -42.3699 -42.3699 -42.3694 -42.3694 -10.1448 -10.1448 -9.6301 -9.6301 -0.4713 -0.4713 -0.2759 -0.2759 -0.1841 -0.1841 -0.0655 -0.0655 0.6510 0.6510 2.1291 2.1291 2.6595 2.6595 2.8492 2.8492 3.4275 3.4275 3.5176 3.5176 3.5874 3.5874 4.7783 4.7783 7.8236 7.8236 k = 0.0476 0.0468 0.8227 ( 10676 PWs) bands (ev): -42.4661 -42.4661 -42.4655 -42.4655 -42.3699 -42.3699 -42.3694 -42.3694 -10.1438 -10.1438 -9.6315 -9.6315 -0.4727 -0.4727 -0.2678 -0.2678 -0.2005 -0.2005 -0.0441 -0.0441 0.6493 0.6493 2.1068 2.1068 2.6655 2.6655 2.8510 2.8510 3.4208 3.4208 3.5174 3.5174 3.5801 3.5801 4.8045 4.8045 7.7911 7.7911 k = 0.0595 0.0585 0.8227 ( 10674 PWs) bands (ev): -42.4661 -42.4661 -42.4655 -42.4655 -42.3699 -42.3699 -42.3694 -42.3694 -10.1425 -10.1425 -9.6331 -9.6331 -0.4746 -0.4746 -0.2578 -0.2578 -0.2156 -0.2156 -0.0222 -0.0222 0.6472 0.6472 2.0796 2.0796 2.6722 2.6722 2.8532 2.8532 3.4122 3.4122 3.5174 3.5174 3.5716 3.5716 4.8369 4.8369 7.7507 7.7507 k = 0.0714 0.0702 0.8227 ( 10676 PWs) bands (ev): -42.4661 -42.4661 -42.4655 -42.4655 -42.3699 -42.3699 -42.3694 -42.3694 -10.1409 -10.1409 -9.6351 -9.6351 -0.4767 -0.4767 -0.2477 -0.2477 -0.2279 -0.2279 0.0001 0.0001 0.6446 0.6446 2.0485 2.0485 2.6791 2.6791 2.8558 2.8558 3.4016 3.4016 3.5176 3.5176 3.5625 3.5625 4.8749 4.8749 7.7034 7.7034 k = 0.0833 0.0819 0.8227 ( 10670 PWs) bands (ev): -42.4660 -42.4660 -42.4655 -42.4655 -42.3699 -42.3699 -42.3695 -42.3695 -10.1392 -10.1392 -9.6373 -9.6373 -0.4791 -0.4791 -0.2492 -0.2492 -0.2257 -0.2257 0.0225 0.0225 0.6415 0.6415 2.0143 2.0143 2.6859 2.6859 2.8588 2.8588 3.3895 3.3895 3.5180 3.5180 3.5531 3.5531 4.9177 4.9177 7.6503 7.6503 k = 0.0952 0.0936 0.8227 ( 10666 PWs) bands (ev): -42.4660 -42.4660 -42.4656 -42.4656 -42.3699 -42.3699 -42.3695 -42.3695 -10.1372 -10.1372 -9.6398 -9.6398 -0.4818 -0.4818 -0.2603 -0.2603 -0.2113 -0.2113 0.0449 0.0449 0.6378 0.6378 1.9777 1.9777 2.6924 2.6924 2.8619 2.8619 3.3761 3.3761 3.5185 3.5185 3.5438 3.5438 4.9644 4.9644 7.5923 7.5923 k = 0.1071 0.1053 0.8227 ( 10676 PWs) bands (ev): -42.4660 -42.4660 -42.4656 -42.4656 -42.3698 -42.3698 -42.3695 -42.3695 -10.1351 -10.1351 -9.6424 -9.6424 -0.4847 -0.4847 -0.2717 -0.2717 -0.1942 -0.1942 0.0673 0.0673 0.6336 0.6336 1.9395 1.9395 2.6984 2.6984 2.8652 2.8652 3.3619 3.3619 3.5184 3.5184 3.5353 3.5353 5.0144 5.0144 7.5306 7.5306 k = 0.1190 0.1170 0.8227 ( 10664 PWs) bands (ev): -42.4660 -42.4660 -42.4656 -42.4656 -42.3698 -42.3698 -42.3695 -42.3695 -10.1330 -10.1330 -9.6452 -9.6452 -0.4876 -0.4876 -0.2823 -0.2823 -0.1758 -0.1758 0.0894 0.0894 0.6288 0.6288 1.9005 1.9005 2.7038 2.7038 2.8686 2.8686 3.3474 3.3474 3.5163 3.5163 3.5294 3.5294 5.0667 5.0667 7.4662 7.4662 k = 0.1310 0.1287 0.8227 ( 10664 PWs) bands (ev): -42.4660 -42.4660 -42.4656 -42.4656 -42.3698 -42.3698 -42.3695 -42.3695 -10.1307 -10.1307 -9.6480 -9.6480 -0.4907 -0.4907 -0.2921 -0.2921 -0.1565 -0.1565 0.1110 0.1110 0.6235 0.6235 1.8614 1.8614 2.7085 2.7085 2.8719 2.8719 3.3329 3.3329 3.5105 3.5105 3.5275 3.5275 5.1205 5.1205 7.4003 7.4003 k = 0.1429 0.1404 0.8227 ( 10682 PWs) bands (ev): -42.4660 -42.4660 -42.4656 -42.4656 -42.3698 -42.3698 -42.3695 -42.3695 -10.1285 -10.1285 -9.6508 -9.6508 -0.4937 -0.4937 -0.3009 -0.3009 -0.1368 -0.1368 0.1320 0.1320 0.6178 0.6178 1.8230 1.8230 2.7126 2.7126 2.8751 2.8751 3.3189 3.3189 3.5029 3.5029 3.5279 3.5279 5.1751 5.1751 7.3341 7.3341 k = 0.1548 0.1522 0.8227 ( 10692 PWs) bands (ev): -42.4660 -42.4660 -42.4656 -42.4656 -42.3698 -42.3698 -42.3695 -42.3695 -10.1263 -10.1263 -9.6535 -9.6535 -0.4966 -0.4966 -0.3087 -0.3087 -0.1172 -0.1172 0.1522 0.1522 0.6118 0.6118 1.7859 1.7859 2.7162 2.7162 2.8781 2.8781 3.3056 3.3056 3.4952 3.4952 3.5290 3.5290 5.2294 5.2294 7.2687 7.2687 k = 0.1667 0.1639 0.8227 ( 10704 PWs) bands (ev): -42.4660 -42.4660 -42.4656 -42.4656 -42.3698 -42.3698 -42.3695 -42.3695 -10.1243 -10.1243 -9.6561 -9.6561 -0.4994 -0.4994 -0.3155 -0.3155 -0.0981 -0.0981 0.1712 0.1712 0.6055 0.6055 1.7508 1.7508 2.7192 2.7192 2.8808 2.8808 3.2935 3.2935 3.4879 3.4879 3.5302 3.5302 5.2824 5.2824 7.2054 7.2054 k = 0.1786 0.1756 0.8227 ( 10698 PWs) bands (ev): -42.4660 -42.4660 -42.4656 -42.4656 -42.3698 -42.3698 -42.3695 -42.3695 -10.1223 -10.1223 -9.6585 -9.6585 -0.5019 -0.5019 -0.3215 -0.3215 -0.0801 -0.0801 0.1888 0.1888 0.5992 0.5992 1.7186 1.7186 2.7217 2.7217 2.8833 2.8833 3.2826 3.2826 3.4813 3.4813 3.5314 3.5314 5.3329 5.3329 7.1456 7.1456 k = 0.1905 0.1873 0.8227 ( 10696 PWs) bands (ev): -42.4660 -42.4660 -42.4656 -42.4656 -42.3698 -42.3698 -42.3695 -42.3695 -10.1206 -10.1206 -9.6606 -9.6606 -0.5042 -0.5042 -0.3264 -0.3264 -0.0637 -0.0637 0.2046 0.2046 0.5931 0.5931 1.6898 1.6898 2.7237 2.7237 2.8854 2.8854 3.2731 3.2731 3.4754 3.4754 3.5325 3.5325 5.3796 5.3796 7.0908 7.0908 k = 0.2024 0.1990 0.8227 ( 10696 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1192 -10.1192 -9.6625 -9.6625 -0.5061 -0.5061 -0.3304 -0.3304 -0.0494 -0.0494 0.2184 0.2184 0.5875 0.5875 1.6652 1.6652 2.7253 2.7253 2.8871 2.8871 3.2652 3.2652 3.4704 3.4704 3.5335 3.5335 5.4210 5.4210 7.0425 7.0425 k = 0.2143 0.2107 0.8227 ( 10696 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1180 -10.1180 -9.6639 -9.6639 -0.5077 -0.5077 -0.3336 -0.3336 -0.0376 -0.0376 0.2296 0.2296 0.5826 0.5826 1.6454 1.6454 2.7266 2.7266 2.8885 2.8885 3.2590 3.2590 3.4664 3.4664 3.5343 3.5343 5.4555 5.4555 7.0026 7.0026 k = 0.2262 0.2224 0.8227 ( 10686 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1171 -10.1171 -9.6650 -9.6650 -0.5088 -0.5088 -0.3358 -0.3358 -0.0289 -0.0289 0.2380 0.2380 0.5789 0.5789 1.6308 1.6308 2.7274 2.7274 2.8895 2.8895 3.2545 3.2545 3.4635 3.4635 3.5349 3.5349 5.4816 5.4816 6.9725 6.9725 k = 0.2381 0.2341 0.8227 ( 10678 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1166 -10.1166 -9.6657 -9.6657 -0.5095 -0.5095 -0.3371 -0.3371 -0.0235 -0.0235 0.2431 0.2431 0.5765 0.5765 1.6219 1.6219 2.7279 2.7279 2.8901 2.8901 3.2518 3.2518 3.4618 3.4618 3.5352 3.5352 5.4979 5.4979 6.9538 6.9538 k = 0.2500 0.2458 0.8227 ( 10672 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1164 -10.1164 -9.6659 -9.6659 -0.5098 -0.5098 -0.3376 -0.3376 -0.0217 -0.0217 0.2449 0.2449 0.5756 0.5756 1.6189 1.6189 2.7281 2.7281 2.8903 2.8903 3.2509 3.2509 3.4612 3.4612 3.5353 3.5353 5.5034 5.5034 6.9475 6.9475 k = 0.2500 0.2458 0.8227 ( 10672 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1164 -10.1164 -9.6659 -9.6659 -0.5098 -0.5098 -0.3376 -0.3376 -0.0217 -0.0217 0.2449 0.2449 0.5756 0.5756 1.6189 1.6189 2.7281 2.7281 2.8903 2.8903 3.2509 3.2509 3.4612 3.4612 3.5353 3.5353 5.5034 5.5034 6.9475 6.9475 k = 0.2400 0.2560 0.8145 ( 10674 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1164 -10.1164 -9.6659 -9.6659 -0.5097 -0.5097 -0.3373 -0.3373 -0.0217 -0.0217 0.2445 0.2445 0.5755 0.5755 1.6190 1.6190 2.7267 2.7267 2.8895 2.8895 3.2524 3.2524 3.4618 3.4618 3.5355 3.5355 5.5038 5.5038 6.9495 6.9495 k = 0.2300 0.2661 0.8062 ( 10674 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1164 -10.1164 -9.6659 -9.6659 -0.5093 -0.5093 -0.3365 -0.3365 -0.0217 -0.0217 0.2434 0.2434 0.5751 0.5751 1.6196 1.6196 2.7225 2.7225 2.8871 2.8871 3.2566 3.2566 3.4636 3.4636 3.5363 3.5363 5.5049 5.5049 6.9555 6.9555 k = 0.2200 0.2763 0.7980 ( 10682 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1164 -10.1164 -9.6659 -9.6659 -0.5088 -0.5088 -0.3353 -0.3353 -0.0217 -0.0217 0.2415 0.2415 0.5745 0.5745 1.6205 1.6205 2.7159 2.7159 2.8831 2.8831 3.2633 3.2633 3.4666 3.4666 3.5375 3.5375 5.5066 5.5066 6.9654 6.9654 k = 0.2100 0.2865 0.7897 ( 10686 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1164 -10.1164 -9.6660 -9.6660 -0.5081 -0.5081 -0.3335 -0.3335 -0.0218 -0.0218 0.2389 0.2389 0.5735 0.5735 1.6217 1.6217 2.7070 2.7070 2.8778 2.8778 3.2721 3.2721 3.4707 3.4707 3.5392 3.5392 5.5090 5.5090 6.9794 6.9794 k = 0.2000 0.2966 0.7814 ( 10682 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1165 -10.1165 -9.6660 -9.6660 -0.5071 -0.5071 -0.3313 -0.3313 -0.0218 -0.0218 0.2356 0.2356 0.5724 0.5724 1.6232 1.6232 2.6961 2.6961 2.8712 2.8712 3.2826 3.2826 3.4757 3.4757 3.5416 3.5416 5.5120 5.5120 6.9973 6.9973 k = 0.1900 0.3068 0.7732 ( 10678 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1165 -10.1165 -9.6660 -9.6660 -0.5060 -0.5060 -0.3287 -0.3287 -0.0218 -0.0218 0.2316 0.2316 0.5710 0.5710 1.6250 1.6250 2.6838 2.6838 2.8636 2.8636 3.2943 3.2943 3.4814 3.4814 3.5445 3.5445 5.5157 5.5157 7.0192 7.0192 k = 0.1800 0.3170 0.7649 ( 10678 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1165 -10.1165 -9.6661 -9.6661 -0.5048 -0.5048 -0.3256 -0.3256 -0.0218 -0.0218 0.2270 0.2270 0.5694 0.5694 1.6270 1.6270 2.6703 2.6703 2.8552 2.8552 3.3068 3.3068 3.4877 3.4877 3.5482 3.5482 5.5198 5.5198 7.0450 7.0450 k = 0.1700 0.3272 0.7567 ( 10682 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1166 -10.1166 -9.6661 -9.6661 -0.5034 -0.5034 -0.3221 -0.3221 -0.0218 -0.0218 0.2219 0.2219 0.5677 0.5677 1.6293 1.6293 2.6560 2.6560 2.8463 2.8463 3.3197 3.3197 3.4944 3.4944 3.5525 3.5525 5.5244 5.5244 7.0746 7.0746 k = 0.1600 0.3373 0.7484 ( 10682 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1166 -10.1166 -9.6662 -9.6662 -0.5018 -0.5018 -0.3182 -0.3182 -0.0218 -0.0218 0.2163 0.2163 0.5658 0.5658 1.6318 1.6318 2.6412 2.6412 2.8368 2.8368 3.3325 3.3325 3.5014 3.5014 3.5575 3.5575 5.5295 5.5295 7.1080 7.1080 k = 0.1500 0.3475 0.7402 ( 10680 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1167 -10.1167 -9.6662 -9.6662 -0.5002 -0.5002 -0.3141 -0.3141 -0.0218 -0.0218 0.2103 0.2103 0.5637 0.5637 1.6344 1.6344 2.6262 2.6262 2.8271 2.8271 3.3450 3.3450 3.5086 3.5086 3.5632 3.5632 5.5348 5.5348 7.1452 7.1452 k = 0.1400 0.3577 0.7319 ( 10678 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1167 -10.1167 -9.6663 -9.6663 -0.4985 -0.4985 -0.3096 -0.3096 -0.0217 -0.0217 0.2040 0.2040 0.5616 0.5616 1.6371 1.6371 2.6113 2.6113 2.8173 2.8173 3.3568 3.3568 3.5158 3.5158 3.5695 3.5695 5.5404 5.5404 7.1860 7.1860 k = 0.1300 0.3678 0.7237 ( 10678 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3695 -42.3695 -10.1168 -10.1168 -9.6663 -9.6663 -0.4968 -0.4968 -0.3050 -0.3050 -0.0217 -0.0217 0.1974 0.1974 0.5594 0.5594 1.6399 1.6399 2.5967 2.5967 2.8076 2.8076 3.3678 3.3678 3.5230 3.5230 3.5763 3.5763 5.5462 5.5462 7.2304 7.2304 k = 0.1200 0.3780 0.7154 ( 10672 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3695 -42.3695 -10.1168 -10.1168 -9.6664 -9.6664 -0.4950 -0.4950 -0.3002 -0.3002 -0.0217 -0.0217 0.1907 0.1907 0.5571 0.5571 1.6427 1.6427 2.5825 2.5825 2.7980 2.7980 3.3778 3.3778 3.5302 3.5302 3.5834 3.5834 5.5520 5.5520 7.2783 7.2783 k = 0.1100 0.3882 0.7072 ( 10682 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3695 -42.3695 -10.1169 -10.1169 -9.6664 -9.6664 -0.4932 -0.4932 -0.2953 -0.2953 -0.0217 -0.0217 0.1839 0.1839 0.5549 0.5549 1.6454 1.6454 2.5690 2.5690 2.7888 2.7888 3.3867 3.3867 3.5373 3.5373 3.5906 3.5906 5.5579 5.5579 7.3295 7.3295 k = 0.1000 0.3984 0.6989 ( 10690 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3695 -42.3695 -10.1170 -10.1170 -9.6665 -9.6665 -0.4915 -0.4915 -0.2905 -0.2905 -0.0216 -0.0216 0.1771 0.1771 0.5527 0.5527 1.6481 1.6481 2.5563 2.5563 2.7800 2.7800 3.3945 3.3945 3.5442 3.5442 3.5979 3.5979 5.5636 5.5636 7.3839 7.3839 k = 0.0900 0.4085 0.6907 ( 10684 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3695 -42.3695 -10.1170 -10.1170 -9.6665 -9.6665 -0.4899 -0.4899 -0.2857 -0.2857 -0.0216 -0.0216 0.1705 0.1705 0.5505 0.5505 1.6507 1.6507 2.5445 2.5445 2.7717 2.7717 3.4013 3.4013 3.5509 3.5509 3.6050 3.6050 5.5691 5.5691 7.4413 7.4413 k = 0.0800 0.4187 0.6824 ( 10686 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3695 -42.3695 -10.1171 -10.1171 -9.6666 -9.6666 -0.4883 -0.4883 -0.2810 -0.2810 -0.0215 -0.0215 0.1642 0.1642 0.5485 0.5485 1.6531 1.6531 2.5336 2.5336 2.7641 2.7641 3.4070 3.4070 3.5572 3.5572 3.6118 3.6118 5.5743 5.5743 7.5014 7.5014 k = 0.0700 0.4289 0.6742 ( 10680 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3694 -42.3694 -10.1171 -10.1171 -9.6666 -9.6666 -0.4868 -0.4868 -0.2766 -0.2766 -0.0215 -0.0215 0.1583 0.1583 0.5467 0.5467 1.6553 1.6553 2.5239 2.5239 2.7572 2.7572 3.4118 3.4118 3.5630 3.5630 3.6182 3.6182 5.5791 5.5791 7.5642 7.5642 k = 0.0600 0.4390 0.6659 ( 10674 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3694 -42.3694 -10.1171 -10.1171 -9.6666 -9.6666 -0.4855 -0.4855 -0.2726 -0.2726 -0.0214 -0.0214 0.1528 0.1528 0.5450 0.5450 1.6573 1.6573 2.5153 2.5153 2.7510 2.7510 3.4158 3.4158 3.5683 3.5683 3.6239 3.6239 5.5835 5.5835 7.6292 7.6292 k = 0.0500 0.4492 0.6577 ( 10676 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3694 -42.3694 -10.1172 -10.1172 -9.6667 -9.6667 -0.4844 -0.4844 -0.2689 -0.2689 -0.0214 -0.0214 0.1480 0.1480 0.5435 0.5435 1.6590 1.6590 2.5080 2.5080 2.7457 2.7457 3.4189 3.4189 3.5729 3.5729 3.6289 3.6289 5.5873 5.5873 7.6962 7.6962 k = 0.0400 0.4594 0.6494 ( 10682 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3694 -42.3694 -10.1172 -10.1172 -9.6667 -9.6667 -0.4834 -0.4834 -0.2658 -0.2658 -0.0213 -0.0213 0.1439 0.1439 0.5422 0.5422 1.6605 1.6605 2.5019 2.5019 2.7413 2.7413 3.4214 3.4214 3.5768 3.5768 3.6332 3.6332 5.5905 5.5905 7.7647 7.7647 k = 0.0300 0.4696 0.6412 ( 