Program PWSCF v.5.1.1 starts on 19Jul2015 at 19:21:23 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Sb8Te3.save/ file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 130 68 20 3002 1149 186 Max 131 69 21 3004 1165 188 Sum 6241 3311 977 144103 55627 8965 bravais-lattice index = 14 lattice parameter (alat) = 40.5173 a.u. unit-cell volume = 2270.8450 (a.u.)^3 number of atoms/cell = 11 number of atomic types = 2 number of electrons = 58.00 number of Kohn-Sham states= 70 kinetic-energy cutoff = 32.0000 Ry charge density cutoff = 242.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 40.517335 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.980158 celldm(5)= 0.980158 celldm(6)= 0.980158 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.980158 0.198220 0.000000 ) a(3) = ( 0.980158 0.098117 0.172233 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -4.944792 -2.873949 ) b(2) = ( 0.000000 5.044896 -2.873949 ) b(3) = ( 0.000000 0.000000 5.806079 ) PseudoPot. # 1 for Sb read from file: /home/autes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 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 1243 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 Te read from file: /home/autes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Sb 5.00 121.76000 Sb( 1.00) Te 6.00 127.60000 Te( 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: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 260 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 2) = ( 0.0116279 -0.0574976 -0.0334180), wk = 0.0038462 k( 3) = ( 0.0232558 -0.1149951 -0.0668360), wk = 0.0038462 k( 4) = ( 0.0348837 -0.1724927 -0.1002540), wk = 0.0038462 k( 5) = ( 0.0465116 -0.2299903 -0.1336721), wk = 0.0038462 k( 6) = ( 0.0581395 -0.2874879 -0.1670901), wk = 0.0038462 k( 7) = ( 0.0697674 -0.3449855 -0.2005081), wk = 0.0038462 k( 8) = ( 0.0813954 -0.4024831 -0.2339261), wk = 0.0038462 k( 9) = ( 0.0930233 -0.4599807 -0.2673441), wk = 0.0038462 k( 10) = ( 0.1046512 -0.5174782 -0.3007621), wk = 0.0038462 k( 11) = ( 0.1162791 -0.5749758 -0.3341801), wk = 0.0038462 k( 12) = ( 0.1279070 -0.6324734 -0.3675982), wk = 0.0038462 k( 13) = ( 0.1395349 -0.6899710 -0.4010162), wk = 0.0038462 k( 14) = ( 0.1511628 -0.7474686 -0.4344342), wk = 0.0038462 k( 15) = ( 0.1627907 -0.8049662 -0.4678522), wk = 0.0038462 k( 16) = ( 0.1744186 -0.8624637 -0.5012702), wk = 0.0038462 k( 17) = ( 0.1860465 -0.9199613 -0.5346882), wk = 0.0038462 k( 18) = ( 0.1976744 -0.9774589 -0.5681062), wk = 0.0038462 k( 19) = ( 0.2093023 -1.0349565 -0.6015243), wk = 0.0038462 k( 20) = ( 0.2209302 -1.0924541 -0.6349423), wk = 0.0038462 k( 21) = ( 0.2325581 -1.1499517 -0.6683603), wk = 0.0038462 k( 22) = ( 0.2441860 -1.2074493 -0.7017783), wk = 0.0038462 k( 23) = ( 0.2558140 -1.2649468 -0.7351963), wk = 0.0038462 k( 24) = ( 0.2674419 -1.3224444 -0.7686143), wk = 0.0038462 k( 25) = ( 0.2790698 -1.3799420 -0.8020323), wk = 0.0038462 k( 26) = ( 0.2906977 -1.4374396 -0.8354503), wk = 0.0038462 k( 27) = ( 0.3023256 -1.4949372 -0.8688684), wk = 0.0038462 k( 28) = ( 0.3139535 -1.5524348 -0.9022864), wk = 0.0038462 k( 29) = ( 0.3255814 -1.6099324 -0.9357044), wk = 0.0038462 k( 30) = ( 0.3372093 -1.6674299 -0.9691224), wk = 0.0038462 k( 31) = ( 0.3488372 -1.7249275 -1.0025404), wk = 0.0038462 k( 32) = ( 0.3604651 -1.7824251 -1.0359584), wk = 0.0038462 k( 33) = ( 0.3720930 -1.8399227 -1.0693764), wk = 0.0038462 k( 34) = ( 0.3837209 -1.8974203 -1.1027945), wk = 0.0038462 k( 35) = ( 0.3953488 -1.9549179 -1.1362125), wk = 0.0038462 k( 36) = ( 0.4069767 -2.0124154 -1.1696305), wk = 0.0038462 k( 37) = ( 0.4186047 -2.0699130 -1.2030485), wk = 0.0038462 k( 38) = ( 0.4302326 -2.1274106 -1.2364665), wk = 0.0038462 k( 39) = ( 0.4418605 -2.1849082 -1.2698845), wk = 0.0038462 k( 40) = ( 0.4534884 -2.2424058 -1.3033025), wk = 0.0038462 k( 41) = ( 0.4651163 -2.2999034 -1.3367206), wk = 0.0038462 k( 42) = ( 0.4767442 -2.3574010 -1.3701386), wk = 0.0038462 k( 43) = ( 0.4883721 -2.4148985 -1.4035566), wk = 0.0038462 k( 44) = ( 0.5000000 -2.4723961 -1.4369746), wk = 0.0038462 k( 45) = ( 0.5000000 -2.4723961 -1.4369746), wk = 0.0038462 k( 46) = ( 0.5000000 -2.4383126 -1.4956172), wk = 0.0038462 k( 47) = ( 0.5000000 -2.4042291 -1.5542598), wk = 0.0038462 k( 48) = ( 0.5000000 -2.3701456 -1.6129024), wk = 0.0038462 k( 49) = ( 0.5000000 -2.3360621 -1.6715450), wk = 0.0038462 k( 50) = ( 0.5000000 -2.3019786 -1.7301876), wk = 0.0038462 k( 51) = ( 0.5000000 -2.2678951 -1.7888302), wk = 0.0038462 k( 52) = ( 0.5000