10668 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3694 -42.3694 -10.1172 -10.1172 -9.6667 -9.6667 -0.4826 -0.4826 -0.2633 -0.2633 -0.0213 -0.0213 0.1405 0.1405 0.5412 0.5412 1.6617 1.6617 2.4972 2.4972 2.7378 2.7378 3.4233 3.4233 3.5799 3.5799 3.6366 3.6366 5.5931 5.5931 7.8342 7.8342 k = 0.0200 0.4797 0.6329 ( 10674 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3694 -42.3694 -10.1173 -10.1173 -9.6668 -9.6668 -0.4821 -0.4821 -0.2614 -0.2614 -0.0213 -0.0213 0.1381 0.1381 0.5405 0.5405 1.6625 1.6625 2.4938 2.4938 2.7353 2.7353 3.4246 3.4246 3.5822 3.5822 3.6390 3.6390 5.5949 5.5949 7.9038 7.9038 k = 0.0100 0.4899 0.6247 ( 10670 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3694 -42.3694 -10.1173 -10.1173 -9.6668 -9.6668 -0.4817 -0.4817 -0.2603 -0.2603 -0.0213 -0.0213 0.1366 0.1366 0.5401 0.5401 1.6630 1.6630 2.4917 2.4917 2.7338 2.7338 3.4254 3.4254 3.5835 3.5835 3.6405 3.6405 5.5961 5.5961 7.9704 7.9704 k = 0.0000 0.5001 0.6164 ( 10672 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3694 -42.3694 -10.1173 -10.1173 -9.6668 -9.6668 -0.4816 -0.4816 -0.2599 -0.2599 -0.0213 -0.0213 0.1361 0.1361 0.5399 0.5399 1.6632 1.6632 2.4910 2.4910 2.7333 2.7333 3.4257 3.4257 3.5840 3.5840 3.6410 3.6410 5.5965 5.5965 8.0116 8.0116 k = 0.0000 0.5001 0.6164 ( 10672 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3697 -42.3697 -42.3694 -42.3694 -10.1173 -10.1173 -9.6668 -9.6668 -0.4816 -0.4816 -0.2599 -0.2599 -0.0213 -0.0213 0.1361 0.1361 0.5399 0.5399 1.6632 1.6632 2.4910 2.4910 2.7333 2.7333 3.4257 3.4257 3.5840 3.5840 3.6410 3.6410 5.5965 5.5965 8.0116 8.0116 k = 0.0129 0.5077 0.6102 ( 10667 PWs) bands (ev): -42.4674 -42.4674 -42.4644 -42.4644 -42.3711 -42.3711 -42.3681 -42.3681 -10.1174 -10.1174 -9.6666 -9.6666 -0.4811 -0.4811 -0.2595 -0.2595 -0.0235 -0.0235 0.1363 0.1363 0.5389 0.5389 1.6648 1.6648 2.4912 2.4912 2.7339 2.7339 3.4255 3.4255 3.5836 3.5836 3.6400 3.6400 5.5987 5.5987 8.0129 8.0129 k = 0.0259 0.5154 0.6040 ( 10673 PWs) bands (ev): -42.4688 -42.4688 -42.4629 -42.4629 -42.3726 -42.3726 -42.3666 -42.3666 -10.1177 -10.1177 -9.6662 -9.6662 -0.4795 -0.4795 -0.2581 -0.2581 -0.0300 -0.0300 0.1369 0.1369 0.5360 0.5360 1.6697 1.6697 2.4917 2.4917 2.7359 2.7359 3.4251 3.4251 3.5823 3.5823 3.6369 3.6369 5.6054 5.6054 8.0169 8.0169 k = 0.0388 0.5231 0.5977 ( 10683 PWs) bands (ev): -42.4703 -42.4703 -42.4615 -42.4615 -42.3741 -42.3741 -42.3651 -42.3651 -10.1182 -10.1182 -9.6655 -9.6655 -0.4768 -0.4768 -0.2558 -0.2558 -0.0405 -0.0405 0.1375 0.1375 0.5312 0.5312 1.6778 1.6778 2.4924 2.4924 2.7390 2.7390 3.4245 3.4245 3.5799 3.5799 3.6322 3.6322 5.6163 5.6163 8.0233 8.0233 k = 0.0518 0.5308 0.5915 ( 10680 PWs) bands (ev): -42.4718 -42.4718 -42.4600 -42.4600 -42.3756 -42.3756 -42.3636 -42.3636 -10.1189 -10.1189 -9.6646 -9.6646 -0.4731 -0.4731 -0.2526 -0.2526 -0.0543 -0.0543 0.1378 0.1378 0.5245 0.5245 1.6889 1.6889 2.4933 2.4933 2.7434 2.7434 3.4234 3.4234 3.5761 3.5761 3.6265 3.6265 5.6314 5.6314 8.0324 8.0324 k = 0.0647 0.5384 0.5853 ( 10680 PWs) bands (ev): -42.4733 -42.4733 -42.4585 -42.4585 -42.3770 -42.3770 -42.3621 -42.3621 -10.1198 -10.1198 -9.6634 -9.6634 -0.4684 -0.4684 -0.2484 -0.2484 -0.0709 -0.0709 0.1375 0.1375 0.5160 0.5160 1.7028 1.7028 2.4940 2.4940 2.7489 2.7489 3.4218 3.4218 3.5704 3.5704 3.6209 3.6209 5.6504 5.6504 8.0439 8.0439 k = 0.0776 0.5461 0.5791 ( 10684 PWs) bands (ev): -42.4747 -42.4747 -42.4570 -42.4570 -42.3785 -42.3785 -42.3606 -42.3606 -10.1209 -10.1209 -9.6620 -9.6620 -0.4627 -0.4627 -0.2434 -0.2434 -0.0897 -0.0897 0.1363 0.1363 0.5059 0.5059 1.7193 1.7193 2.4944 2.4944 2.7553 2.7553 3.4196 3.4196 3.5627 3.5627 3.6159 3.6159 5.6730 5.6730 8.0578 8.0578 k = 0.0906 0.5538 0.5728 ( 10688 PWs) bands (ev): -42.4762 -42.4762 -42.4556 -42.4556 -42.3800 -42.3800 -42.3591 -42.3591 -10.1221 -10.1221 -9.6604 -9.6604 -0.4559 -0.4559 -0.2376 -0.2376 -0.1103 -0.1103 0.1342 0.1342 0.4941 0.4941 1.7382 1.7382 2.4941 2.4941 2.7627 2.7627 3.4165 3.4165 3.5533 3.5533 3.6120 3.6120 5.6988 5.6988 8.0740 8.0740 k = 0.1035 0.5615 0.5666 ( 10692 PWs) bands (ev): -42.4777 -42.4777 -42.4541 -42.4541 -42.3815 -42.3815 -42.3576 -42.3576 -10.1234 -10.1234 -9.6587 -9.6587 -0.4482 -0.4482 -0.2309 -0.2309 -0.1321 -0.1321 0.1311 0.1311 0.4808 0.4808 1.7591 1.7591 2.4929 2.4929 2.7709 2.7709 3.4122 3.4122 3.5430 3.5430 3.6093 3.6093 5.7275 5.7275 8.0924 8.0924 k = 0.1165 0.5691 0.5604 ( 10688 PWs) bands (ev): -42.4792 -42.4792 -42.4526 -42.4526 -42.3830 -42.3830 -42.3562 -42.3562 -10.1248 -10.1248 -9.6568 -9.6568 -0.4396 -0.4396 -0.2236 -0.2236 -0.1547 -0.1547 0.1270 0.1270 0.4661 0.4661 1.7818 1.7818 2.4904 2.4904 2.7797 2.7797 3.4065 3.4065 3.5327 3.5327 3.6073 3.6073 5.7588 5.7588 8.1128 8.1128 k = 0.1294 0.5768 0.5542 ( 10687 PWs) bands (ev): -42.4806 -42.4806 -42.4512 -42.4512 -42.3845 -42.3845 -42.3547 -42.3547 -10.1263 -10.1263 -9.6549 -9.6549 -0.4302 -0.4302 -0.2161 -0.2161 -0.1772 -0.1772 0.1220 0.1220 0.4502 0.4502 1.8061 1.8061 2.4862 2.4862 2.7889 2.7889 3.3991 3.3991 3.5235 3.5235 3.6060 3.6060 5.7925 5.7925 8.1350 8.1350 k = 0.1424 0.5845 0.5479 ( 10693 PWs) bands (ev): -42.4821 -42.4821 -42.4497 -42.4497 -42.3860 -42.3860 -42.3532 -42.3532 -10.1278 -10.1278 -9.6529 -9.6529 -0.4199 -0.4199 -0.2134 -0.2134 -0.1944 -0.1944 0.1162 0.1162 0.4332 0.4332 1.8315 1.8315 2.4800 2.4800 2.7986 2.7986 3.3901 3.3901 3.5159 3.5159 3.6052 3.6052 5.8281 5.8281 8.1589 8.1589 k = 0.1553 0.5921 0.5417 ( 10689 PWs) bands (ev): -42.4835 -42.4835 -42.4483 -42.4483 -42.3874 -42.3874 -42.3518 -42.3518 -10.1293 -10.1293 -9.6509 -9.6509 -0.4089 -0.4089 -0.2299 -0.2299 -0.1915 -0.1915 0.1098 0.1098 0.4152 0.4152 1.8578 1.8578 2.4715 2.4715 2.8084 2.8084 3.3796 3.3796 3.5101 3.5101 3.6047 3.6047 5.8655 5.8655 8.1842 8.1842 k = 0.1682 0.5998 0.5355 ( 10679 PWs) bands (ev): -42.4850 -42.4850 -42.4468 -42.4468 -42.3889 -42.3889 -42.3503 -42.3503 -10.1308 -10.1308 -9.6489 -9.6489 -0.3973 -0.3973 -0.2521 -0.2521 -0.1817 -0.1817 0.1029 0.1029 0.3964 0.3964 1.8848 1.8848 2.4604 2.4604 2.8183 2.8183 3.3681 3.3681 3.5063 3.5063 3.6046 3.6046 5.9045 5.9045 8.2106 8.2106 k = 0.1812 0.6075 0.5293 ( 10680 PWs) bands (ev): -42.4864 -42.4864 -42.4454 -42.4454 -42.3903 -42.3903 -42.3488 -42.3488 -10.1322 -10.1322 -9.6471 -9.6471 -0.3853 -0.3853 -0.2745 -0.2745 -0.1704 -0.1704 0.0957 0.0957 0.3770 0.3770 1.9121 1.9121 2.4465 2.4465 2.8281 2.8281 3.3562 3.3562 3.5041 3.5041 3.6047 3.6047 5.9447 5.9447 8.2377 8.2377 k = 0.1941 0.6152 0.5230 ( 10687 PWs) bands (ev): -42.4879 -42.4879 -42.4439 -42.4439 -42.3918 -42.3918 -42.3474 -42.3474 -10.1336 -10.1336 -9.6453 -9.6453 -0.3731 -0.3731 -0.2959 -0.2959 -0.1582 -0.1582 0.0884 0.0884 0.3571 0.3571 1.9395 1.9395 2.4297 2.4297 2.8378 2.8378 3.3442 3.3442 3.5034 3.5034 3.6052 3.6052 5.9861 5.9861 8.2652 8.2652 k = 0.2071 0.6228 0.5168 ( 10680 PWs) bands (ev): -42.4893 -42.4893 -42.4425 -42.4425 -42.3932 -42.3932 -42.3460 -42.3460 -10.1349 -10.1349 -9.6436 -9.6436 -0.3619 -0.3619 -0.3152 -0.3152 -0.1453 -0.1453 0.0812 0.0812 0.3369 0.3369 1.9666 1.9666 2.4100 2.4100 2.8471 2.8471 3.3325 3.3325 3.5037 3.5037 3.6058 3.6058 6.0285 6.0285 8.2927 8.2927 k = 0.2200 0.6305 0.5106 ( 10686 PWs) bands (ev): -42.4908 -42.4908 -42.4411 -42.4411 -42.3947 -42.3947 -42.3445 -42.3445 -10.1360 -10.1360 -9.6422 -9.6422 -0.3563 -0.3563 -0.3275 -0.3275 -0.1319 -0.1319 0.0743 0.0743 0.3166 0.3166 1.9933 1.9933 2.3874 2.3874 2.8560 2.8560 3.3214 3.3214 3.5050 3.5050 3.6067 3.6067 6.0719 6.0719 8.3195 8.3195 k = 0.2329 0.6382 0.5044 ( 10684 PWs) bands (ev): -42.4922 -42.4922 -42.4396 -42.4396 -42.3961 -42.3961 -42.3431 -42.3431 -10.1371 -10.1371 -9.6409 -9.6409 -0.3654 -0.3654 -0.3238 -0.3238 -0.1181 -0.1181 0.0679 0.0679 0.2965 0.2965 2.0191 2.0191 2.3623 2.3623 2.8644 2.8644 3.3108 3.3108 3.5069 3.5069 3.6079 3.6079 6.1160 6.1160 8.3451 8.3451 k = 0.2459 0.6459 0.4981 ( 10676 PWs) bands (ev): -42.4936 -42.4936 -42.4382 -42.4382 -42.3976 -42.3976 -42.3417 -42.3417 -10.1380 -10.1380 -9.6399 -9.6399 -0.3805 -0.3805 -0.3126 -0.3126 -0.1041 -0.1041 0.0624 0.0624 0.2767 0.2767 2.0436 2.0436 2.3350 2.3350 2.8723 2.8723 3.3010 3.3010 3.5094 3.5094 3.6092 3.6092 6.1608 6.1608 8.3690 8.3690 k = 0.2588 0.6535 0.4919 ( 10679 PWs) bands (ev): -42.4950 -42.4950 -42.4368 -42.4368 -42.3990 -42.3990 -42.3403 -42.3403 -10.1387 -10.1387 -9.6391 -9.6391 -0.3956 -0.3956 -0.3003 -0.3003 -0.0901 -0.0901 0.0579 0.0579 0.2577 0.2577 2.0662 2.0662 2.3062 2.3062 2.8794 2.8794 3.2917 3.2917 3.5124 3.5124 3.6107 3.6107 6.2063 6.2063 8.3905 8.3905 k = 0.2718 0.6612 0.4857 ( 10682 PWs) bands (ev): -42.4965 -42.4965 -42.4354 -42.4354 -42.4004 -42.4004 -42.3389 -42.3389 -10.1392 -10.1392 -9.6385 -9.6385 -0.4094 -0.4094 -0.2880 -0.2880 -0.0766 -0.0766 0.0549 0.0549 0.2399 0.2399 2.0855 2.0855 2.2774 2.2774 2.8859 2.8859 3.2828 3.2828 3.5157 3.5157 3.6123 3.6123 6.2523 6.2523 8.4088 8.4088 k = 0.2847 0.6689 0.4795 ( 10681 PWs) bands (ev): -42.4979 -42.4979 -42.4340 -42.4340 -42.4018 -42.4018 -42.3375 -42.3375 -10.1396 -10.1396 -9.6383 -9.6383 -0.4216 -0.4216 -0.2763 -0.2763 -0.0639 -0.0639 0.0535 0.0535 0.2238 0.2238 2.0989 2.0989 2.2511 2.2511 2.8916 2.8916 3.2743 3.2743 3.5192 3.5192 3.6141 3.6141 6.2988 6.2988 8.4233 8.4233 k = 0.2976 0.6765 0.4732 ( 10676 PWs) bands (ev): -42.4993 -42.4993 -42.4326 -42.4326 -42.4032 -42.4032 -42.3361 -42.3361 -10.1398 -10.1398 -9.6383 -9.6383 -0.4320 -0.4320 -0.2656 -0.2656 -0.0527 -0.0527 0.0540 0.0540 0.2101 0.2101 2.1015 2.1015 2.2327 2.2327 2.8966 2.8966 3.2659 3.2659 3.5228 3.5228 3.6159 3.6159 6.3458 6.3458 8.4332 8.4332 k = 0.3106 0.6842 0.4670 ( 10675 PWs) bands (ev): -42.5007 -42.5007 -42.4312 -42.4312 -42.4046 -42.4046 -42.3347 -42.3347 -10.1397 -10.1397 -9.6386 -9.6386 -0.4405 -0.4405 -0.2562 -0.2562 -0.0439 -0.0439 0.0568 0.0568 0.1997 0.1997 2.0882 2.0882 2.2272 2.2272 2.9008 2.9008 3.2577 3.2577 3.5265 3.5265 3.6178 3.6178 6.3930 6.3930 8.4379 8.4379 k = 0.3106 0.6842 0.4670 ( 10675 PWs) bands (ev): -42.5007 -42.5007 -42.4312 -42.4312 -42.4046 -42.4046 -42.3347 -42.3347 -10.1397 -10.1397 -9.6386 -9.6386 -0.4405 -0.4405 -0.2562 -0.2562 -0.0439 -0.0439 0.0568 0.0568 0.1997 0.1997 2.0882 2.0882 2.2272 2.2272 2.9008 2.9008 3.2577 3.2577 3.5265 3.5265 3.6178 3.6178 6.3930 6.3930 8.4379 8.4379 k = 0.3163 0.6784 0.4529 ( 10669 PWs) bands (ev): -42.5038 -42.5038 -42.4281 -42.4281 -42.4077 -42.4077 -42.3316 -42.3316 -10.1396 -10.1396 -9.6398 -9.6398 -0.4579 -0.4579 -0.2359 -0.2359 -0.0272 -0.0272 0.0665 0.0665 0.1810 0.1810 2.0400 2.0400 2.2294 2.2294 2.9096 2.9096 3.2391 3.2391 3.5354 3.5354 3.6221 3.6221 6.5015 6.5015 8.4373 8.4373 k = 0.3221 0.6725 0.4387 ( 10669 PWs) bands (ev): -42.5069 -42.5069 -42.4250 -42.4250 -42.4107 -42.4107 -42.3286 -42.3286 -10.1394 -10.1394 -9.6409 -9.6409 -0.4762 -0.4762 -0.2147 -0.2147 -0.0103 -0.0103 0.0778 0.0778 0.1630 0.1630 1.9923 1.9923 2.2309 2.2309 2.9187 2.9187 3.2211 3.2211 3.5448 3.5448 3.6268 3.6268 6.6111 6.6111 8.4285 8.4285 k = 0.3278 0.6667 0.4246 ( 10673 PWs) bands (ev): -42.5099 -42.5099 -42.4220 -42.4220 -42.4137 -42.4137 -42.3256 -42.3256 -10.1394 -10.1394 -9.6421 -9.6421 -0.4953 -0.4953 -0.1925 -0.1925 0.0066 0.0066 0.0905 0.0905 0.1459 0.1459 1.9453 1.9453 2.2316 2.2316 2.9280 2.9280 3.2038 3.2038 3.5549 3.5549 3.6318 3.6318 6.7215 6.7215 8.4129 8.4129 k = 0.3335 0.6609 0.4104 ( 10681 PWs) bands (ev): -42.5129 -42.5129 -42.4191 -42.4191 -42.4167 -42.4167 -42.3226 -42.3226 -10.1394 -10.1394 -9.6433 -9.6433 -0.5151 -0.5151 -0.1696 -0.1696 0.0236 0.0236 0.1040 0.1040 0.1301 0.1301 1.8993 1.8993 2.2316 2.2316 2.9373 2.9373 3.1871 3.1871 3.5653 3.5653 3.6373 3.6373 6.8321 6.8321 8.3923 8.3923 k = 0.3393 0.6550 0.3963 ( 10690 PWs) bands (ev): -42.5159 -42.5159 -42.4196 -42.4196 -42.4162 -42.4162 -42.3198 -42.3198 -10.1395 -10.1395 -9.6445 -9.6445 -0.5356 -0.5356 -0.1459 -0.1459 0.0406 0.0406 0.1086 0.1086 0.1253 0.1253 1.8543 1.8543 2.2310 2.2310 2.9466 2.9466 3.1711 3.1711 3.5762 3.5762 3.6432 3.6432 6.9427 6.9427 8.3677 8.3677 k = 0.3450 0.6492 0.3821 ( 10682 PWs) bands (ev): -42.5187 -42.5187 -42.4224 -42.4224 -42.4134 -42.4134 -42.3169 -42.3169 -10.1396 -10.1396 -9.6457 -9.6457 -0.5565 -0.5565 -0.1215 -0.1215 0.0575 0.0575 0.0955 0.0955 0.1401 0.1401 1.8104 1.8104 2.2298 2.2298 2.9556 2.9556 3.1559 3.1559 3.5873 3.5873 3.6495 3.6495 7.0528 7.0528 8.3403 8.3403 k = 0.3508 0.6434 0.3680 ( 10684 PWs) bands (ev): -42.5215 -42.5215 -42.4252 -42.4252 -42.4106 -42.4106 -42.3142 -42.3142 -10.1398 -10.1398 -9.6470 -9.6470 -0.5778 -0.5778 -0.0966 -0.0966 0.0743 0.0743 0.0813 0.0813 0.1581 0.1581 1.7678 1.7678 2.2280 2.2280 2.9642 2.9642 3.1416 3.1416 3.5985 3.5985 3.6564 3.6564 7.1620 7.1620 8.3108 8.3108 k = 0.3565 0.6375 0.3538 ( 10676 PWs) bands (ev): -42.5242 -42.5242 -42.4279 -42.4279 -42.4079 -42.4079 -42.3115 -42.3115 -10.1401 -10.1401 -9.6482 -9.6482 -0.5995 -0.5995 -0.0713 -0.0713 0.0670 0.0670 0.0913 0.0913 0.1775 0.1775 1.7265 1.7265 2.2258 2.2258 2.9720 2.9720 3.1285 3.1285 3.6098 3.6098 3.6638 3.6638 7.2699 7.2699 8.2799 8.2799 k = 0.3622 0.6317 0.3396 ( 10682 PWs) bands (ev): -42.5269 -42.5269 -42.4305 -42.4305 -42.4053 -42.4053 -42.3089 -42.3089 -10.1403 -10.1403 -9.6495 -9.6495 -0.6213 -0.6213 -0.0455 -0.0455 0.0536 0.0536 0.1079 0.1079 0.1981 0.1981 1.6865 1.6865 2.2231 2.2231 2.9786 2.9786 3.1170 3.1170 3.6209 3.6209 3.6719 3.6719 7.3762 7.3762 8.2481 8.2481 k = 0.3680 0.6258 0.3255 ( 10684 PWs) bands (ev): -42.5294 -42.5294 -42.4330 -42.4330 -42.4028 -42.4028 -42.3064 -42.3064 -10.1407 -10.1407 -9.6507 -9.6507 -0.6432 -0.6432 -0.0195 -0.0195 0.0407 0.0407 0.1243 0.1243 0.2197 0.2197 1.6478 1.6478 2.2201 2.2201 2.9834 2.9834 3.1076 3.1076 3.6317 3.6317 3.6808 3.6808 7.4803 7.4803 8.2159 8.2159 k = 0.3737 0.6200 0.3113 ( 10688 PWs) bands (ev): -42.5319 -42.5319 -42.4355 -42.4355 -42.4003 -42.4003 -42.3040 -42.3040 -10.1410 -10.1410 -9.6520 -9.6520 -0.6650 -0.6650 0.0066 0.0066 0.0285 0.0285 0.1405 0.1405 0.2422 0.2422 1.6105 1.6105 2.2167 2.2167 2.9857 2.9857 3.1008 3.1008 3.6421 3.6421 3.6904 3.6904 7.5819 7.5819 8.1836 8.1836 k = 0.3795 0.6142 0.2972 ( 10704 PWs) bands (ev): -42.5343 -42.5343 -42.4379 -42.4379 -42.3980 -42.3980 -42.3017 -42.3017 -10.1414 -10.1414 -9.6532 -9.6532 -0.6868 -0.6868 0.0167 0.0167 0.0328 0.0328 0.1564 0.1564 0.2656 0.2656 1.5745 1.5745 2.2130 2.2130 2.9850 2.9850 3.0973 3.0973 3.6520 3.6520 3.7009 3.7009 7.6806 7.6806 8.1515 8.1515 k = 0.3852 0.6083 0.2830 ( 10708 PWs) bands (ev): -42.5366 -42.5366 -42.4401 -42.4401 -42.3957 -42.3957 -42.2994 -42.2994 -10.1418 -10.1418 -9.6544 -9.6544 -0.7083 -0.7083 0.0057 0.0057 0.0588 0.0588 0.1719 0.1719 0.2896 0.2896 1.5399 1.5399 2.2092 2.2092 2.9812 2.9812 3.0972 3.0972 3.6614 3.6614 3.7121 3.7121 7.7758 7.7758 8.1199 8.1199 k = 0.3909 0.6025 0.2689 ( 10686 PWs) bands (ev): -42.5388 -42.5388 -42.4423 -42.4423 -42.3935 -42.3935 -42.2972 -42.2972 -10.1422 -10.1422 -9.6556 -9.6556 -0.7294 -0.7294 -0.0048 -0.0048 0.0846 0.0846 0.1871 0.1871 0.3143 0.3143 1.5065 1.5065 2.2052 2.2052 2.9746 2.9746 3.0999 3.0999 3.6702 3.6702 3.7239 3.7239 7.8670 7.8670 8.0889 8.0889 k = 0.3967 0.5966 0.2547 ( 10702 PWs) bands (ev): -42.5410 -42.5410 -42.4444 -42.4444 -42.3915 -42.3915 -42.2952 -42.2952 -10.1426 -10.1426 -9.6568 -9.6568 -0.7502 -0.7502 -0.0147 -0.0147 0.1101 0.1101 0.2019 0.2019 0.3395 0.3395 1.4744 1.4744 2.2010 2.2010 2.9659 2.9659 3.1048 3.1048 3.6787 3.6787 3.7361 3.7361 7.9532 7.9532 8.0590 8.0590 k = 0.4024 0.5908 0.2406 ( 10710 PWs) bands (ev): -42.5430 -42.5430 -42.4464 -42.4464 -42.3895 -42.3895 -42.2932 -42.2932 -10.1431 -10.1431 -9.6579 -9.6579 -0.7703 -0.7703 -0.0240 -0.0240 0.1351 0.1351 0.2162 0.2162 0.3650 0.3650 1.4435 1.4435 2.1968 2.1968 2.9558 2.9558 3.1111 3.1111 3.6867 3.6867 3.7487 3.7487 8.0242 8.0242 8.0393 8.0393 k = 0.4082 0.5850 0.2264 ( 10706 PWs) bands (ev): -42.5449 -42.5449 -42.4483 -42.4483 -42.3876 -42.3876 -42.2913 -42.2913 -10.1435 -10.1435 -9.6590 -9.6590 -0.7899 -0.7899 -0.0327 -0.0327 0.1594 0.1594 0.2302 0.2302 0.3908 0.3908 1.4139 1.4139 2.1926 2.1926 2.9450 2.9450 3.1184 3.1184 3.6943 3.6943 3.7614 3.7614 8.0007 8.0007 8.1066 8.1066 k = 0.4139 0.5791 0.2123 ( 10712 PWs) bands (ev): -42.5467 -42.5467 -42.4501 -42.4501 -42.3858 -42.3858 -42.2895 -42.2895 -10.1439 -10.1439 -9.6601 -9.6601 -0.8087 -0.8087 -0.0409 -0.0409 0.1830 0.1830 0.2436 0.2436 0.4168 0.4168 1.3853 1.3853 2.1884 2.1884 2.9338 2.9338 3.1261 3.1261 3.7017 3.7017 3.7741 3.7741 7.9740 7.9740 8.1626 8.1626 k = 0.4196 0.5733 0.1981 ( 10720 PWs) bands (ev): -42.5485 -42.5485 -42.4518 -42.4518 -42.3841 -42.3841 -42.2879 -42.2879 -10.1444 -10.1444 -9.6611 -9.6611 -0.8268 -0.8268 -0.0485 -0.0485 0.2055 0.2055 0.2566 0.2566 0.4428 0.4428 1.3579 1.3579 2.1843 2.1843 2.9224 2.9224 3.1340 3.1340 3.7087 3.7087 3.7866 3.7866 7.9485 7.9485 8.1879 8.1879 k = 0.4254 0.5675 0.1840 ( 10714 PWs) bands (ev): -42.5500 -42.5500 -42.4534 -42.4534 -42.3826 -42.3826 -42.2863 -42.2863 -10.1448 -10.1448 -9.6621 -9.6621 -0.8439 -0.8439 -0.0555 -0.0555 0.2268 0.2268 0.2693 0.2693 0.4687 0.4687 1.3316 1.3316 2.1802 2.1802 2.9112 2.9112 3.1418 3.1418 3.7154 3.7154 3.7989 3.7989 7.9244 7.9244 8.1773 8.1773 k = 0.4311 0.5616 0.1698 ( 10706 PWs) bands (ev): -42.5515 -42.5515 -42.4549 -42.4549 -42.3811 -42.3811 -42.2848 -42.2848 -10.1452 -10.1452 -9.6630 -9.6630 -0.8601 -0.8601 -0.0620 -0.0620 0.2465 0.2465 0.2817 0.2817 0.4944 0.4944 1.3064 1.3064 2.1763 2.1763 2.9002 2.9002 3.1495 3.1495 3.7218 3.7218 3.8109 3.8109 7.9018 7.9018 8.1490 8.1490 k = 0.4369 0.5558 0.1557 ( 10698 PWs) bands (ev): -42.5529 -42.5529 -42.4562 -42.4562 -42.3797 -42.3797 -42.2835 -42.2835 -10.1456 -10.1456 -9.6638 -9.6638 -0.8752 -0.8752 -0.0680 -0.0680 0.2643 0.2643 0.2942 0.2942 0.5196 0.5196 1.2822 1.2822 2.1726 2.1726 2.8897 2.8897 3.1569 3.1569 3.7278 3.7278 3.8223 3.8223 7.8807 7.8807 8.1162 8.1162 k = 0.4426 0.5499 0.1415 ( 10698 PWs) bands (ev): -42.5542 -42.5542 -42.4575 -42.4575 -42.3785 -42.3785 -42.2822 -42.2822 -10.1460 -10.1460 -9.6646 -9.6646 -0.8893 -0.8893 -0.0734 -0.0734 0.2797 0.2797 0.3069 0.3069 0.5442 0.5442 1.2592 1.2592 2.1691 2.1691 2.8797 2.8797 3.1639 3.1639 3.7335 3.7335 3.8332 3.8332 7.8612 7.8612 8.0833 8.0833 k = 0.4483 0.5441 0.1274 ( 10694 PWs) bands (ev): -42.5553 -42.5553 -42.4586 -42.4586 -42.3774 -42.3774 -42.2811 -42.2811 -10.1463 -10.1463 -9.6653 -9.6653 -0.9022 -0.9022 -0.0783 -0.0783 0.2926 0.2926 0.3200 0.3200 0.5680 0.5680 1.2374 1.2374 2.1658 2.1658 2.8703 2.8703 3.1705 3.1705 3.7387 3.7387 3.8433 3.8433 7.8435 7.8435 8.0521 8.0521 k = 0.4541 0.5383 0.1132 ( 10698 PWs) bands (ev): -42.5564 -42.5564 -42.4596 -42.4596 -42.3763 -42.3763 -42.2801 -42.2801 -10.1466 -10.1466 -9.6660 -9.6660 -0.9138 -0.9138 -0.0826 -0.0826 0.3032 0.3032 0.3330 0.3330 0.5907 0.5907 1.2168 1.2168 2.1628 2.1628 2.8616 2.8616 3.1765 3.1765 3.7436 3.7436 3.8527 3.8527 7.8274 7.8274 8.0234 8.0234 k = 0.4598 0.5324 0.0991 ( 10704 PWs) bands (ev): -42.5573 -42.5573 -42.4605 -42.4605 -42.3754 -42.3754 -42.2792 -42.2792 -10.1469 -10.1469 -9.6666 -9.6666 -0.9243 -0.9243 -0.0865 -0.0865 0.3119 0.3119 0.3454 0.3454 0.6122 0.6122 1.1977 1.1977 2.1601 2.1601 2.8538 2.8538 3.1819 3.1819 3.7479 3.7479 3.8613 3.8613 7.8132 7.8132 7.9975 7.9975 k = 0.4656 0.5266 0.0849 ( 10704 PWs) bands (ev): -42.5581 -42.5581 -42.4613 -42.4613 -42.3747 -42.3747 -42.2784 -42.2784 -10.1472 -10.1472 -9.6671 -9.6671 -0.9334 -0.9334 -0.0898 -0.0898 0.3191 0.3191 0.3568 0.3568 0.6319 0.6319 1.1801 1.1801 2.1577 2.1577 2.8468 2.8468 3.1867 3.1867 3.7517 3.7517 3.8688 3.8688 7.8008 7.8008 7.9749 7.9749 k = 0.4713 0.5208 0.0708 ( 10702 PWs) bands (ev): -42.5588 -42.5588 -42.4620 -42.4620 -42.3740 -42.3740 -42.2778 -42.2778 -10.1474 -10.1474 -9.6676 -9.6676 -0.9412 -0.9412 -0.0926 -0.0926 0.3250 0.3250 0.3668 0.3668 0.6498 0.6498 1.1644 1.1644 2.1557 2.1557 2.8408 2.8408 3.1908 3.1908 3.7550 3.7550 3.8754 3.8754 7.7902 7.7902 7.9555 7.9555 k = 0.4770 0.5149 0.0566 ( 10702 PWs) bands (ev): -42.5593 -42.5593 -42.4625 -42.4625 -42.3735 -42.3735 -42.2772 -42.2772 -10.1476 -10.1476 -9.6679 -9.6679 -0.9476 -0.9476 -0.0949 -0.0949 0.3298 0.3298 0.3751 0.3751 0.6652 0.6652 1.1508 1.1508 2.1539 2.1539 2.8358 2.8358 3.1942 3.1942 3.7578 3.7578 3.8808 3.8808 7.7815 7.7815 7.9395 7.9395 k = 0.4828 0.5091 0.0425 ( 10722 PWs) bands (ev): -42.5598 -42.5598 -42.4630 -42.4630 -42.3730 -42.3730 -42.2768 -42.2768 -10.1477 -10.1477 -9.6682 -9.6682 -0.9526 -0.9526 -0.0967 -0.0967 0.3335 0.3335 0.3817 0.3817 0.6778 0.6778 1.1397 1.1397 2.1526 2.1526 2.8318 2.8318 3.1969 3.1969 3.7599 3.7599 3.8851 3.8851 7.7747 7.7747 7.9270 7.9270 k = 0.4885 0.5032 0.0283 ( 10722 PWs) bands (ev): -42.5601 -42.5601 -42.4633 -42.4633 -42.3727 -42.3727 -42.2765 -42.2765 -10.1478 -10.1478 -9.6684 -9.6684 -0.9562 -0.9562 -0.0979 -0.0979 0.3361 0.3361 0.3865 0.3865 0.6872 0.6872 1.1315 1.1315 2.1516 2.1516 2.8290 2.8290 3.1988 3.1988 3.7615 3.7615 3.8882 3.8882 7.7699 7.7699 7.9180 7.9180 k = 0.4943 0.4974 0.0142 ( 10728 PWs) bands (ev): -42.5603 -42.5603 -42.4635 -42.4635 -42.3726 -42.3726 -42.2764 -42.2764 -10.1479 -10.1479 -9.6685 -9.6685 -0.9583 -0.9583 -0.0987 -0.0987 0.3376 0.3376 0.3894 0.3894 0.6930 0.6930 1.1264 1.1264 2.1510 2.1510 2.8273 2.8273 3.2000 3.2000 3.7624 3.7624 3.8901 3.8901 7.7669 7.7669 7.9126 7.9126 k = 0.5000 0.4916 0.0000 ( 10740 PWs) bands (ev): -42.5603 -42.5603 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1479 -10.1479 -9.6686 -9.6686 -0.9591 -0.9591 -0.0989 -0.0989 0.3382 0.3382 0.3904 0.3904 0.6950 0.6950 1.1246 1.1246 2.1508 2.1508 2.8267 2.8267 3.2004 3.2004 3.7628 3.7628 3.8907 3.8907 7.7660 7.7660 7.9108 7.9108 k = 0.5000 0.4916 0.0000 ( 10740 PWs) bands (ev): -42.5603 -42.5603 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1479 -10.1479 -9.6686 -9.6686 -0.9591 -0.9591 -0.0989 -0.0989 0.3382 0.3382 0.3904 0.3904 0.6950 0.6950 1.1246 1.1246 2.1508 2.1508 2.8267 2.8267 3.2004 3.2004 3.7628 3.7628 3.8907 3.8907 7.7660 7.7660 7.9108 7.9108 k = 0.4881 0.4799 0.0000 ( 10729 PWs) bands (ev): -42.5603 -42.5603 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1478 -10.1478 -9.6688 -9.6688 -0.9570 -0.9570 -0.1008 -0.1008 0.3406 0.3406 0.3881 0.3881 0.6982 0.6982 1.1232 1.1232 2.1489 2.1489 2.8277 2.8277 3.2003 3.2003 3.7620 3.7620 3.8903 3.8903 7.7603 7.7603 7.9120 7.9120 k = 0.4762 0.4682 0.0000 ( 10729 PWs) bands (ev): -42.5603 -42.5603 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1475 -10.1475 -9.6693 -9.6693 -0.9508 -0.9508 -0.1061 -0.1061 0.3472 0.3472 0.3821 0.3821 0.7076 0.7076 1.1190 1.1190 2.1430 2.1430 2.8306 2.8306 3.2000 3.2000 3.7597 3.7597 3.8888 3.8888 7.7433 7.7433 7.9156 7.9156 k = 0.4643 0.4565 0.0000 ( 10725 PWs) bands (ev): -42.5603 -42.5603 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1470 -10.1470 -9.6703 -9.6703 -0.9406 -0.9406 -0.1146 -0.1146 0.3525 0.3525 0.3782 0.3782 0.7221 0.7221 1.1120 1.1120 2.1336 2.1336 2.8353 2.8353 3.1996 3.1996 3.7559 3.7559 3.8865 3.8865 7.7156 7.7156 7.9212 7.9212 k = 0.4524 0.4447 0.0000 ( 10719 PWs) bands (ev): -42.5603 -42.5603 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1464 -10.1464 -9.6715 -9.6715 -0.9262 -0.9262 -0.1257 -0.1257 0.3451 0.3451 0.3885 0.3885 0.7410 0.7410 1.1021 1.1021 2.1210 2.1210 2.8415 2.8415 3.1990 3.1990 3.7507 3.7507 3.8832 3.8832 7.6775 7.6775 7.9281 7.9281 k = 0.4405 0.4330 0.0000 ( 10725 PWs) bands (ev): -42.5603 -42.5603 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1457 -10.1457 -9.6731 -9.6731 -0.9080 -0.9080 -0.1388 -0.1388 0.3297 0.3297 0.4084 0.4084 0.7630 0.7630 1.0893 1.0893 2.1058 2.1058 2.8489 2.8489 3.1983 3.1983 3.7440 3.7440 3.8790 3.8790 7.6301 7.6301 7.9354 7.9354 k = 0.4286 0.4213 0.0000 ( 10725 PWs) bands (ev): -42.5604 -42.5604 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1448 -10.1448 -9.6750 -9.6750 -0.8858 -0.8858 -0.1533 -0.1533 0.3115 0.3115 0.4330 0.4330 0.7875 0.7875 1.0736 1.0736 2.0885 2.0885 2.8571 2.8571 3.1974 3.1974 3.7360 3.7360 3.8740 3.8740 7.5740 7.5740 7.9418 7.9418 k = 0.4167 0.4096 0.0000 ( 10717 PWs) bands (ev): -42.5604 -42.5604 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1439 -10.1439 -9.6770 -9.6770 -0.8598 -0.8598 -0.1687 -0.1687 0.2920 0.2920 0.4607 0.4607 0.8138 0.8138 1.0550 1.0550 2.0697 2.0697 2.8659 2.8659 3.1964 3.1964 3.7267 3.7267 3.8682 3.8682 7.5104 7.5104 7.9453 7.9453 k = 0.4048 0.3979 0.0000 ( 10711 PWs) bands (ev): -42.5604 -42.5604 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1429 -10.1429 -9.6792 -9.6792 -0.8302 -0.8302 -0.1846 -0.1846 0.2718 0.2718 0.4910 0.4910 0.8415 0.8415 1.0336 1.0336 2.0500 2.0500 2.8748 2.8748 3.1952 3.1952 3.7162 3.7162 3.8616 3.8616 7.4400 7.4400 7.9436 7.9436 k = 0.3929 0.3862 0.0000 ( 10705 PWs) bands (ev): -42.5604 -42.5604 -42.4635 -42.4635 -42.3724 -42.3724 -42.2763 -42.2763 -10.1420 -10.1420 -9.6815 -9.6815 -0.7970 -0.7970 -0.2008 -0.2008 0.2514 0.2514 0.5234 0.5234 0.8701 0.8701 1.0094 1.0094 2.0299 2.0299 2.8838 2.8838 3.1938 3.1938 3.7047 3.7047 3.8544 3.8544 7.3639 7.3639 7.9344 7.9344 k = 0.3810 0.3745 0.0000 ( 10705 PWs) bands (ev): -42.5604 -42.5604 -42.4635 -42.4635 -42.3724 -42.3724 -42.2763 -42.2763 -10.1411 -10.1411 -9.6838 -9.6838 -0.7606 -0.7606 -0.2170 -0.2170 0.2310 0.2310 0.5575 0.5575 0.8993 0.8993 0.9827 0.9827 2.0099 2.0099 2.8925 2.8925 3.1923 3.1923 3.6922 3.6922 3.8465 3.8465 7.2828 7.2828 7.9155 7.9155 k = 0.3690 0.3628 0.0000 ( 10709 PWs) bands (ev): -42.5604 -42.5604 -42.4634 -42.4634 -42.3724 -42.3724 -42.2763 -42.2763 -10.1404 -10.1404 -9.6860 -9.6860 -0.7210 -0.7210 -0.2330 -0.2330 0.2109 0.2109 0.5930 0.5930 0.9271 0.9271 0.9554 0.9554 1.9903 1.9903 2.9008 2.9008 3.1907 3.1907 3.6790 3.6790 3.8381 3.8381 7.1976 7.1976 7.8859 7.8859 k = 0.3571 0.3511 0.0000 ( 10701 PWs) bands (ev): -42.5605 -42.5605 -42.4634 -42.4634 -42.3724 -42.3724 -42.2763 -42.2763 -10.1398 -10.1398 -9.6881 -9.6881 -0.6785 -0.6785 -0.2486 -0.2486 0.1910 0.1910 0.6298 0.6298 0.9188 0.9188 0.9624 0.9624 1.9714 1.9714 2.9086 2.9086 3.1890 3.1890 3.6650 3.6650 3.8291 3.8291 7.1089 7.1089 7.8459 7.8459 k = 0.3452 0.3394 0.0000 ( 10693 PWs) bands (ev): -42.5605 -42.5605 -42.4634 -42.4634 -42.3724 -42.3724 -42.2763 -42.2763 -10.1395 -10.1395 -9.6900 -9.6900 -0.6335 -0.6335 -0.2637 -0.2637 0.1716 0.1716 0.6674 0.6674 0.8865 0.8865 0.9918 0.9918 1.9535 1.9535 2.9158 2.9158 3.1871 3.1871 3.6505 3.6505 3.8198 3.8198 7.0175 7.0175 7.7967 7.7967 k = 0.3333 0.3277 0.0000 ( 10705 PWs) bands (ev): -42.5605 -42.5605 -42.4634 -42.4634 -42.3724 -42.3724 -42.2764 -42.2764 -10.1394 -10.1394 -9.6916 -9.6916 -0.5864 -0.5864 -0.2783 -0.2783 0.1528 0.1528 0.7058 0.7058 0.8521 0.8521 1.0221 1.0221 1.9366 1.9366 2.9224 2.9224 3.1852 3.1852 3.6357 3.6357 3.8102 3.8102 6.9238 6.9238 7.7400 7.7400 k = 0.3214 0.3160 0.0000 ( 10705 PWs) bands (ev): -42.5605 -42.5605 -42.4634 -42.4634 -42.3724 -42.3724 -42.2764 -42.2764 -10.1397 -10.1397 -9.6929 -9.6929 -0.5374 -0.5374 -0.2922 -0.2922 0.1345 0.1345 0.7442 0.7442 0.8174 0.8174 1.0524 1.0524 1.9209 1.9209 2.9282 2.9282 3.1831 3.1831 3.6207 3.6207 3.8003 3.8003 6.8284 6.8284 7.6773 7.6773 k = 0.3095 0.3043 0.0000 ( 10695 PWs) bands (ev): -42.5606 -42.5606 -42.4633 -42.4633 -42.3723 -42.3723 -42.2764 -42.2764 -10.1404 -10.1404 -9.6937 -9.6937 -0.4873 -0.4873 -0.3055 -0.3055 0.1168 0.1168 0.7709 0.7709 0.7947 0.7947 1.0825 1.0825 1.9064 1.9064 2.9333 2.9333 3.1810 3.1810 3.6057 3.6057 3.7902 3.7902 6.7317 6.7317 7.6096 7.6096 k = 0.2976 0.2926 0.0000 ( 10695 PWs) bands (ev): -42.5606 -42.5606 -42.4633 -42.4633 -42.3723 -42.3723 -42.2764 -42.2764 -10.1415 -10.1415 -9.6941 -9.6941 -0.4367 -0.4367 -0.3181 -0.3181 0.0998 0.0998 0.7431 0.7431 0.8276 0.8276 1.1123 1.1123 1.8930 1.8930 2.9376 2.9376 3.1787 3.1787 3.5908 3.5908 3.7800 3.7800 6.6342 6.6342 7.5382 7.5382 k = 0.2857 0.2809 0.0000 ( 10689 PWs) bands (ev): -42.5606 -42.5606 -42.4633 -42.4633 -42.3723 -42.3723 -42.2764 -42.2764 -10.1430 -10.1430 -9.6940 -9.6940 -0.3865 -0.3865 -0.3297 -0.3297 0.0835 0.0835 0.7105 0.7105 0.8672 0.8672 1.1417 1.1417 1.8807 1.8807 2.9412 2.9412 3.1764 3.1764 3.5763 3.5763 3.7698 3.7698 6.5362 6.5362 7.4636 7.4636 k = 0.2738 0.2692 0.0000 ( 10689 PWs) bands (ev): -42.5606 -42.5606 -42.4633 -42.4633 -42.3723 -42.3723 -42.2764 -42.2764 -10.1450 -10.1450 -9.6933 -9.6933 -0.3450 -0.3450 -0.3334 -0.3334 0.0678 0.0678 0.6802 0.6802 0.9072 0.9072 1.1705 1.1705 1.8694 1.8694 2.9440 2.9440 3.1741 3.1741 3.5624 3.5624 3.7597 3.7597 6.4381 6.4381 7.3865 7.3865 k = 0.2619 0.2575 0.0000 ( 10691 PWs) bands (ev): -42.5607 -42.5607 -42.4633 -42.4633 -42.3723 -42.3723 -42.2764 -42.2764 -10.1473 -10.1473 -9.6922 -9.6922 -0.3524 -0.3524 -0.2901 -0.2901 0.0530 0.0530 0.6542 0.6542 0.9473 0.9473 1.1987 1.1987 1.8590 1.8590 2.9461 2.9461 3.1717 3.1717 3.5492 3.5492 3.7497 3.7497 6.3402 6.3402 7.3075 7.3075 k = 0.2500 0.2458 0.0000 ( 10693 PWs) bands (ev): -42.5607 -42.5607 -42.4633 -42.4633 -42.3722 -42.3722 -42.2764 -42.2764 -10.1501 -10.1501 -9.6905 -9.6905 -0.3620 -0.3620 -0.2480 -0.2480 0.0388 0.0388 0.6342 0.6342 0.9871 0.9871 1.2262 1.2262 1.8494 1.8494 2.9475 2.9475 3.1692 3.1692 3.5370 3.5370 3.7400 3.7400 6.2427 6.2427 7.2270 7.2270 k = 0.2381 0.2341 0.0000 ( 10683 PWs) bands (ev): -42.5607 -42.5607 -42.4632 -42.4632 -42.3722 -42.3722 -42.2765 -42.2765 -10.1533 -10.1533 -9.6883 -9.6883 -0.3711 -0.3711 -0.2117 -0.2117 0.0254 0.0254 0.6219 0.6219 1.0265 1.0265 1.2529 1.2529 1.8405 1.8405 2.9482 2.9482 3.1667 3.1667 3.5259 3.5259 3.7305 3.7305 6.1460 6.1460 7.1453 7.1453 k = 0.2262 0.2224 0.0000 ( 10697 PWs) bands (ev): -42.5608 -42.5608 -42.4632 -42.4632 -42.3722 -42.3722 -42.2765 -42.2765 -10.1569 -10.1569 -9.6857 -9.6857 -0.3795 -0.3795 -0.1830 -0.1830 0.0128 0.0128 0.6191 0.6191 1.0653 1.0653 1.2787 1.2787 1.8320 1.8320 2.9482 2.9482 3.1642 3.1642 3.5161 3.5161 3.7213 3.7213 6.0503 6.0503 7.0630 7.0630 k = 0.2143 0.2107 0.0000 ( 10697 PWs) bands (ev): -42.5608 -42.5608 -42.4632 -42.4632 -42.3722 -42.3722 -42.2765 -42.2765 -10.1607 -10.1607 -9.6826 -9.6826 -0.3872 -0.3872 -0.1631 -0.1631 0.0009 0.0009 0.6272 0.6272 1.1032 1.1032 1.3036 1.3036 1.8240 1.8240 2.9475 2.9475 3.1617 3.1617 3.5078 3.5078 3.7125 3.7125 5.9559 5.9559 6.9804 6.9804 k = 0.2024 0.1990 0.0000 ( 10685 PWs) bands (ev): -42.5608 -42.5608 -42.4632 -42.4632 -42.3722 -42.3722 -42.2765 -42.2765 -10.1649 -10.1649 -9.6791 -9.6791 -0.3943 -0.3943 -0.1526 -0.1526 -0.0102 -0.0102 0.6466 0.6466 1.1401 1.1401 1.3274 1.3274 1.8162 1.8162 2.9463 2.9463 3.1592 3.1592 3.5011 3.5011 3.7041 3.7041 5.8630 5.8630 6.8979 6.8979 k = 0.1905 0.1873 0.0000 ( 10679 PWs) bands (ev): -42.5608 -42.5608 -42.4632 -42.4632 -42.3721 -42.3721 -42.2765 -42.2765 -10.1692 -10.1692 -9.6754 -9.6754 -0.4008 -0.4008 -0.1509 -0.1509 -0.0206 -0.0206 0.6770 0.6770 1.1759 1.1759 1.3501 1.3501 1.8086 1.8086 2.9444 2.9444 3.1567 3.1567 3.4962 3.4962 3.6963 3.6963 5.7719 5.7719 6.8160 6.8160 k = 0.1786 0.1756 0.0000 ( 10673 PWs) bands (ev): -42.5609 -42.5609 -42.4631 -42.4631 -42.3721 -42.3721 -42.2765 -42.2765 -10.1736 -10.1736 -9.6714 -9.6714 -0.4067 -0.4067 -0.1570 -0.1570 -0.0304 -0.0304 0.7170 0.7170 1.2104 1.2104 1.3717 1.3717 1.8009 1.8009 2.9420 2.9420 3.1543 3.1543 3.4931 3.4931 3.6889 3.6889 5.6829 5.6829 6.7350 6.7350 k = 0.1667 0.1639 0.0000 ( 10669 PWs) bands (ev): -42.5609 -42.5609 -42.4631 -42.4631 -42.3721 -42.3721 -42.2765 -42.2765 -10.1782 -10.1782 -9.6672 -9.6672 -0.4121 -0.4121 -0.1690 -0.1690 -0.0396 -0.0396 0.7650 0.7650 1.2433 1.2433 1.3920 1.3920 1.7930 1.7930 2.9390 2.9390 3.1519 3.1519 3.4919 3.4919 3.6821 3.6821 5.5962 5.5962 6.6555 6.6555 k = 0.1548 0.1522 0.0000 ( 10673 PWs) bands (ev): -42.5609 -42.5609 -42.4631 -42.4631 -42.3721 -42.3721 -42.2765 -42.2765 -10.1827 -10.1827 -9.6629 -9.6629 -0.4169 -0.4169 -0.1854 -0.1854 -0.0481 -0.0481 0.8189 0.8189 1.2746 1.2746 1.4111 1.4111 1.7847 1.7847 2.9356 2.9356 3.1495 3.1495 3.4927 3.4927 3.6758 3.6758 5.5121 5.5121 6.5780 6.5780 k = 0.1429 0.1404 0.0000 ( 10661 PWs) bands (ev): -42.5609 -42.5609 -42.4631 -42.4631 -42.3721 -42.3721 -42.2765 -42.2765 -10.1872 -10.1872 -9.6586 -9.6586 -0.4213 -0.4213 -0.2046 -0.2046 -0.0560 -0.0560 0.8772 0.8772 1.3041 1.3041 1.4289 1.4289 1.7759 1.7759 2.9317 2.9317 3.1473 3.1473 3.4955 3.4955 3.6701 3.6701 5.4311 5.4311 6.5030 6.5030 k = 0.1310 0.1287 0.0000 ( 10645 PWs) bands (ev): -42.5609 -42.5609 -42.4631 -42.4631 -42.3721 -42.3721 -42.2766 -42.2766 -10.1915 -10.1915 -9.6543 -9.6543 -0.4252 -0.4252 -0.2253 -0.2253 -0.0632 -0.0632 0.9382 0.9382 1.3316 1.3316 1.4453 1.4453 1.7664 1.7664 2.9273 2.9273 3.1451 3.1451 3.5001 3.5001 3.6651 3.6651 5.3534 5.3534 6.4311 6.4311 k = 0.1190 0.1170 0.0000 ( 10645 PWs) bands (ev): -42.5610 -42.5610 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.1957 -10.1957 -9.6502 -9.6502 -0.4286 -0.4286 -0.2465 -0.2465 -0.0698 -0.0698 1.0008 1.0008 1.3570 1.3570 1.4604 1.4604 1.7560 1.7560 2.9227 2.9227 3.1431 3.1431 3.5064 3.5064 3.6606 3.6606 5.2794 5.2794 6.3627 6.3627 k = 0.1071 0.1053 0.0000 ( 10641 PWs) bands (ev): -42.5610 -42.5610 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.1997 -10.1997 -9.6462 -9.6462 -0.4316 -0.4316 -0.2674 -0.2674 -0.0757 -0.0757 1.0638 1.0638 1.3802 1.3802 1.4742 1.4742 1.7443 1.7443 2.9179 2.9179 3.1412 3.1412 3.5141 3.5141 3.6568 3.6568 5.2097 5.2097 6.2985 6.2985 k = 0.0952 0.0936 0.0000 ( 10635 PWs) bands (ev): -42.5610 -42.5610 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2033 -10.2033 -9.6425 -9.6425 -0.4343 -0.4343 -0.2874 -0.2874 -0.0810 -0.0810 1.1264 1.1264 1.4011 1.4011 1.4865 1.4865 1.7313 1.7313 2.9129 2.9129 3.1394 3.1394 3.5230 3.5230 3.6536 3.6536 5.1447 5.1447 6.2390 6.2390 k = 0.0833 0.0819 0.0000 ( 10653 PWs) bands (ev): -42.5610 -42.5610 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2067 -10.2067 -9.6390 -9.6390 -0.4366 -0.4366 -0.3059 -0.3059 -0.0856 -0.0856 1.1876 1.1876 1.4197 1.4197 1.4974 1.4974 1.7166 1.7166 2.9079 2.9079 3.1378 3.1378 3.5326 3.5326 3.6510 3.6510 5.0850 5.0850 6.1849 6.1849 k = 0.0714 0.0702 0.0000 ( 10673 PWs) bands (ev): -42.5611 -42.5611 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2097 -10.2097 -9.6359 -9.6359 -0.4386 -0.4386 -0.3226 -0.3226 -0.0895 -0.0895 1.2469 1.2469 1.4359 1.4359 1.5068 1.5068 1.6999 1.6999 2.9031 2.9031 3.1364 3.1364 3.5424 3.5424 3.6491 3.6491 5.0312 5.0312 6.1366 6.1366 k = 0.0595 0.0585 0.0000 ( 10669 PWs) bands (ev): -42.5611 -42.5611 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2122 -10.2122 -9.6333 -9.6333 -0.4402 -0.4402 -0.3371 -0.3371 -0.0929 -0.0929 1.3036 1.3036 1.4496 1.4496 1.5149 1.5149 1.6809 1.6809 2.8986 2.8986 3.1352 3.1352 3.5519 3.5519 3.6479 3.6479 4.9841 4.9841 6.0948 6.0948 k = 0.0476 0.0468 0.0000 ( 10671 PWs) bands (ev): -42.5611 -42.5611 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2144 -10.2144 -9.6310 -9.6310 -0.4416 -0.4416 -0.3493 -0.3493 -0.0956 -0.0956 1.3572 1.3572 1.4608 1.4608 1.5215 1.5215 1.6594 1.6594 2.8946 2.8946 3.1342 3.1342 3.5605 3.5605 3.6473 3.6473 4.9442 4.9442 6.0598 6.0598 k = 0.0357 0.0351 0.0000 ( 10683 PWs) bands (ev): -42.5611 -42.5611 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2161 -10.2161 -9.6292 -9.6292 -0.4427 -0.4427 -0.3589 -0.3589 -0.0977 -0.0977 1.4072 1.4072 1.4695 1.4695 1.5266 1.5266 1.6351 1.6351 2.8913 2.8913 3.1334 3.1334 3.5676 3.5676 3.6471 3.6471 4.9122 4.9122 6.0321 6.0321 k = 0.0238 0.0234 0.0000 ( 10687 PWs) bands (ev): -42.5611 -42.5611 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2173 -10.2173 -9.6279 -9.6279 -0.4435 -0.4435 -0.3658 -0.3658 -0.0992 -0.0992 1.4530 1.4530 1.4758 1.4758 1.5303 1.5303 1.6080 1.6080 2.8888 2.8888 3.1328 3.1328 3.5729 3.5729 3.6473 3.6473 4.8889 4.8889 6.0121 6.0121 k = 0.0119 0.0117 0.0000 ( 10699 PWs) bands (ev): -42.5611 -42.5611 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2181 -10.2181 -9.6271 -9.6271 -0.4440 -0.4440 -0.3700 -0.3700 -0.1002 -0.1002 1.4794 1.4794 1.4935 1.4935 1.5325 1.5325 1.5791 1.5791 2.8872 2.8872 3.1324 3.1324 3.5762 3.5762 3.6476 3.6476 4.8747 4.8747 6.0000 6.0000 k = 0.0000 0.0000 0.0000 ( 10695 PWs) bands (ev): -42.5611 -42.5611 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2183 -10.2183 -9.6269 -9.6269 -0.4442 -0.4442 -0.3713 -0.3713 -0.1005 -0.1005 1.4807 1.4807 1.5170 1.5170 1.5332 1.5332 1.5595 1.5595 2.8867 2.8867 3.1323 3.1323 3.5773 3.5773 3.6477 3.6477 4.8699 4.8699 5.9959 5.9959 k = 0.0000 0.0000 0.0000 ( 10695 PWs) bands (ev): -42.5611 -42.5611 -42.4630 -42.4630 -42.3720 -42.3720 -42.2766 -42.2766 -10.2183 -10.2183 -9.6269 -9.6269 -0.4442 -0.4442 -0.3713 -0.3713 -0.1005 -0.1005 1.4807 1.4807 1.5170 1.5170 1.5332 1.5332 1.5595 1.5595 2.8867 2.8867 3.1323 3.1323 3.5773 3.5773 3.6477 3.6477 4.8699 4.8699 5.9959 5.9959 k = 0.0100-0.0102 0.0083 ( 10699 PWs) bands (ev): -42.5610 -42.5610 -42.4632 -42.4632 -42.3718 -42.3718 -42.2767 -42.2767 -10.2183 -10.2183 -9.6269 -9.6269 -0.4435 -0.4435 -0.3718 -0.3718 -0.1000 -0.1000 1.4726 1.4726 1.5213 1.5213 1.5327 1.5327 1.5600 1.5600 2.8868 2.8868 3.1325 3.1325 3.5774 3.5774 3.6478 3.6478 4.8701 4.8701 6.0011 6.0011 k = 0.0200-0.0204 0.0165 ( 10685 PWs) bands (ev): -42.5608 -42.5608 -42.4638 -42.4638 -42.3712 -42.3712 -42.2769 -42.2769 -10.2180 -10.2180 -9.6270 -9.6270 -0.4416 -0.4416 -0.3730 -0.3730 -0.0987 -0.0987 1.4544 1.4544 1.5251 1.5251 1.5341 1.5341 1.5617 1.5617 2.8873 2.8873 3.1331 3.1331 3.5776 3.5776 3.6482 3.6482 4.8709 4.8709 6.0164 6.0164 k = 0.0301-0.0306 0.0248 ( 10685 PWs) bands (ev): -42.5605 -42.5605 -42.4647 -42.4647 -42.3703 -42.3703 -42.2772 -42.2772 -10.2177 -10.2177 -9.6272 -9.6272 -0.4383 -0.4383 -0.3750 -0.3750 -0.0964 -0.0964 1.4310 1.4310 1.5215 1.5215 1.5397 1.5397 1.5644 1.5644 2.8879 2.8879 3.1340 3.1340 3.5779 3.5779 3.6489 3.6489 4.8725 4.8725 6.0416 6.0416 k = 0.0401-0.0408 0.0331 ( 10667 PWs) bands (ev): -42.5601 -42.5601 -42.4660 -42.4660 -42.3690 -42.3690 -42.2776 -42.2776 -10.2172 -10.2172 -9.6275 -9.6275 -0.4339 -0.4339 -0.3777 -0.3777 -0.0933 -0.0933 1.4039 1.4039 1.5145 1.5145 1.5441 1.5441 1.5682 1.5682 2.8887 2.8887 3.1353 3.1353 3.5784 3.5784 3.6499 3.6499 4.8751 4.8751 6.0761 6.0761 k = 0.0501-0.0510 0.0414 ( 10675 PWs) bands (ev): -42.5595 -42.5595 -42.4676 -42.4676 -42.3674 -42.3674 -42.2782 -42.2782 -10.2166 -10.2166 -9.6278 -9.6278 -0.4283 -0.4283 -0.3812 -0.3812 -0.0893 -0.0893 1.3736 1.3736 1.5053 1.5053 1.5461 1.5461 1.5730 1.5730 2.8897 2.8897 3.1368 3.1368 3.5791 3.5791 3.6512 3.6512 4.8794 4.8794 6.1194 6.1194 k = 0.0601-0.0612 0.0496 ( 10677 PWs) bands (ev): -42.5588 -42.5588 -42.4696 -42.4696 -42.3655 -42.3655 -42.2789 -42.2789 -10.2158 -10.2158 -9.6283 -9.6283 -0.4219 -0.4219 -0.3850 -0.3850 -0.0844 -0.0844 1.3404 1.3404 1.4942 1.4942 1.5455 1.5455 1.5789 1.5789 2.8906 2.8906 3.1387 3.1387 3.5799 3.5799 3.6527 3.6527 4.8855 4.8855 6.1706 6.1706 k = 0.0702-0.0714 0.0579 ( 10675 PWs) bands (ev): -42.5580 -42.5580 -42.4717 -42.4717 -42.3633 -42.3633 -42.2797 -42.2797 -10.2149 -10.2149 -9.6288 -9.6288 -0.4155 -0.4155 -0.3883 -0.3883 -0.0787 -0.0787 1.3046 1.3046 1.4811 1.4811 1.5424 1.5424 1.5858 1.5858 2.8915 2.8915 3.1408 3.1408 3.5808 3.5808 3.6546 3.6546 4.8941 4.8941 6.2290 6.2290 k = 0.0802-0.0816 0.0662 ( 10687 PWs) bands (ev): -42.5570 -42.5570 -42.4741 -42.4741 -42.3610 -42.3610 -42.2806 -42.2806 -10.2139 -10.2139 -9.6293 -9.6293 -0.4119 -0.4119 -0.3886 -0.3886 -0.0721 -0.0721 1.2665 1.2665 1.4663 1.4663 1.5369 1.5369 1.5937 1.5937 2.8923 2.8923 3.1431 3.1431 3.5819 3.5819 3.6567 3.6567 4.9054 4.9054 6.2940 6.2940 k = 0.0902-0.0918 0.0744 ( 10683 PWs) bands (ev): -42.5559 -42.5559 -42.4766 -42.4766 -42.3585 -42.3585 -42.2816 -42.2816 -10.2127 -10.2127 -9.6300 -9.6300 -0.4140 -0.4140 -0.3827 -0.3827 -0.0647 -0.0647 1.2263 1.2263 1.4499 1.4499 1.5293 1.5293 1.6026 1.6026 2.8928 2.8928 3.1456 3.1456 3.5831 3.5831 3.6591 3.6591 4.9197 4.9197 6.3646 6.3646 k = 0.1002-0.1020 0.0827 ( 10677 PWs) bands (ev): -42.5547 -42.5547 -42.4792 -42.4792 -42.3559 -42.3559 -42.2828 -42.2828 -10.2114 -10.2114 -9.6307 -9.6307 -0.4203 -0.4203 -0.3724 -0.3724 -0.0565 -0.0565 1.1842 1.1842 1.4319 1.4319 1.5197 1.5197 1.6124 1.6124 2.8932 2.8932 3.1483 3.1483 3.5845 3.5845 3.6619 3.6619 4.9373 4.9373 6.4403 6.4403 k = 0.1103-0.1122 0.0910 ( 10681 PWs) bands (ev): -42.5534 -42.5534 -42.4820 -42.4820 -42.3531 -42.3531 -42.2841 -42.2841 -10.2100 -10.2100 -9.6314 -9.6314 -0.4287 -0.4287 -0.3597 -0.3597 -0.0476 -0.0476 1.1406 1.1406 1.4126 1.4126 1.5084 1.5084 1.6232 1.6232 2.8932 2.8932 3.1510 3.1510 3.5860 3.5860 3.6649 3.6649 4.9583 4.9583 6.5203 6.5203 k = 0.1203-0.1224 0.0993 ( 10669 PWs) bands (ev): -42.5520 -42.5520 -42.4849 -42.4849 -42.3503 -42.3503 -42.2855 -42.2855 -10.2086 -10.2086 -9.6323 -9.6323 -0.4384 -0.4384 -0.3454 -0.3454 -0.0380 -0.0380 1.0957 1.0957 1.3920 1.3920 1.4956 1.4956 1.6349 1.6349 2.8929 2.8929 3.1538 3.1538 3.5877 3.5877 3.6683 3.6683 4.9827 4.9827 6.6040 6.6040 k = 0.1303-0.1326 0.1075 ( 10661 PWs) bands (ev): -42.5504 -42.5504 -42.4879 -42.4879 -42.3473 -42.3473 -42.2870 -42.2870 -10.2070 -10.2070 -9.6332 -9.6332 -0.4491 -0.4491 -0.3298 -0.3298 -0.0276 -0.0276 1.0497 1.0497 1.3702 1.3702 1.4815 1.4815 1.6474 1.6474 2.8924 2.8924 3.1567 3.1567 3.5896 3.5896 3.6720 3.6720 5.0107 5.0107 6.6907 6.6907 k = 0.1403-0.1427 0.1158 ( 10669 PWs) bands (ev): -42.5488 -42.5488 -42.4909 -42.4909 -42.3444 -42.3444 -42.2886 -42.2886 -10.2053 -10.2053 -9.6341 -9.6341 -0.4609 -0.4609 -0.3130 -0.3130 -0.0166 -0.0166 1.0028 1.0028 1.3474 1.3474 1.4664 1.4664 1.6608 1.6608 2.8915 2.8915 3.1595 3.1595 3.5916 3.5916 3.6761 3.6761 5.0422 5.0422 6.7799 6.7799 k = 0.1504-0.1529 0.1241 ( 10667 PWs) bands (ev): -42.5470 -42.5470 -42.4939 -42.4939 -42.3414 -42.3414 -42.2904 -42.2904 -10.2035 -10.2035 -9.6351 -9.6351 -0.4736 -0.4736 -0.2952 -0.2952 -0.0049 -0.0049 0.9553 0.9553 1.3238 1.3238 1.4505 1.4505 1.6750 1.6750 2.8903 2.8903 3.1623 3.1623 3.5938 3.5938 3.6804 3.6804 5.0772 5.0772 6.8709 6.8709 k = 0.1604-0.1631 0.1324 ( 10665 PWs) bands (ev): -42.5451 -42.5451 -42.4969 -42.4969 -42.3384 -42.3384 -42.2922 -42.2922 -10.2016 -10.2016 -9.6362 -9.6362 -0.4872 -0.4872 -0.2763 -0.2763 0.0073 0.0073 0.9074 0.9074 1.2994 1.2994 1.4341 1.4341 1.6899 1.6899 2.8888 2.8888 3.1651 3.1651 3.5962 3.5962 3.6851 3.6851 5.1155 5.1155 6.9633 6.9633 k = 0.1704-0.1733 0.1406 ( 10659 PWs) bands (ev): -42.5431 -42.5431 -42.5000 -42.5000 -42.3354 -42.3354 -42.2941 -42.2941 -10.1997 -10.1997 -9.6373 -9.6373 -0.5015 -0.5015 -0.2566 -0.2566 0.0201 0.0201 0.8593 0.8593 1.2743 1.2743 1.4172 1.4172 1.7055 1.7055 2.8871 2.8871 3.1678 3.1678 3.5989 3.5989 3.6901 3.6901 5.1572 5.1572 7.0565 7.0565 k = 0.1804-0.1835 0.1489 ( 10669 PWs) bands (ev): -42.5410 -42.5410 -42.5031 -42.5031 -42.3324 -42.3324 -42.2962 -42.2962 -10.1977 -10.1977 -9.6384 -9.6384 -0.5167 -0.5167 -0.2359 -0.2359 0.0334 0.0334 0.8112 0.8112 1.2488 1.2488 1.4001 1.4001 1.7217 1.7217 2.8852 2.8852 3.1704 3.1704 3.6017 3.6017 3.6954 3.6954 5.2021 5.2021 7.1499 7.1499 k = 0.1905-0.1937 0.1572 ( 10679 PWs) bands (ev): -42.5388 -42.5388 -42.5061 -42.5061 -42.3294 -42.3294 -42.2983 -42.2983 -10.1956 -10.1956 -9.6396 -9.6396 -0.5326 -0.5326 -0.2145 -0.2145 0.0471 0.0471 0.7632 0.7632 1.2228 1.2228 1.3829 1.3829 1.7384 1.7384 2.8830 2.8830 3.1730 3.1730 3.6047 3.6047 3.7010 3.7010 5.2500 5.2500 7.2432 7.2432 k = 0.2005-0.2039 0.1654 ( 10673 PWs) bands (ev): -42.5365 -42.5365 -42.5091 -42.5091 -42.3264 -42.3264 -42.3006 -42.3006 -10.1935 -10.1935 -9.6408 -9.6408 -0.5491 -0.5491 -0.1924 -0.1924 0.0613 0.0613 0.7156 0.7156 1.1967 1.1967 1.3659 1.3659 1.7557 1.7557 2.8808 2.8808 3.1754 3.1754 3.6080 3.6080 3.7070 3.7070 5.3010 5.3010 7.3357 7.3357 k = 0.2105-0.2141 0.1737 ( 10687 PWs) bands (ev): -42.5342 -42.5342 -42.5121 -42.5121 -42.3235 -42.3235 -42.3029 -42.3029 -10.1914 -10.1914 -9.6420 -9.6420 -0.5663 -0.5663 -0.1697 -0.1697 0.0758 0.0758 0.6684 0.6684 1.1703 1.1703 1.3491 1.3491 1.7735 1.7735 2.8783 2.8783 3.1777 3.1777 3.6116 3.6116 3.7132 3.7132 5.3549 5.3549 7.4272 7.4272 k = 0.2205-0.2243 0.1820 ( 10688 PWs) bands (ev): -42.5317 -42.5317 -42.5150 -42.5150 -42.3206 -42.3206 -42.3053 -42.3053 -10.1892 -10.1892 -9.6433 -9.6433 -0.5840 -0.5840 -0.1464 -0.1464 0.0905 0.0905 0.6218 0.6218 1.1439 1.1439 1.3326 1.3326 1.7916 1.7916 2.8758 2.8758 3.1798 3.1798 3.6154 3.6154 3.7197 3.7197 5.4116 5.4116 7.5171 7.5171 k = 0.2306-0.2345 0.1903 ( 10684 PWs) bands (ev): -42.5292 -42.5292 -42.5179 -42.5179 -42.3178 -42.3178 -42.3078 -42.3078 -10.1870 -10.1870 -9.6446 -9.6446 -0.6022 -0.6022 -0.1227 -0.1227 0.1056 0.1056 0.5760 0.5760 1.1176 1.1176 1.3166 1.3166 1.8100 1.8100 2.8732 2.8732 3.1819 3.1819 3.6195 3.6195 3.7265 3.7265 5.4711 5.4711 7.6051 7.6051 k = 0.2406-0.2447 0.1985 ( 10682 PWs) bands (ev): -42.5265 -42.5265 -42.5207 -42.5207 -42.3150 -42.3150 -42.3104 -42.3104 -10.1848 -10.1848 -9.6459 -9.6459 -0.6208 -0.6208 -0.0986 -0.0986 0.1208 0.1208 0.5311 0.5311 1.0915 1.0915 1.3011 1.3011 1.8287 1.8287 2.8706 2.8706 3.1838 3.1838 3.6238 3.6238 3.7336 3.7336 5.5331 5.5331 7.6909 7.6909 k = 0.2506-0.2549 0.2068 ( 10686 PWs) bands (ev): -42.5240 -42.5240 -42.5233 -42.5233 -42.3131 -42.3131 -42.3122 -42.3122 -10.1826 -10.1826 -9.6472 -9.6472 -0.6397 -0.6397 -0.0742 -0.0742 0.1361 0.1361 0.4871 0.4871 1.0656 1.0656 1.2862 1.2862 1.8475 1.8475 2.8679 2.8679 3.1856 3.1856 3.6285 3.6285 3.7409 3.7409 5.5977 5.5977 7.7742 7.7742 k = 0.2606-0.2651 0.2151 ( 10682 PWs) bands (ev): -42.5262 -42.5262 -42.5210 -42.5210 -42.3158 -42.3158 -42.3097 -42.3097 -10.1804 -10.1804 -9.6485 -9.6485 -0.6587 -0.6587 -0.0496 -0.0496 0.1515 0.1515 0.4442 0.4442 1.0400 1.0400 1.2720 1.2720 1.8664 1.8664 2.8652 2.8652 3.1872 3.1872 3.6334 3.6334 3.7484 3.7484 5.6648 5.6648 7.8546 7.8546 k = 0.2707-0.2753 0.2233 ( 10678 PWs) bands (ev): -42.5288 -42.5288 -42.5182 -42.5182 -42.3185 -42.3185 -42.3071 -42.3071 -10.1782 -10.1782 -9.6498 -9.6498 -0.6780 -0.6780 -0.0249 -0.0249 0.1669 0.1669 0.4026 0.4026 1.0149 1.0149 1.2584 1.2584 1.8853 1.8853 2.8625 2.8625 3.1887 3.1887 3.6387 3.6387 3.7561 3.7561 5.7343 5.7343 7.9321 7.9321 k = 0.2807-0.2855 0.2316 ( 10664 PWs) bands (ev): -42.5313 -42.5313 -42.5153 -42.5153 -42.3214 -42.3214 -42.3046 -42.3046 -10.1760 -10.1760 -9.6511 -9.6511 -0.6972 -0.6972 -0.0002 -0.0002 0.1823 0.1823 0.3621 0.3621 0.9903 0.9903 1.2455 1.2455 1.9041 1.9041 2.8599 2.8599 3.1901 3.1901 3.6443 3.6443 3.7640 3.7640 5.8061 5.8061 8.0064 8.0064 k = 0.2907-0.2957 0.2399 ( 10658 PWs) bands (ev): -42.5337 -42.5337 -42.5124 -42.5124 -42.3243 -42.3243 -42.3022 -42.3022 -10.1738 -10.1738 -9.6524 -9.6524 -0.7164 -0.7164 0.0243 0.0243 0.1975 0.1975 0.3231 0.3231 0.9663 0.9663 1.2334 1.2334 1.9227 1.9227 2.8573 2.8573 3.1914 3.1914 3.6501 3.6501 3.7720 3.7720 5.8801 5.8801 8.0774 8.0774 k = 0.3007-0.3059 0.2482 ( 10662 PWs) bands (ev): -42.5361 -42.5361 -42.5094 -42.5094 -42.3272 -42.3272 -42.2999 -42.2999 -10.1717 -10.1717 -9.6537 -9.6537 -0.7354 -0.7354 0.0487 0.0487 0.2125 0.2125 0.2855 0.2855 0.9430 0.9430 1.2220 1.2220 1.9411 1.9411 2.8547 2.8547 3.1926 3.1926 3.6562 3.6562 3.7800 3.7800 5.9564 5.9564 8.1450 8.1450 k = 0.3108-0.3161 0.2564 ( 10652 PWs) bands (ev): -42.5384 -42.5384 -42.5064 -42.5064 -42.3302 -42.3302 -42.2977 -42.2977 -10.1696 -10.1696 -9.6550 -9.6550 -0.7542 -0.7542 0.0727 0.0727 0.2270 0.2270 0.2496 0.2496 0.9204 0.9204 1.2113 1.2113 1.9591 1.9591 2.8522 2.8522 3.1936 3.1936 3.6626 3.6626 3.7882 3.7882 6.0348 6.0348 8.2091 8.2091 k = 0.3208-0.3263 0.2647 ( 10668 PWs) bands (ev): -42.5406 -42.5406 -42.5033 -42.5033 -42.3332 -42.3332 -42.2955 -42.2955 -10.1676 -10.1676 -9.6562 -9.6562 -0.7726 -0.7726 0.0963 0.0963 0.2142 0.2142 0.2423 0.2423 0.8987 0.8987 1.2014 1.2014 1.9768 1.9768 2.8498 2.8498 3.1945 3.1945 3.6692 3.6692 3.7964 3.7964 6.1153 6.1153 8.2697 8.2697 k = 0.3308-0.3365 0.2730 ( 10676 PWs) bands (ev): -42.5426 -42.5426 -42.5003 -42.5003 -42.3362 -42.3362 -42.2935 -42.2935 -10.1657 -10.1657 -9.6574 -9.6574 -0.7906 -0.7906 0.1193 0.1193 0.1815 0.1815 0.2562 0.2562 0.8778 0.8778 1.1922 1.1922 1.9939 1.9939 2.8475 2.8475 3.1954 3.1954 3.6761 3.6761 3.8045 3.8045 6.1979 6.1979 8.3269 8.3269 k = 0.3408-0.3467 0.2812 ( 10688 PWs) bands (ev): -42.5446 -42.5446 -42.4972 -42.4972 -42.3392 -42.3392 -42.2916 -42.2916 -10.1638 -10.1638 -9.6586 -9.6586 -0.8080 -0.8080 0.1408 0.1408 0.1511 0.1511 0.2699 0.2699 0.8578 0.8578 1.1836 1.1836 2.0105 2.0105 2.8452 2.8452 3.1961 3.1961 3.6830 3.6830 3.8126 3.8126 6.2824 6.2824 8.3805 8.3805 k = 0.3508-0.3569 0.2895 ( 10688 PWs) bands (ev): -42.5465 -42.5465 -42.4941 -42.4941 -42.3422 -42.3422 -42.2898 -42.2898 -10.1620 -10.1620 -9.6597 -9.6597 -0.8249 -0.8249 0.1201 0.1201 0.1638 0.1638 0.2831 0.2831 0.8388 0.8388 1.1758 1.1758 2.0264 2.0264 2.8431 2.8431 3.1968 3.1968 3.6901 3.6901 3.8205 3.8205 6.3689 6.3689 8.4306 8.4306 k = 0.3609-0.3671 0.2978 ( 10700 PWs) bands (ev): -42.5482 -42.5482 -42.4911 -42.4911 -42.3452 -42.3452 -42.2881 -42.2881 -10.1603 -10.1603 -9.6607 -9.6607 -0.8410 -0.8410 0.0923 0.0923 0.1846 0.1846 0.2958 0.2958 0.8208 0.8208 1.1686 1.1686 2.0416 2.0416 2.8411 2.8411 3.1974 3.1974 3.6973 3.6973 3.8283 3.8283 6.4572 6.4572 8.4772 8.4772 k = 0.3709-0.3773 0.3061 ( 10692 PWs) bands (ev): -42.5499 -42.5499 -42.4881 -42.4881 -42.3482 -42.3482 -42.2865 -42.2865 -10.1586 -10.1586 -9.6618 -9.6618 -0.8564 -0.8564 0.0662 0.0662 0.2044 0.2044 0.3079 0.3079 0.8038 0.8038 1.1621 1.1621 2.0560 2.0560 2.8391 2.8391 3.1979 3.1979 3.7045 3.7045 3.8359 3.8359 6.5472 6.5472 8.5204 8.5204 k = 0.3809-0.3875 0.3143 ( 10692 PWs) bands (ev): -42.5514 -42.5514 -42.4852 -42.4852 -42.3511 -42.3511 -42.2850 -42.2850 -10.1571 -10.1571 -9.6627 -9.6627 -0.8709 -0.8709 0.0419 0.0419 0.2232 0.2232 0.3193 0.3193 0.7880 0.7880 1.1561 1.1561 2.0696 2.0696 2.8374 2.8374 3.1983 3.1983 3.7116 3.7116 3.8432 3.8432 6.6391 6.6391 8.5602 8.5602 k = 0.3909-0.3977 0.3226 ( 10684 PWs) bands (ev): -42.5528 -42.5528 -42.4823 -42.4823 -42.3539 -42.3539 -42.2836 -42.2836 -10.1557 -10.1557 -9.6636 -9.6636 -0.8845 -0.8845 0.0195 0.0195 0.2409 0.2409 0.3301 0.3301 0.7733 0.7733 1.1508 1.1508 2.0823 2.0823 2.8357 2.8357 3.1987 3.1987 3.7185 3.7185 3.8501 3.8501 6.7325 6.7325 8.5966 8.5966 k = 0.4010-0.4079 0.3309 ( 10684 PWs) bands (ev): -42.5541 -42.5541 -42.4795 -42.4795 -42.3567 -42.3567 -42.2823 -42.2823 -10.1543 -10.1543 -9.6645 -9.6645 -0.8971 -0.8971 -0.0011 -0.0011 0.2573 0.2573 0.3401 0.3401 0.7598 0.7598 1.1460 1.1460 2.0940 2.0940 2.8341 2.8341 3.1991 3.1991 3.7253 3.7253 3.8567 3.8567 6.8276 6.8276 8.6296 8.6296 k = 0.4110-0.4180 0.3391 ( 10690 PWs) bands (ev): -42.5553 -42.5553 -42.4768 -42.4768 -42.3593 -42.3593 -42.2812 -42.2812 -10.1531 -10.1531 -9.6652 -9.6652 -0.9086 -0.9086 -0.0197 -0.0197 0.2724 0.2724 0.3494 0.3494 0.7476 0.7476 1.1417 1.1417 2.1047 2.1047 2.8327 2.8327 3.1993 3.1993 3.7317 3.7317 3.8628 3.8628 6.9241 6.9241 8.6587 8.6587 k = 0.4210-0.4282 0.3474 ( 10698 PWs) bands (ev): -42.5564 -42.5564 -42.4743 -42.4743 -42.3618 -42.3618 -42.2801 -42.2801 -10.1520 -10.1520 -9.6659 -9.6659 -0.9191 -0.9191 -0.0365 -0.0365 0.2861 0.2861 0.3578 0.3578 0.7365 0.7365 1.1380 1.1380 2.1143 2.1143 2.8315 2.8315 3.1996 3.1996 3.7377 3.7377 3.8685 3.8685 7.0220 7.0220 8.6660 8.6660 k = 0.4310-0.4384 0.3557 ( 10704 PWs) bands (ev): -42.5573 -42.5573 -42.4720 -42.4720 -42.3641 -42.3641 -42.2792 -42.2792 -10.1511 -10.1511 -9.6665 -9.6665 -0.9284 -0.9284 -0.0513 -0.0513 0.2982 0.2982 0.3653 0.3653 0.7267 0.7267 1.1347 1.1347 2.1229 2.1229 2.8304 2.8304 3.1998 3.1998 3.7433 3.7433 3.8735 3.8735 7.1211 7.1211 8.5699 8.5699 k = 0.4310-0.4384 0.3557 ( 10704 PWs) bands (ev): -42.5573 -42.5573 -42.4720 -42.4720 -42.3641 -42.3641 -42.2792 -42.2792 -10.1511 -10.1511 -9.6665 -9.6665 -0.9284 -0.9284 -0.0513 -0.0513 0.2982 0.2982 0.3653 0.3653 0.7267 0.7267 1.1347 1.1347 2.1229 2.1229 2.8304 2.8304 3.1998 3.1998 3.7433 3.7433 3.8735 3.8735 7.1211 7.1211 8.5699 8.5699 k = 0.4335-0.4231 0.3504 ( 10698 PWs) bands (ev): -42.5567 -42.5567 -42.4735 -42.4735 -42.3626 -42.3626 -42.2798 -42.2798 -10.1516 -10.1516 -9.6663 -9.6663 -0.9214 -0.9214 -0.0433 -0.0433 0.2923 0.2923 0.3595 0.3595 0.7343 0.7343 1.1360 1.1360 2.1163 2.1163 2.8315 2.8315 3.1996 3.1996 3.7394 3.7394 3.8701 3.8701 7.0564 7.0564 8.6334 8.6334 k = 0.4360-0.4077 0.3450 ( 10694 PWs) bands (ev): -42.5561 -42.5561 -42.4750 -42.4750 -42.3611 -42.3611 -42.2804 -42.2804 -10.1521 -10.1521 -9.6662 -9.6662 -0.9117 -0.9117 -0.0374 -0.0374 0.2895 0.2895 0.3515 0.3515 0.7449 0.7449 1.1360 1.1360 2.1069 2.1069 2.8335 2.8335 3.1993 3.1993 3.7348 3.7348 3.8660 3.8660 6.9913 6.9913 8.6667 8.6667 k = 0.4384-0.3924 0.3397 ( 10694 PWs) bands (ev): -42.5554 -42.5554 -42.4767 -42.4767 -42.3595 -42.3595 -42.2811 -42.2811 -10.1525 -10.1525 -9.6663 -9.6663 -0.8992 -0.8992 -0.0337 -0.0337 0.2899 0.2899 0.3419 0.3419 0.7581 0.7581 1.1348 1.1348 2.0946 2.0946 2.8363 2.8363 3.1988 3.1988 3.7295 3.7295 3.8612 3.8612 6.9261 6.9261 8.6402 8.6402 k = 0.4409-0.3770 0.3344 ( 10694 PWs) bands (ev): -42.5546 -42.5546 -42.4784 -42.4784 -42.3578 -42.3578 -42.2818 -42.2818 -10.1528 -10.1528 -9.6666 -9.6666 -0.8841 -0.8841 -0.0323 -0.0323 0.2930 0.2930 0.3315 0.3315 0.7735 0.7735 1.1325 1.1325 2.0795 2.0795 2.8396 2.8396 3.1981 3.1981 3.7236 3.7236 3.8559 3.8559 6.8614 6.8614 8.6084 8.6084 k = 0.4434-0.3617 0.3290 ( 10691 PWs) bands (ev): -42.5539 -42.5539 -42.4801 -42.4801 -42.3561 -42.3561 -42.2826 -42.2826 -10.1531 -10.1531 -9.6670 -9.6670 -0.8664 -0.8664 -0.0331 -0.0331 0.2972 0.2972 0.3222 0.3222 0.7904 0.7904 1.1290 1.1290 2.0616 2.0616 2.8432 2.8432 3.1973 3.1973 3.7175 3.7175 3.8500 3.8500 6.7976 6.7976 8.5739 8.5739 k = 0.4458-0.3463 0.3237 ( 10701 PWs) bands (ev): -42.5530 -42.5530 -42.4819 -42.4819 -42.3543 -42.3543 -42.2834 -42.2834 -10.1533 -10.1533 -9.6677 -9.6677 -0.8463 -0.8463 -0.0359 -0.0359 0.2955 0.2955 0.3211 0.3211 0.8087 0.8087 1.1244 1.1244 2.0412 2.0412 2.8468 2.8468 3.1962 3.1962 3.7112 3.7112 3.8438 3.8438 6.7349 6.7349 8.5378 8.5378 k = 0.4483-0.3310 0.3183 ( 10701 PWs) bands (ev): -42.5521 -42.5521 -42.4837 -42.4837 -42.3525 -42.3525 -42.2843 -42.2843 -10.1533 -10.1533 -9.6685 -9.6685 -0.8238 -0.8238 -0.0402 -0.0402 0.2853 0.2853 0.3306 0.3306 0.8279 0.8279 1.1189 1.1189 2.0183 2.0183 2.8502 2.8502 3.1950 3.1950 3.7050 3.7050 3.8372 3.8372 6.6736 6.6736 8.5008 8.5008 k = 0.4507-0.3156 0.3130 ( 10701 PWs) bands (ev): -42.5512 -42.5512 -42.4856 -42.4856 -42.3506 -42.3506 -42.2852 -42.2852 -10.1534 -10.1534 -9.6695 -9.6695 -0.7990 -0.7990 -0.0458 -0.0458 0.2726 0.2726 0.3445 0.3445 0.8477 0.8477 1.1125 1.1125 1.9930 1.9930 2.8532 2.8532 3.1936 3.1936 3.6990 3.6990 3.8303 3.8303 6.6140 6.6140 8.4634 8.4634 k = 0.4532-0.3002 0.3077 ( 10704 PWs) bands (ev): -42.5502 -42.5502 -42.4875 -42.4875 -42.3487 -42.3487 -42.2862 -42.2862 -10.1533 -10.1533 -9.6706 -9.6706 -0.7720 -0.7720 -0.0522 -0.0522 0.2593 0.2593 0.3608 0.3608 0.8679 0.8679 1.1052 1.1052 1.9654 1.9654 2.8556 2.8556 3.1919 3.1919 3.6935 3.6935 3.8232 3.8232 6.5563 6.5563 8.4261 8.4261 k = 0.4557-0.2849 0.3023 ( 10698 PWs) bands (ev): -42.5492 -42.5492 -42.4894 -42.4894 -42.3468 -42.3468 -42.2872 -42.2872 -10.1532 -10.1532 -9.6718 -9.6718 -0.7431 -0.7431 -0.0592 -0.0592 0.2459 0.2459 0.3784 0.3784 0.8883 0.8883 1.0974 1.0974 1.9358 1.9358 2.8571 2.8571 3.1900 3.1900 3.6885 3.6885 3.8160 3.8160 6.5008 6.5008 8.3892 8.3892 k = 0.4581-0.2695 0.2970 ( 10698 PWs) bands (ev): -42.5481 -42.5481 -42.4913 -42.4913 -42.3449 -42.3449 -42.2883 -42.2883 -10.1530 -10.1530 -9.6731 -9.6731 -0.7123 -0.7123 -0.0665 -0.0665 0.2327 0.2327 0.3969 0.3969 0.9087 0.9087 1.0891 1.0891 1.9043 1.9043 2.8578 2.8578 3.1879 3.1879 3.6844 3.6844 3.8087 3.8087 6.4476 6.4476 8.3530 8.3530 k = 0.4606-0.2542 0.2917 ( 10694 PWs) bands (ev): -42.5470 -42.5470 -42.4933 -42.4933 -42.3429 -42.3429 -42.2894 -42.2894 -10.1527 -10.1527 -9.6745 -9.6745 -0.6798 -0.6798 -0.0738 -0.0738 0.2199 0.2199 0.4157 0.4157 0.9289 0.9289 1.0806 1.0806 1.8710 1.8710 2.8574 2.8574 3.1856 3.1856 3.6811 3.6811 3.8016 3.8016 6.3969 6.3969 8.3177 8.3177 k = 0.4631-0.2388 0.2863 ( 10692 PWs) bands (ev): -42.5459 -42.5459 -42.4952 -42.4952 -42.3410 -42.3410 -42.2905 -42.2905 -10.1524 -10.1524 -9.6760 -9.6760 -0.6460 -0.6460 -0.0810 -0.0810 0.2075 0.2075 0.4343 0.4343 0.9488 0.9488 1.0722 1.0722 1.8361 1.8361 2.8560 2.8560 3.1830 3.1830 3.6787 3.6787 3.7946 3.7946 6.3488 6.3488 8.2837 8.2837 k = 0.4655-0.2235 0.2810 ( 10698 PWs) bands (ev): -42.5447 -42.5447 -42.4972 -42.4972 -42.3390 -42.3390 -42.2917 -42.2917 -10.1521 -10.1521 -9.6775 -9.6775 -0.6110 -0.6110 -0.0879 -0.0879 0.1956 0.1956 0.4524 0.4524 0.9681 0.9681 1.0643 1.0643 1.7997 1.7997 2.8537 2.8537 3.1803 3.1803 3.6773 3.6773 3.7878 3.7878 6.3033 6.3033 8.2510 8.2510 k = 0.4680-0.2081 0.2757 ( 10698 PWs) bands (ev): -42.5434 -42.5434 -42.4992 -42.4992 -42.3371 -42.3371 -42.2930 -42.2930 -10.1517 -10.1517 -9.6791 -9.6791 -0.5751 -0.5751 -0.0943 -0.0943 0.1844 0.1844 0.4693 0.4693 0.9868 0.9868 1.0573 1.0573 1.7621 1.7621 2.8504 2.8504 3.1774 3.1774 3.6768 3.6768 3.7814 3.7814 6.2607 6.2607 8.2200 8.2200 k = 0.4704-0.1928 0.2703 ( 10687 PWs) bands (ev): -42.5421 -42.5421 -42.5011 -42.5011 -42.3351 -42.3351 -42.2942 -42.2942 -10.1513 -10.1513 -9.6806 -9.6806 -0.5386 -0.5386 -0.1001 -0.1001 0.1738 0.1738 0.4845 0.4845 1.0047 1.0047 1.0517 1.0517 1.7234 1.7234 2.8464 2.8464 3.1745 3.1745 3.6771 3.6771 3.7754 3.7754 6.2209 6.2209 8.1906 8.1906 k = 0.4729-0.1774 0.2650 ( 10689 PWs) bands (ev): -42.5408 -42.5408 -42.5031 -42.5031 -42.3332 -42.3332 -42.2956 -42.2956 -10.1508 -10.1508 -9.6821 -9.6821 -0.5021 -0.5021 -0.1051 -0.1051 0.1640 0.1640 0.4975 0.4975 1.0216 1.0216 1.0482 1.0482 1.6838 1.6838 2.8417 2.8417 3.1714 3.1714 3.6781 3.6781 3.7698 3.7698 6.1840 6.1840 8.1632 8.1632 k = 0.4754-0.1621 0.2597 ( 10687 PWs) bands (ev): -42.5394 -42.5394 -42.5050 -42.5050 -42.3312 -42.3312 -42.2969 -42.2969 -10.1504 -10.1504 -9.6836 -9.6836 -0.4659 -0.4659 -0.1092 -0.1092 0.1549 0.1549 0.5078 0.5078 1.0371 1.0371 1.0477 1.0477 1.6436 1.6436 2.8366 2.8366 3.1684 3.1684 3.6796 3.6796 3.7649 3.7649 6.1501 6.1501 8.1377 8.1377 k = 0.4778-0.1467 0.2543 ( 10677 PWs) bands (ev): -42.5380 -42.5380 -42.5070 -42.5070 -42.3293 -42.3293 -42.2983 -42.2983 -10.1500 -10.1500 -9.6850 -9.6850 -0.4306 -0.4306 -0.1122 -0.1122 0.1466 0.1466 0.5150 0.5150 1.0476 1.0476 1.0542 1.0542 1.6029 1.6029 2.8312 2.8312 3.1654 3.1654 3.6815 3.6815 3.7605 3.7605 6.1193 6.1193 8.1143 8.1143 k = 0.4803-0.1313 0.2490 ( 10674 PWs) bands (ev): -42.5366 -42.5366 -42.5089 -42.5089 -42.3274 -42.3274 -42.2998 -42.2998 -10.1496 -10.1496 -9.6863 -9.6863 -0.3969 -0.3969 -0.1139 -0.1139 0.1391 0.1391 0.5188 0.5188 1.0543 1.0543 1.0670 1.0670 1.5621 1.5621 2.8258 2.8258 3.1625 3.1625 3.6835 3.6835 3.7569 3.7569 6.0915 6.0915 8.0932 8.0932 k = 0.4828-0.1160 0.2436 ( 10679 PWs) bands (ev): -42.5351 -42.5351 -42.5108 -42.5108 -42.3255 -42.3255 -42.3013 -42.3013 -10.1492 -10.1492 -9.6875 -9.6875 -0.3656 -0.3656 -0.1141 -0.1141 0.1324 0.1324 0.5194 0.5194 1.0640 1.0640 1.0791 1.0791 1.5213 1.5213 2.8205 2.8205 3.1597 3.1597 3.6855 3.6855 3.7539 3.7539 6.0669 6.0669 8.0743 8.0743 k = 0.4852-0.1006 0.2383 ( 10675 PWs) bands (ev): -42.5335 -42.5335 -42.5127 -42.5127 -42.3236 -42.3236 -42.3028 -42.3028 -10.1488 -10.1488 -9.6886 -9.6886 -0.3374 -0.3374 -0.1126 -0.1126 0.1266 0.1266 0.5170 0.5170 1.0775 1.0775 1.0900 1.0900 1.4810 1.4810 2.8156 2.8156 3.1572 3.1572 3.6874 3.6874 3.7517 3.7517 6.0454 6.0454 8.0578 8.0578 k = 0.4877-0.0853 0.2330 ( 10674 PWs) bands (ev): -42.5320 -42.5320 -42.5146 -42.5146 -42.3217 -42.3217 -42.3044 -42.3044 -10.1485 -10.1485 -9.6896 -9.6896 -0.3133 -0.3133 -0.1094 -0.1094 0.1217 0.1217 0.5124 0.5124 1.0942 1.0942 1.0997 1.0997 1.4414 1.4414 2.8111 2.8111 3.1550 3.1550 3.6889 3.6889 3.7501 3.7501 6.0272 6.0272 8.0438 8.0438 k = 0.4901-0.0699 0.2276 ( 10678 PWs) bands (ev): -42.5304 -42.5304 -42.5164 -42.5164 -42.3198 -42.3198 -42.3059 -42.3059 -10.1482 -10.1482 -9.6904 -9.6904 -0.2937 -0.2937 -0.1047 -0.1047 0.1177 0.1177 0.5065 0.5065 1.1064 1.1064 1.1155 1.1155 1.4030 1.4030 2.8073 2.8073 3.1530 3.1530 3.6901 3.6901 3.7491 3.7491 6.0122 6.0122 8.0322 8.0322 k = 0.4926-0.0546 0.2223 ( 10678 PWs) bands (ev): -42.5288 -42.5288 -42.5183 -42.5183 -42.3180 -42.3180 -42.3076 -42.3076 -10.1480 -10.1480 -9.6910 -9.6910 -0.2790 -0.2790 -0.0992 -0.0992 0.1145 0.1145 0.5003 0.5003 1.1127 1.1127 1.1378 1.1378 1.3665 1.3665 2.8041 2.8041 3.1515 3.1515 3.6909 3.6909 3.7485 3.7485 6.0005 6.0005 8.0232 8.0232 k = 0.4951-0.0392 0.2170 ( 10680 PWs) bands (ev): -42.5271 -42.5271 -42.5201 -42.5201 -42.3162 -42.3162 -42.3092 -42.3092 -10.1479 -10.1479 -9.6915 -9.6915 -0.2689 -0.2689 -0.0939 -0.0939 0.1123 0.1123 0.4948 0.4948 1.1172 1.1172 1.1610 1.1610 1.3335 1.3335 2.8018 2.8018 3.1504 3.1504 3.6915 3.6915 3.7482 3.7482 5.9921 5.9921 8.0167 8.0167 k = 0.4975-0.0239 0.2116 ( 10685 PWs) bands (ev): -42.5254 -42.5254 -42.5219 -42.5219 -42.3145 -42.3145 -42.3109 -42.3109 -10.1478 -10.1478 -9.6918 -9.6918 -0.2632 -0.2632 -0.0902 -0.0902 0.1110 0.1110 0.4912 0.4912 1.1198 1.1198 1.1813 1.1813 1.3073 1.3073 2.8004 2.8004 3.1497 3.1497 3.6918 3.6918 3.7481 3.7481 5.9871 5.9871 8.0128 8.0128 k = 0.5000-0.0085 0.2063 ( 10692 PWs) bands (ev): -42.5240 -42.5240 -42.5233 -42.5233 -42.3130 -42.3130 -42.3123 -42.3123 -10.1477 -10.1477 -9.6919 -9.6919 -0.2613 -0.2613 -0.0888 -0.0888 0.1105 0.1105 0.4898 0.4898 1.1207 1.1207 1.1905 1.1905 1.2962 1.2962 2.8000 2.8000 3.1495 3.1495 3.6919 3.6919 3.7480 3.7480 5.9854 5.9854 8.0115 8.0115 k = 0.5000-0.0085 0.2063 ( 10692 PWs) bands (ev): -42.5240 -42.5240 -42.5233 -42.5233 -42.3130 -42.3130 -42.3123 -42.3123 -10.1477 -10.1477 -9.6919 -9.6919 -0.2613 -0.2613 -0.0888 -0.0888 0.1105 0.1105 0.4898 0.4898 1.1207 1.1207 1.1905 1.1905 1.2962 1.2962 2.8000 2.8000 3.1495 3.1495 3.6919 3.6919 3.7480 3.7480 5.9854 5.9854 8.0115 8.0115 k = 0.4942-0.0026 0.2206 ( 10688 PWs) bands (ev): -42.5240 -42.5240 -42.5232 -42.5232 -42.3131 -42.3131 -42.3124 -42.3124 -10.1477 -10.1477 -9.6918 -9.6918 -0.2612 -0.2612 -0.0889 -0.0889 0.1095 0.1095 0.4902 0.4902 1.1093 1.1093 1.2021 1.2021 1.2964 1.2964 2.8004 2.8004 3.1490 3.1490 3.6915 3.6915 3.7476 3.7476 5.9865 5.9865 8.0107 8.0107 k = 0.4884 0.0033 0.2350 ( 10678 PWs) bands (ev): -42.5238 -42.5238 -42.5230 -42.5230 -42.3132 -42.3132 -42.3126 -42.3126 -10.1476 -10.1476 -9.6917 -9.6917 -0.2608 -0.2608 -0.0890 -0.0890 0.1064 0.1064 0.4911 0.4911 1.0856 1.0856 1.2265 1.2265 1.2971 1.2971 2.8017 2.8017 3.1478 3.1478 3.6904 3.6904 3.7462 3.7462 5.9899 5.9899 8.0081 8.0081 k = 0.4826 0.0092 0.2493 ( 10682 PWs) bands (ev): -42.5235 -42.5235 -42.5228 -42.5228 -42.3135 -42.3135 -42.3128 -42.3128 -10.1474 -10.1474 -9.6916 -9.6916 -0.2603 -0.2603 -0.0893 -0.0893 0.1014 0.1014 0.4927 0.4927 1.0582 1.0582 1.2550 1.2550 1.2983 1.2983 2.8040 2.8040 3.1458 3.1458 3.6886 3.6886 3.7440 3.7440 5.9956 5.9956 8.0037 8.0037 k = 0.4767 0.0151 0.2636 ( 10686 PWs) bands (ev): -42.5231 -42.5231 -42.5224 -42.5224 -42.3139 -42.3139 -42.3132 -42.3132 -10.1471 -10.1471 -9.6913 -9.6913 -0.2595 -0.2595 -0.0897 -0.0897 0.0944 0.0944 0.4948 0.4948 1.0296 1.0296 1.2852 1.2852 1.3001 1.3001 2.8070 2.8070 3.1430 3.1430 3.6860 3.6860 3.7409 3.7409 6.0034 6.0034 7.9974 7.9974 k = 0.4709 0.0211 0.2780 ( 10686 PWs) bands (ev): -42.5226 -42.5226 -42.5219 -42.5219 -42.3144 -42.3144 -42.3137 -42.3137 -10.1467 -10.1467 -9.6910 -9.6910 -0.2586 -0.2586 -0.0901 -0.0901 0.0856 0.0856 0.4974 0.4974 1.0005 1.0005 1.3019 1.3019 1.3168 1.3168 2.8110 2.8110 3.1395 3.1395 3.6826 3.6826 3.7371 3.7371 6.0134 6.0134 7.9891 7.9891 k = 0.4651 0.0270 0.2923 ( 10688 PWs) bands (ev): -42.5220 -42.5220 -42.5212 -42.5212 -42.3150 -42.3150 -42.3143 -42.3143 -10.1463 -10.1463 -9.6907 -9.6907 -0.2576 -0.2576 -0.0906 -0.0906 0.0750 0.0750 0.5004 0.5004 0.9712 0.9712 1.3046 1.3046 1.3490 1.3490 2.8157 2.8157 3.1352 3.1352 3.6783 3.6783 3.7326 3.7326 6.0255 6.0255 7.9786 7.9786 k = 0.4593 0.0329 0.3066 ( 10682 PWs) bands (ev): -42.5213 -42.5213 -42.5205 -42.5205 -42.3157 -42.3157 -42.3150 -42.3150 -10.1457 -10.1457 -9.6902 -9.6902 -0.2565 -0.2565 -0.0911 -0.0911 0.0628 0.0628 0.5039 0.5039 0.9417 0.9417 1.3078 1.3078 1.3821 1.3821 2.8212 2.8212 3.1303 3.1303 3.6732 3.6732 3.7276 3.7276 6.0396 6.0396 7.9656 7.9656 k = 0.4535 0.0388 0.3210 ( 10682 PWs) bands (ev): -42.5205 -42.5205 -42.5197 -42.5197 -42.3165 -42.3165 -42.3158 -42.3158 -10.1452 -10.1452 -9.6897 -9.6897 -0.2554 -0.2554 -0.0916 -0.0916 0.0491 0.0491 0.5076 0.5076 0.9121 0.9121 1.3114 1.3114 1.4161 1.4161 2.8274 2.8274 3.1247 3.1247 3.6671 3.6671 3.7221 3.7221 6.0557 6.0557 7.9498 7.9498 k = 0.4477 0.0447 0.3353 ( 10682 PWs) bands (ev): -42.5195 -42.5195 -42.5188 -42.5188 -42.3174 -42.3174 -42.3167 -42.3167 -10.1445 -10.1445 -9.6892 -9.6892 -0.2543 -0.2543 -0.0921 -0.0921 0.0340 0.0340 0.5116 0.5116 0.8824 0.8824 1.3156 1.3156 1.4510 1.4510 2.8344 2.8344 3.1186 3.1186 3.6601 3.6601 3.7163 3.7163 6.0737 6.0737 7.9309 7.9309 k = 0.4419 0.0506 0.3496 ( 10684 PWs) bands (ev): -42.5185 -42.5185 -42.5177 -42.5177 -42.3184 -42.3184 -42.3178 -42.3178 -10.1438 -10.1438 -9.6886 -9.6886 -0.2533 -0.2533 -0.0925 -0.0925 0.0177 0.0177 0.5157 0.5157 0.8528 0.8528 1.3203 1.3203 1.4869 1.4869 2.8419 2.8419 3.1120 3.1120 3.6520 3.6520 3.7102 3.7102 6.0934 6.0934 7.9086 7.9086 k = 0.4360 0.0565 0.3640 ( 10680 PWs) bands (ev): -42.5174 -42.5174 -42.5166 -42.5166 -42.3195 -42.3195 -42.3189 -42.3189 -10.1430 -10.1430 -9.6879 -9.6879 -0.2524 -0.2524 -0.0928 -0.0928 0.0002 0.0002 0.5200 0.5200 0.8233 0.8233 1.3256 1.3256 1.5239 1.5239 2.8501 2.8501 3.1050 3.1050 3.6430 3.6430 3.7040 3.7040 6.1148 6.1148 7.8823 7.8823 k = 0.4302 0.0625 0.3783 ( 10678 PWs) bands (ev): -42.5161 -42.5161 -42.5154 -42.5154 -42.3207 -42.3207 -42.3201 -42.3201 -10.1421 -10.1421 -9.6872 -9.6872 -0.2517 -0.2517 -0.0929 -0.0929 -0.0183 -0.0183 0.5243 0.5243 0.7939 0.7939 1.3315 1.3315 1.5619 1.5619 2.8588 2.8588 3.0977 3.0977 3.6330 3.6330 3.6976 3.6976 6.1378 6.1378 7.8516 7.8516 k = 0.4244 0.0684 0.3927 ( 10680 PWs) bands (ev): -42.5148 -42.5148 -42.5140 -42.5140 -42.3220 -42.3220 -42.3214 -42.3214 -10.1412 -10.1412 -9.6865 -9.6865 -0.2514 -0.2514 -0.0930 -0.0930 -0.0374 -0.0374 0.5287 0.5287 0.7647 0.7647 1.3380 1.3380 1.6011 1.6011 2.8679 2.8679 3.0902 3.0902 3.6221 3.6221 3.6911 3.6911 6.1623 6.1623 7.8159 7.8159 k = 0.4186 0.0743 0.4070 ( 10676 PWs) bands (ev): -42.5134 -42.5134 -42.5126 -42.5126 -42.3234 -42.3234 -42.3228 -42.3228 -10.1403 -10.1403 -9.6857 -9.6857 -0.2513 -0.2513 -0.0932 -0.0932 -0.0570 -0.0570 0.5330 0.5330 0.7357 0.7357 1.3450 1.3450 1.6414 1.6414 2.8774 2.8774 3.0826 3.0826 3.6104 3.6104 3.6846 3.6846 6.1882 6.1882 7.7748 7.7748 k = 0.4128 0.0802 0.4213 ( 10670 PWs) bands (ev): -42.5119 -42.5119 -42.5111 -42.5111 -42.3249 -42.3249 -42.3242 -42.3242 -10.1393 -10.1393 -9.6849 -9.6849 -0.2517 -0.2517 -0.0950 -0.0950 -0.0753 -0.0753 0.5371 0.5371 0.7070 0.7070 1.3527 1.3527 1.6830 1.6830 2.8871 2.8871 3.0750 3.0750 3.5979 3.5979 3.6779 3.6779 6.2153 6.2153 7.7277 7.7277 k = 0.4070 0.0861 0.4357 ( 10672 PWs) bands (ev): -42.5103 -42.5103 -42.5095 -42.5095 -42.3265 -42.3265 -42.3258 -42.3258 -10.1382 -10.1382 -9.6840 -9.6840 -0.2525 -0.2525 -0.1056 -0.1056 -0.0849 -0.0849 0.5412 0.5412 0.6786 0.6786 1.3609 1.3609 1.7257 1.7257 2.8969 2.8969 3.0678 3.0678 3.5848 3.5848 3.6712 3.6712 6.2436 6.2436 7.6743 7.6743 k = 0.4012 0.0920 0.4500 ( 10668 PWs) bands (ev): -42.5086 -42.5086 -42.5079 -42.5079 -42.3281 -42.3281 -42.3274 -42.3274 -10.1372 -10.1372 -9.6832 -9.6832 -0.2539 -0.2539 -0.1250 -0.1250 -0.0858 -0.0858 0.5450 0.5450 0.6507 0.6507 1.3698 1.3698 1.7697 1.7697 2.9066 2.9066 3.0610 3.0610 3.5711 3.5711 3.6644 3.6644 6.2729 6.2729 7.6141 7.6141 k = 0.3953 0.0979 0.4643 ( 10666 PWs) bands (ev): -42.5069 -42.5069 -42.5061 -42.5061 -42.3298 -42.3298 -42.3292 -42.3292 -10.1361 -10.1361 -9.6823 -9.6823 -0.2557 -0.2557 -0.1463 -0.1463 -0.0846 -0.0846 0.5486 0.5486 0.6234 0.6234 1.3792 1.3792 1.8148 1.8148 2.9158 2.9158 3.0552 3.0552 3.5568 3.5568 3.6575 3.6575 6.3032 6.3032 7.5470 7.5470 k = 0.3895 0.1039 0.4787 ( 10666 PWs) bands (ev): -42.5051 -42.5051 -42.5043 -42.5043 -42.3316 -42.3316 -42.3309 -42.3309 -10.1349 -10.1349 -9.6813 -9.6813 -0.2580 -0.2580 -0.1681 -0.1681 -0.0827 -0.0827 0.5518 0.5518 0.5968 0.5968 1.3892 1.3892 1.8612 1.8612 2.9243 2.9243 3.0506 3.0506 3.5421 3.5421 3.6505 3.6505 6.3343 6.3343 7.4732 7.4732 k = 0.3837 0.1098 0.4930 ( 10662 PWs) bands (ev): -42.5032 -42.5032 -42.5025 -42.5025 -42.3334 -42.3334 -42.3328 -42.3328 -10.1338 -10.1338 -9.6804 -9.6804 -0.2609 -0.2609 -0.1900 -0.1900 -0.0804 -0.0804 0.5536 0.5536 0.5718 0.5718 1.3997 1.3997 1.9086 1.9086 2.9315 2.9315 3.0480 3.0480 3.5270 3.5270 3.6434 3.6434 6.3661 6.3661 7.3928 7.3928 k = 0.3779 0.1157 0.5073 ( 10666 PWs) bands (ev): -42.5013 -42.5013 -42.5005 -42.5005 -42.3353 -42.3353 -42.3347 -42.3347 -10.1327 -10.1327 -9.6795 -9.6795 -0.2645 -0.2645 -0.2117 -0.2117 -0.0777 -0.0777 0.5420 0.5420 0.5608 0.5608 1.4108 1.4108 1.9570 1.9570 2.9368 2.9368 3.0480 3.0480 3.5117 3.5117 3.6363 3.6363 6.3986 6.3986 7.3063 7.3063 k = 0.3721 0.1216 0.5217 ( 10672 PWs) bands (ev): -42.4993 -42.4993 -42.4985 -42.4985 -42.3373 -42.3373 -42.3366 -42.3366 -10.1315 -10.1315 -9.6785 -9.6785 -0.2690 -0.2690 -0.2327 -0.2327 -0.0747 -0.0747 0.5184 0.5184 0.5623 0.5623 1.4223 1.4223 2.0063 2.0063 2.9398 2.9398 3.0511 3.0511 3.4961 3.4961 3.6292 3.6292 6.4315 6.4315 7.2143 7.2143 k = 0.3663 0.1275 0.5360 ( 10680 PWs) bands (ev): -42.4973 -42.4973 -42.4965 -42.4965 -42.3393 -42.3393 -42.3386 -42.3386 -10.1304 -10.1304 -9.6776 -9.6776 -0.2754 -0.2754 -0.2519 -0.2519 -0.0716 -0.0716 0.4946 0.4946 0.5644 0.5644 1.4342 1.4342 2.0563 2.0563 2.9404 2.9404 3.0574 3.0574 3.4804 3.4804 3.6221 3.6221 6.4648 6.4648 7.1175 7.1175 k = 0.3605 0.1334 0.5503 ( 10680 PWs) bands (ev): -42.4952 -42.4952 -42.4945 -42.4945 -42.3413 -42.3413 -42.3407 -42.3407 -10.1292 -10.1292 -9.6766 -9.6766 -0.2867 -0.2867 -0.2660 -0.2660 -0.0682 -0.0682 0.4716 0.4716 0.5665 0.5665 1.4465 1.4465 2.1069 2.1069 2.9389 2.9389 3.0669 3.0669 3.4646 3.4646 3.6149 3.6149 6.4983 6.4983 7.0167 7.0167 k = 0.3547 0.1393 0.5647 ( 10676 PWs) bands (ev): -42.4931 -42.4931 -42.4924 -42.4924 -42.3433 -42.3433 -42.3427 -42.3427 -10.1281 -10.1281 -9.6757 -9.6757 -0.3038 -0.3038 -0.2742 -0.2742 -0.0647 -0.0647 0.4494 0.4494 0.5683 0.5683 1.4590 1.4590 2.1578 2.1578 2.9359 2.9359 3.0791 3.0791 3.4488 3.4488 3.6079 3.6079 6.5319 6.5319 6.9130 6.9130 k = 0.3488 0.1452 0.5790 ( 10678 PWs) bands (ev): -42.4910 -42.4910 -42.4903 -42.4903 -42.3454 -42.3454 -42.3448 -42.3448 -10.1270 -10.1270 -9.6748 -9.6748 -0.3228 -0.3228 -0.2801 -0.2801 -0.0611 -0.0611 0.4281 0.4281 0.5699 0.5699 1.4718 1.4718 2.2088 2.2088 2.9318 2.9318 3.0935 3.0935 3.4332 3.4332 3.6008 3.6008 6.5654 6.5654 6.8071 6.8071 k = 0.3430 0.1512 0.5933 ( 10670 PWs) bands (ev): -42.4889 -42.4889 -42.4882 -42.4882 -42.3475 -42.3475 -42.3469 -42.3469 -10.1260 -10.1260 -9.6739 -9.6739 -0.3418 -0.3418 -0.2854 -0.2854 -0.0575 -0.0575 0.4079 0.4079 0.5713 0.5713 1.4846 1.4846 2.2596 2.2596 2.9272 2.9272 3.1099 3.1099 3.4176 3.4176 3.5939 3.5939 6.5981 6.5981 6.7004 6.7004 k = 0.3372 0.1571 0.6077 ( 10670 PWs) bands (ev): -42.4868 -42.4868 -42.4861 -42.4861 -42.3496 -42.3496 -42.3490 -42.3490 -10.1249 -10.1249 -9.6730 -9.6730 -0.3604 -0.3604 -0.2905 -0.2905 -0.0539 -0.0539 0.3887 0.3887 0.5724 0.5724 1.4974 1.4974 2.3097 2.3097 2.9224 2.9224 3.1280 3.1280 3.4024 3.4024 3.5871 3.5871 6.5881 6.5881 6.6356 6.6356 k = 0.3314 0.1630 0.6220 ( 10670 PWs) bands (ev): -42.4847 -42.4847 -42.4840 -42.4840 -42.3516 -42.3516 -42.3510 -42.3510 -10.1239 -10.1239 -9.6722 -9.6722 -0.3783 -0.3783 -0.2956 -0.2956 -0.0504 -0.0504 0.3706 0.3706 0.5734 0.5734 1.5102 1.5102 2.3588 2.3588 2.9175 2.9175 3.1478 3.1478 3.3876 3.3876 3.5805 3.5805 6.4827 6.4827 6.6661 6.6661 k = 0.3256 0.1689 0.6364 ( 10674 PWs) bands (ev): -42.4826 -42.4826 -42.4819 -42.4819 -42.3537 -42.3537 -42.3531 -42.3531 -10.1230 -10.1230 -9.6714 -9.6714 -0.3953 -0.3953 -0.3004 -0.3004 -0.0469 -0.0469 0.3536 0.3536 0.5741 0.5741 1.5227 1.5227 2.4064 2.4064 2.9129 2.9129 3.1691 3.1691 3.3734 3.3734 3.5740 3.5740 6.3764 6.3764 6.6978 6.6978 k = 0.3198 0.1748 0.6507 ( 10674 PWs) bands (ev): -42.4806 -42.4806 -42.4799 -42.4799 -42.3556 -42.3556 -42.3551 -42.3551 -10.1220 -10.1220 -9.6706 -9.6706 -0.4114 -0.4114 -0.3052 -0.3052 -0.0436 -0.0436 0.3378 0.3378 0.5747 0.5747 1.5350 1.5350 2.4520 2.4520 2.9086 2.9086 3.1918 3.1918 3.3600 3.3600 3.5679 3.5679 6.2719 6.2719 6.7289 6.7289 k = 0.3140 0.1807 0.6650 ( 10668 PWs) bands (ev): -42.4786 -42.4786 -42.4780 -42.4780 -42.3576 -42.3576 -42.3570 -42.3570 -10.1212 -10.1212 -9.6699 -9.6699 -0.4265 -0.4265 -0.3098 -0.3098 -0.0404 -0.0404 0.3231 0.3231 0.5752 0.5752 1.5468 1.5468 2.4952 2.4952 2.9046 2.9046 3.2154 3.2154 3.3478 3.3478 3.5620 3.5620 6.1699 6.1699 6.7590 6.7590 k = 0.3081 0.1866 0.6794 ( 10678 PWs) bands (ev): -42.4767 -42.4767 -42.4761 -42.4761 -42.3594 -42.3594 -42.3589 -42.3589 -10.1204 -10.1204 -9.6693 -9.6693 -0.4404 -0.4404 -0.3142 -0.3142 -0.0374 -0.0374 0.3097 0.3097 0.5755 0.5755 1.5580 1.5580 2.5355 2.5355 2.9011 2.9011 3.2391 3.2391 3.3377 3.3377 3.5564 3.5564 6.0716 6.0716 6.7878 6.7878 k = 0.3023 0.1926 0.6937 ( 10674 PWs) bands (ev): -42.4749 -42.4749 -42.4743 -42.4743 -42.3612 -42.3612 -42.3607 -42.3607 -10.1197 -10.1197 -9.6687 -9.6687 -0.4533 -0.4533 -0.3183 -0.3183 -0.0346 -0.0346 0.2975 0.2975 0.5757 0.5757 1.5687 1.5687 2.5725 2.5725 2.8982 2.8982 3.2605 3.2605 3.3319 3.3319 3.5513 3.5513 5.9776 5.9776 6.8150 6.8150 k = 0.2965 0.1985 0.7080 ( 10680 PWs) bands (ev): -42.4732 -42.4732 -42.4726 -42.4726 -42.3629 -42.3629 -42.3623 -42.3623 -10.1190 -10.1190 -9.6681 -9.6681 -0.4649 -0.4649 -0.3221 -0.3221 -0.0320 -0.0320 0.2865 0.2865 0.5758 0.5758 1.5785 1.5785 2.6058 2.6058 2.8957 2.8957 3.2742 3.2742 3.3354 3.3354 3.5467 3.5467 5.8890 5.8890 6.8405 6.8405 k = 0.2907 0.2044 0.7224 ( 10684 PWs) bands (ev): -42.4717 -42.4717 -42.4711 -42.4711 -42.3644 -42.3644 -42.3639 -42.3639 -10.1184 -10.1184 -9.6676 -9.6676 -0.4752 -0.4752 -0.3256 -0.3256 -0.0297 -0.0297 0.2768 0.2768 0.5758 0.5758 1.5875 1.5875 2.6351 2.6351 2.8938 2.8938 3.2767 3.2767 3.3513 3.3513 3.5425 3.5425 5.8067 5.8067 6.8639 6.8639 k = 0.2849 0.2103 0.7367 ( 10678 PWs) bands (ev): -42.4703 -42.4703 -42.4697 -42.4697 -42.3657 -42.3657 -42.3653 -42.3653 -10.1179 -10.1179 -9.6672 -9.6672 -0.4843 -0.4843 -0.3286 -0.3286 -0.0276 -0.0276 0.2684 0.2684 0.5759 0.5759 1.5955 1.5955 2.6604 2.6604 2.8923 2.8923 3.2729 3.2729 3.3739 3.3739 3.5391 3.5391 5.7320 5.7320 6.8850 6.8850 k = 0.2791 0.2162 0.7510 ( 10680 PWs) bands (ev): -42.4690 -42.4690 -42.4685 -42.4685 -42.3669 -42.3669 -42.3665 -42.3665 -10.1174 -10.1174 -9.6668 -9.6668 -0.4920 -0.4920 -0.3313 -0.3313 -0.0259 -0.0259 0.2613 0.2613 0.5758 0.5758 1.6025 1.6025 2.6815 2.6815 2.8914 2.8914 3.2673 3.2673 3.3976 3.3976 3.5363 3.5363 5.6658 5.6658 6.9034 6.9034 k = 0.2733 0.2221 0.7654 ( 10680 PWs) bands (ev): -42.4680 -42.4680 -42.4675 -42.4675 -42.3680 -42.3680 -42.3676 -42.3676 -10.1170 -10.1170 -9.6665 -9.6665 -0.4984 -0.4984 -0.3335 -0.3335 -0.0244 -0.0244 0.2554 0.2554 0.5758 0.5758 1.6083 1.6083 2.6986 2.6986 2.8907 2.8907 3.2619 3.2619 3.4196 3.4196 3.5345 3.5345 5.6094 5.6094 6.9189 6.9189 k = 0.2674 0.2280 0.7797 ( 10676 PWs) bands (ev): -42.4671 -42.4671 -42.4667 -42.4667 -42.3688 -42.3688 -42.3684 -42.3684 -10.1167 -10.1167 -9.6662 -9.6662 -0.5034 -0.5034 -0.3353 -0.3353 -0.0232 -0.0232 0.2508 0.2508 0.5757 0.5757 1.6128 1.6128 2.7116 2.7116 2.8904 2.8904 3.2573 3.2573 3.4379 3.4379 3.5336 3.5336 5.5641 5.5641 6.9312 6.9312 k = 0.2616 0.2340 0.7940 ( 10674 PWs) bands (ev): -42.4665 -42.4665 -42.4661 -42.4661 -42.3693 -42.3693 -42.3690 -42.3690 -10.1165 -10.1165 -9.6660 -9.6660 -0.5069 -0.5069 -0.3366 -0.3366 -0.0224 -0.0224 0.2475 0.2475 0.5757 0.5757 1.6162 1.6162 2.7208 2.7208 2.8903 2.8903 3.2538 3.2538 3.4513 3.4513 3.5337 3.5337 5.5307 5.5307 6.9402 6.9402 k = 0.2558 0.2399 0.8084 ( 10668 PWs) bands (ev): -42.4661 -42.4661 -42.4658 -42.4658 -42.3697 -42.3697 -42.3694 -42.3694 -10.1164 -10.1164 -9.6659 -9.6659 -0.5091 -0.5091 -0.3373 -0.3373 -0.0219 -0.0219 0.2456 0.2456 0.5757 0.5757 1.6182 1.6182 2.7263 2.7263 2.8903 2.8903 3.2517 3.2517 3.4591 3.4591 3.5345 3.5345 5.5103 5.5103 6.9456 6.9456 k = 0.2500 0.2458 0.8227 ( 10672 PWs) bands (ev): -42.4660 -42.4660 -42.4657 -42.4657 -42.3698 -42.3698 -42.3695 -42.3695 -10.1164 -10.1164 -9.6659 -9.6659 -0.5098 -0.5098 -0.3376 -0.3376 -0.0217 -0.0217 0.2449 0.2449 0.5756 0.5756 1.6189 1.6189 2.7281 2.7281 2.8903 2.8903 3.2509 3.2509 3.4612 3.4612 3.5353 3.5353 5.5034 5.5034 6.9475 6.9475 k = 0.2416-0.2458 0.8227 ( 10690 PWs) bands (ev): -42.4988 -42.4988 -42.4400 -42.4400 -42.3958 -42.3958 -42.3366 -42.3366 -10.1407 -10.1407 -9.6379 -9.6379 -0.4291 -0.4291 -0.2763 -0.2763 -0.0443 -0.0443 -0.0005 -0.0005 0.2937 0.2937 2.1170 2.1170 2.2172 2.2172 2.8963 2.8963 3.2537 3.2537 3.5230 3.5230 3.6165 3.6165 6.2519 6.2519 8.1952 8.1952 k = 0.2474-0.2516 0.8086 ( 10685 PWs) bands (ev): -42.5018 -42.5018 -42.4389 -42.4389 -42.3969 -42.3969 -42.3336 -42.3336 -10.1407 -10.1407 -9.6389 -9.6389 -0.4459 -0.4459 -0.2568 -0.2568 -0.0289 -0.0289 0.0049 0.0049 0.2820 0.2820 2.0686 2.0686 2.2183 2.2183 2.9051 2.9051 3.2350 3.2350 3.5317 3.5317 3.6204 3.6204 6.3607 6.3607 8.1666 8.1666 k = 0.2531-0.2575 0.7944 ( 10678 PWs) bands (ev): -42.5048 -42.5048 -42.4383 -42.4383 -42.3975 -42.3975 -42.3306 -42.3306 -10.1406 -10.1406 -9.6400 -9.6400 -0.4635 -0.4635 -0.2362 -0.2362 -0.0133 -0.0133 0.0107 0.0107 0.2720 0.2720 2.0205 2.0205 2.2187 2.2187 2.9141 2.9141 3.2170 3.2170 3.5409 3.5409 3.6247 3.6247 6.4705 6.4705 8.1323 8.1323 k = 0.2589-0.2633 0.7803 ( 10674 PWs) bands (ev): -42.5078 -42.5078 -42.4381 -42.4381 -42.3977 -42.3977 -42.3277 -42.3277 -10.1407 -10.1407 -9.6411 -9.6411 -0.4819 -0.4819 -0.2148 -0.2148 0.0024 0.0024 0.0166 0.0166 0.2640 0.2640 1.9730 1.9730 2.2184 2.2184 2.9233 2.9233 3.1997 3.1997 3.5507 3.5507 3.6293 3.6293 6.5808 6.5808 8.0943 8.0943 k = 0.2646-0.2691 0.7661 ( 10666 PWs) bands (ev): -42.5107 -42.5107 -42.4384 -42.4384 -42.3974 -42.3974 -42.3248 -42.3248 -10.1408 -10.1408 -9.6423 -9.6423 -0.5010 -0.5010 -0.1926 -0.1926 0.0181 0.0181 0.0223 0.0223 0.2584 0.2584 1.9264 1.9264 2.2174 2.2174 2.9325 2.9325 3.1833 3.1833 3.5610 3.5610 3.6342 3.6342 6.6910 6.6910 8.0541 8.0541 k = 0.2703-0.2750 0.7519 ( 10667 PWs) bands (ev): -42.5135 -42.5135 -42.4390 -42.4390 -42.3968 -42.3968 -42.3220 -42.3220 -10.1410 -10.1410 -9.6434 -9.6434 -0.5206 -0.5206 -0.1697 -0.1697 0.0270 0.0270 0.0339 0.0339 0.2555 0.2555 1.8807 1.8807 2.2158 2.2158 2.9417 2.9417 3.1676 3.1676 3.5715 3.5715 3.6396 3.6396 6.8005 6.8005 8.0128 8.0128 k = 0.2761-0.2808 0.7378 ( 10671 PWs) bands (ev): -42.5163 -42.5163 -42.4400 -42.4400 -42.3958 -42.3958 -42.3193 -42.3193 -10.1412 -10.1412 -9.6446 -9.6446 -0.5408 -0.5408 -0.1461 -0.1461 0.0308 0.0308 0.0497 0.0497 0.2556 0.2556 1.8362 1.8362 2.2137 2.2137 2.9506 2.9506 3.1528 3.1528 3.5823 3.5823 3.6454 3.6454 6.9087 6.9087 7.9713 7.9713 k = 0.2818-0.2866 0.7236 ( 10675 PWs) bands (ev): -42.5191 -42.5191 -42.4413 -42.4413 -42.3945 -42.3945 -42.3166 -42.3166 -10.1415 -10.1415 -9.6458 -9.6458 -0.5613 -0.5613 -0.1220 -0.1220 0.0331 0.0331 0.0655 0.0655 0.2590 0.2590 1.7928 1.7928 2.2110 2.2110 2.9591 2.9591 3.1390 3.1390 3.5932 3.5932 3.6517 3.6517 7.0146 7.0146 7.9308 7.9308 k = 0.2876-0.2925 0.7095 ( 10679 PWs) bands (ev): -42.5217 -42.5217 -42.4428 -42.4428 -42.3931 -42.3931 -42.3140 -42.3140 -10.1419 -10.1419 -9.6470 -9.6470 -0.5821 -0.5821 -0.0975 -0.0975 0.0338 0.0338 0.0811 0.0811 0.2656 0.2656 1.7507 1.7507 2.2079 2.2079 2.9668 2.9668 3.1264 3.1264 3.6040 3.6040 3.6586 3.6586 7.1171 7.1171 7.8923 7.8923 k = 0.2933-0.2983 0.6953 ( 10677 PWs) bands (ev): -42.5243 -42.5243 -42.4444 -42.4444 -42.3915 -42.3915 -42.3114 -42.3114 -10.1422 -10.1422 -9.6482 -9.6482 -0.6030 -0.6030 -0.0726 -0.0726 0.0330 0.0330 0.0967 0.0967 0.2753 0.2753 1.7099 1.7099 2.2044 2.2044 2.9734 2.9734 3.1154 3.1154 3.6147 3.6147 3.6662 3.6662 7.2144 7.2144 7.8575 7.8575 k = 0.2990-0.3042 0.6812 ( 10684 PWs) bands (ev): -42.5268 -42.5268 -42.4461 -42.4461 -42.3898 -42.3898 -42.3090 -42.3090 -10.1427 -10.1427 -9.6494 -9.6494 -0.6241 -0.6241 -0.0475 -0.0475 0.0309 0.0309 0.1121 0.1121 0.2880 0.2880 1.6704 1.6704 2.2006 2.2006 2.9782 2.9782 3.1065 3.1065 3.6250 3.6250 3.6745 3.6745 7.3036 7.3036 7.8294 7.8294 k = 0.3048-0.3100 0.6670 ( 10689 PWs) bands (ev): -42.5293 -42.5293 -42.4479 -42.4479 -42.3880 -42.3880 -42.3066 -42.3066 -10.1431 -10.1431 -9.6506 -9.6506 -0.6451 -0.6451 -0.0223 -0.0223 0.0276 0.0276 0.1273 0.1273 0.3032 0.3032 1.6323 1.6323 2.1965 2.1965 2.9806 2.9806 3.1002 3.1002 3.6348 3.6348 3.6835 3.6835 7.3797 7.3797 7.8128 7.8128 k = 0.3105-0.3158 0.6529 ( 10687 PWs) bands (ev): -42.5316 -42.5316 -42.4496 -42.4496 -42.3862 -42.3862 -42.3043 -42.3043 -10.1436 -10.1436 -9.6518 -9.6518 -0.6660 -0.6660 0.0029 0.0029 0.0235 0.0235 0.1424 0.1424 0.3206 0.3206 1.5955 1.5955 2.1921 2.1921 2.9803 2.9803 3.0970 3.0970 3.6441 3.6441 3.6934 3.6934 7.4350 7.4350 7.8149 7.8149 k = 0.3162-0.3217 0.6387 ( 10685 PWs) bands (ev): -42.5339 -42.5339 -42.4514 -42.4514 -42.3845 -42.3845 -42.3020 -42.3020 -10.1441 -10.1441 -9.6529 -9.6529 -0.6867 -0.6867 0.0182 0.0182 0.0284 0.0284 0.1571 0.1571 0.3398 0.3398 1.5601 1.5601 2.1876 2.1876 2.9769 2.9769 3.0968 3.0968 3.6528 3.6528 3.7041 3.7041 7.4634 7.4634 7.8420 7.8420 k = 0.3220-0.3275 0.6246 ( 10683 PWs) bands (ev): -42.5361 -42.5361 -42.4532 -42.4532 -42.3827 -42.3827 -42.2999 -42.2999 -10.1446 -10.1446 -9.6541 -9.6541 -0.7070 -0.7070 0.0132 0.0132 0.0530 0.0530 0.1716 0.1716 0.3606 0.3606 1.5260 1.5260 2.1829 2.1829 2.9710 2.9710 3.0995 3.0995 3.6609 3.6609 3.7153 3.7153 7.4666 7.4666 7.8921 7.8921 k = 0.3277-0.3334 0.6104 ( 10687 PWs) bands (ev): -42.5382 -42.5382 -42.4549 -42.4549 -42.3810 -42.3810 -42.2979 -42.2979 -10.1451 -10.1451 -9.6552 -9.6552 -0.7270 -0.7270 0.0079 0.0079 0.0774 0.0774 0.1858 0.1858 0.3826 0.3826 1.4932 1.4932 2.1782 2.1782 2.9630 2.9630 3.1043 3.1043 3.6686 3.6686 3.7270 3.7270 7.4532 7.4532 7.9562 7.9562 k = 0.3335-0.3392 0.5963 ( 10680 PWs) bands (ev): -42.5402 -42.5402 -42.4566 -42.4566 -42.3793 -42.3793 -42.2959 -42.2959 -10.1456 -10.1456 -9.6563 -9.6563 -0.7464 -0.7464 0.0024 0.0024 0.1013 0.1013 0.1997 0.1997 0.4055 0.4055 1.4616 1.4616 2.1734 2.1734 2.9537 2.9537 3.1105 3.1105 3.6758 3.6758 3.7390 3.7390 7.4309 7.4309 8.0267 8.0267 k = 0.3392-0.3450 0.5821 ( 10702 PWs) bands (ev): -42.5421 -42.5421 -42.4583 -42.4583 -42.3777 -42.3777 -42.2941 -42.2941 -10.1461 -10.1461 -9.6574 -9.6574 -0.7652 -0.7652 -0.0031 -0.0031 0.1244 0.1244 0.2133 0.2133 0.4293 0.4293 1.4313 1.4313 2.1686 2.1686 2.9436 2.9436 3.1176 3.1176 3.6827 3.6827 3.7511 3.7511 7.4043 7.4043 8.0986 8.0986 k = 0.3449-0.3509 0.5680 ( 10696 PWs) bands (ev): -42.5439 -42.5439 -42.4598 -42.4598 -42.3761 -42.3761 -42.2923 -42.2923 -10.1466 -10.1466 -9.6584 -9.6584 -0.7834 -0.7834 -0.0084 -0.0084 0.1466 0.1466 0.2266 0.2266 0.4535 0.4535 1.4021 1.4021 2.1639 2.1639 2.9330 2.9330 3.1252 3.1252 3.6893 3.6893 3.7632 3.7632 7.3759 7.3759 8.1694 8.1694 k = 0.3507-0.3567 0.5538 ( 10704 PWs) bands (ev): -42.5456 -42.5456 -42.4613 -42.4613 -42.3747 -42.3747 -42.2907 -42.2907 -10.1471 -10.1471 -9.6593 -9.6593 -0.8007 -0.8007 -0.0136 -0.0136 0.1677 0.1677 0.2396 0.2396 0.4782 0.4782 1.3741 1.3741 2.1593 2.1593 2.9222 2.9222 3.1331 3.1331 3.6956 3.6956 3.7751 3.7751 7.3473 7.3473 8.2375 8.2375 k = 0.3564-0.3625 0.5397 ( 10706 PWs) bands (ev): -42.5472 -42.5472 -42.4627 -42.4627 -42.3733 -42.3733 -42.2891 -42.2891 -10.1476 -10.1476 -9.6603 -9.6603 -0.8173 -0.8173 -0.0185 -0.0185 0.1874 0.1874 0.2524 0.2524 0.5029 0.5029 1.3472 1.3472 2.1549 2.1549 2.9115 2.9115 3.1410 3.1410 3.7016 3.7016 3.7868 3.7868 7.3191 7.3191 8.3020 8.3020 k = 0.3622-0.3684 0.5255 ( 10702 PWs) bands (ev): -42.5486 -42.5486 -42.4641 -42.4641 -42.3720 -42.3720 -42.2877 -42.2877 -10.1480 -10.1480 -9.6612 -9.6612 -0.8329 -0.8329 -0.0232 -0.0232 0.2057 0.2057 0.2651 0.2651 0.5277 0.5277 1.3214 1.3214 2.1506 2.1506 2.9010 2.9010 3.1487 3.1487 3.7072 3.7072 3.7981 3.7981 7.2920 7.2920 8.3623 8.3623 k = 0.3679-0.3742 0.5114 ( 10704 PWs) bands (ev): -42.5500 -42.5500 -42.4653 -42.4653 -42.3707 -42.3707 -42.2863 -42.2863 -10.1485 -10.1485 -9.6620 -9.6620 -0.8475 -0.8475 -0.0275 -0.0275 0.2222 0.2222 0.2777 0.2777 0.5522 0.5522 1.2968 1.2968 2.1465 2.1465 2.8909 2.8909 3.1561 3.1561 3.7126 3.7126 3.8090 3.8090 7.2662 7.2662 8.4182 8.4182 k = 0.3736-0.3801 0.4972 ( 10709 PWs) bands (ev): -42.5512 -42.5512 -42.4664 -42.4664 -42.3696 -42.3696 -42.2851 -42.2851 -10.1489 -10.1489 -9.6627 -9.6627 -0.8610 -0.8610 -0.0316 -0.0316 0.2369 0.2369 0.2901 0.2901 0.5762 0.5762 1.2732 1.2732 2.1427 2.1427 2.8813 2.8813 3.1631 3.1631 3.7176 3.7176 3.8192 3.8192 7.2422 7.2422 8.4693 8.4693 k = 0.3794-0.3859 0.4831 ( 10703 PWs) bands (ev): -42.5524 -42.5524 -42.4675 -42.4675 -42.3686 -42.3686 -42.2840 -42.2840 -10.1493 -10.1493 -9.6634 -9.6634 -0.8735 -0.8735 -0.0352 -0.0352 0.2497 0.2497 0.3023 0.3023 0.5996 0.5996 1.2509 1.2509 2.1391 2.1391 2.8723 2.8723 3.1697 3.1697 3.7222 3.7222 3.8289 3.8289 7.2200 7.2200 8.5156 8.5156 k = 0.3851-0.3917 0.4689 ( 10701 PWs) bands (ev): -42.5534 -42.5534 -42.4684 -42.4684 -42.3677 -42.3677 -42.2830 -42.2830 -10.1496 -10.1496 -9.6641 -9.6641 -0.8848 -0.8848 -0.0386 -0.0386 0.2607 0.2607 0.3140 0.3140 0.6221 0.6221 1.2298 1.2298 2.1359 2.1359 2.8640 2.8640 3.1757 3.1757 3.7264 3.7264 3.8377 3.8377 7.1998 7.1998 8.5570 8.5570 k = 0.3909-0.3976 0.4548 ( 10697 PWs) bands (ev): -42.5543 -42.5543 -42.4692 -42.4692 -42.3668 -42.3668 -42.2821 -42.2821 -10.1500 -10.1500 -9.6646 -9.6646 -0.8948 -0.8948 -0.0415 -0.0415 0.2700 0.2700 0.3250 0.3250 0.6433 0.6433 1.2102 1.2102 2.1329 2.1329 2.8564 2.8564 3.1812 3.1812 3.7303 3.7303 3.8458 3.8458 7.1817 7.1817 8.5933 8.5933 k = 0.3966-0.4034 0.4406 ( 10697 PWs) bands (ev): -42.5551 -42.5551 -42.4700 -42.4700 -42.3661 -42.3661 -42.2814 -42.2814 -10.1503 -10.1503 -9.6651 -9.6651 -0.9036 -0.9036 -0.0441 -0.0441 0.2778 0.2778 0.3351 0.3351 0.6631 0.6631 1.1922 1.1922 2.1303 2.1303 2.8497 2.8497 3.1860 3.1860 3.7336 3.7336 3.8529 3.8529 7.1658 7.1658 8.6231 8.6231 k = 0.4023-0.4093 0.4265 ( 10700 PWs) bands (ev): -42.5558 -42.5558 -42.4706 -42.4706 -42.3655 -42.3655 -42.2807 -42.2807 -10.1505 -10.1505 -9.6656 -9.6656 -0.9111 -0.9111 -0.0463 -0.0463 0.2842 0.2842 0.3440 0.3440 0.6809 0.6809 1.1760 1.1760 2.1281 2.1281 2.8439 2.8439 3.1901 3.1901 3.7365 3.7365 3.8591 3.8591 7.1523 7.1523 8.6086 8.6086 k = 0.4081-0.4151 0.4123 ( 10708 PWs) bands (ev): -42.5563 -42.5563 -42.4711 -42.4711 -42.3650 -42.3650 -42.2802 -42.2802 -10.1507 -10.1507 -9.6659 -9.6659 -0.9173 -0.9173 -0.0481 -0.0481 0.2894 0.2894 0.3515 0.3515 0.6965 0.6965 1.1619 1.1619 2.1262 2.1262 2.8391 2.8391 3.1936 3.1936 3.7389 3.7389 3.8642 3.8642 7.1412 7.1412 8.5947 8.5947 k = 0.4138-0.4209 0.3981 ( 10704 PWs) bands (ev): -42.5567 -42.5567 -42.4715 -42.4715 -42.3646 -42.3646 -42.2798 -42.2798 -10.1509 -10.1509 -9.6662 -9.6662 -0.9222 -0.9222 -0.0495 -0.0495 0.2933 0.2933 0.3574 0.3574 0.7093 0.7093 1.1504 1.1504 2.1248 2.1248 2.8353 2.8353 3.1963 3.1963 3.7408 3.7408 3.8683 3.8683 7.1324 7.1324 8.5839 8.5839 k = 0.4196-0.4268 0.3840 ( 10710 PWs) bands (ev): -42.5571 -42.5571 -42.4718 -42.4718 -42.3643 -42.3643 -42.2795 -42.2795 -10.1510 -10.1510 -9.6664 -9.6664 -0.9257 -0.9257 -0.0505 -0.0505 0.2961 0.2961 0.3618 0.3618 0.7188 0.7188 1.1418 1.1418 2.1237 2.1237 2.8326 2.8326 3.1982 3.1982 3.7422 3.7422 3.8712 3.8712 7.1262 7.1262 8.5761 8.5761 k = 0.4253-0.4326 0.3698 ( 10699 PWs) bands (ev): -42.5572 -42.5572 -42.4719 -42.4719 -42.3642 -42.3642 -42.2793 -42.2793 -10.1510 -10.1510 -9.6665 -9.6665 -0.9277 -0.9277 -0.0511 -0.0511 0.2977 0.2977 0.3644 0.3644 0.7247 0.7247 1.1365 1.1365 2.1231 2.1231 2.8309 2.8309 3.1994 3.1994 3.7430 3.7430 3.8730 3.8730 7.1224 7.1224 8.5714 8.5714 k = 0.4310-0.4384 0.3557 ( 10704 PWs) bands (ev): -42.5573 -42.5573 -42.4720 -42.4720 -42.3641 -42.3641 -42.2792 -42.2792 -10.1511 -10.1511 -9.6665 -9.6665 -0.9284 -0.9284 -0.0513 -0.0513 0.2982 0.2982 0.3653 0.3653 0.7267 0.7267 1.1347 1.1347 2.1229 2.1229 2.8304 2.8304 3.1998 3.1998 3.7433 3.7433 3.8735 3.8735 7.1211 7.1211 8.5699 8.5699 k = 0.5690 0.4214 0.0569 ( 10704 PWs) bands (ev): -42.5573 -42.5573 -42.4720 -42.4720 -42.3641 -42.3641 -42.2792 -42.2792 -10.1511 -10.1511 -9.6665 -9.6665 -0.9284 -0.9284 -0.0513 -0.0513 0.2982 0.2982 0.3653 0.3653 0.7267 0.7267 1.1347 1.1347 2.1229 2.1229 2.8304 2.8304 3.1998 3.1998 3.7433 3.7433 3.8735 3.8735 7.1211 7.1211 8.5699 8.5699 k = 0.5591 0.4314 0.0488 ( 10698 PWs) bands (ev): -42.5581 -42.5581 -42.4699 -42.4699 -42.3662 -42.3662 -42.2784 -42.2784 -10.1502 -10.1502 -9.6671 -9.6671 -0.9365 -0.9365 -0.0639 -0.0639 0.3087 0.3087 0.3718 0.3718 0.7184 0.7184 1.1320 1.1320 2.1303 2.1303 2.8294 2.8294 3.1999 3.1999 3.7482 3.7482 3.8780 3.8780 7.2197 7.2197 8.4683 8.4683 k = 0.5493 0.4415 0.0406 ( 10696 PWs) bands (ev): -42.5588 -42.5588 -42.4681 -42.4681 -42.3680 -42.3680 -42.2778 -42.2778 -10.1495 -10.1495 -9.6675 -9.6675 -0.9433 -0.9433 -0.0746 -0.0746 0.3177 0.3177 0.3774 0.3774 0.7113 0.7113 1.1297 1.1297 2.1365 2.1365 2.8286 2.8286 3.2001 3.2001 3.7525 3.7525 3.8818 3.8818 7.3191 7.3191 8.3658 8.3658 k = 0.5394 0.4515 0.0325 ( 10708 PWs) bands (ev): -42.5593 -42.5593 -42.4665 -42.4665 -42.3696 -42.3696 -42.2772 -42.2772 -10.1489 -10.1489 -9.6679 -9.6679 -0.9489 -0.9489 -0.0833 -0.0833 0.3250 0.3250 0.3820 0.3820 0.7054 0.7054 1.1279 1.1279 2.1417 2.1417 2.8279 2.8279 3.2002 3.2002 3.7561 3.7561 3.8850 3.8850 7.4192 7.4192 8.2630 8.2630 k = 0.5296 0.4615 0.0244 ( 10720 PWs) bands (ev): -42.5598 -42.5598 -42.4652 -42.4652 -42.3708 -42.3708 -42.2768 -42.2768 -10.1485 -10.1485 -9.6682 -9.6682 -0.9534 -0.9534 -0.0901 -0.0901 0.3307 0.3307 0.3856 0.3856 0.7009 0.7009 1.1264 1.1264 2.1457 2.1457 2.8274 2.8274 3.2003 3.2003 3.7590 3.7590 3.8875 3.8875 7.5193 7.5193 8.1605 8.1605 k = 0.5197 0.4715 0.0163 ( 10724 PWs) bands (ev): -42.5601 -42.5601 -42.4643 -42.4643 -42.3718 -42.3718 -42.2765 -42.2765 -10.1481 -10.1481 -9.6684 -9.6684 -0.9565 -0.9565 -0.0950 -0.0950 0.3349 0.3349 0.3883 0.3883 0.6976 0.6976 1.1254 1.1254 2.1485 2.1485 2.8270 2.8270 3.2003 3.2003 3.7611 3.7611 3.8893 3.8893 7.6184 7.6184 8.0598 8.0598 k = 0.5099 0.4815 0.0081 ( 10732 PWs) bands (ev): -42.5603 -42.5603 -42.4637 -42.4637 -42.3723 -42.3723 -42.2764 -42.2764 -10.1479 -10.1479 -9.6685 -9.6685 -0.9584 -0.9584 -0.0980 -0.0980 0.3373 0.3373 0.3898 0.3898 0.6957 0.6957 1.1248 1.1248 2.1503 2.1503 2.8268 2.8268 3.2004 3.2004 3.7623 3.7623 3.8904 3.8904 7.7116 7.7116 7.9655 7.9655 k = 0.5000 0.4916 0.0000 ( 10740 PWs) bands (ev): -42.5603 -42.5603 -42.4635 -42.4635 -42.3725 -42.3725 -42.2763 -42.2763 -10.1479 -10.1479 -9.6686 -9.6686 -0.9591 -0.9591 -0.0989 -0.0989 0.3382 0.3382 0.3904 0.3904 0.6950 0.6950 1.1246 1.1246 2.1508 2.1508 2.8267 2.8267 3.2004 3.2004 3.7628 3.7628 3.8907 3.8907 7.7660 7.7660 7.9108 7.9108 Writing output data file Li4FeN2.save init_run : 0.32s CPU 0.53s WALL ( 1 calls) electrons : 235.33s CPU 237.95s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 235.32s CPU 237.95s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.04s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.15s WALL ( 393 calls) cegterg : 197.55s CPU 199.25s WALL ( 469 calls) Called by sum_band: Called by *egterg: h_psi : 172.26s CPU 173.79s WALL ( 7569 calls) s_psi : 4.70s CPU 4.59s WALL ( 7569 calls) g_psi : 0.39s CPU 0.44s WALL ( 6707 calls) cdiaghg : 31.30s CPU 31.56s WALL ( 7100 calls) cegterg:over : 7.67s CPU 7.64s WALL ( 6707 calls) cegterg:upda : 7.68s CPU 7.67s WALL ( 6707 calls) cegterg:last : 3.78s CPU 3.87s WALL ( 1255 calls) cdiaghg:chol : 1.94s CPU 1.87s WALL ( 7100 calls) cdiaghg:inve : 0.80s CPU 0.82s WALL ( 7100 calls) cdiaghg:para : 1.94s CPU 1.86s WALL ( 14200 calls) Called by h_psi: h_psi:vloc : 160.56s CPU 162.00s WALL ( 7569 calls) h_psi:vnl : 11.27s CPU 11.34s WALL ( 7569 calls) add_vuspsi : 5.16s CPU 5.20s WALL ( 7569 calls) General routines calbec : 6.08s CPU 6.12s WALL ( 7569 calls) fft : 0.00s CPU 0.01s WALL ( 15 calls) fftw : 151.78s CPU 153.12s WALL ( 643648 calls) davcio : 0.37s CPU 0.40s WALL ( 786 calls) Parallel routines fft_scatter : 46.54s CPU 47.48s WALL ( 643663 calls) PWSCF : 4m21.09s CPU 4m42.20s WALL This run was terminated on: 18:19:12 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. 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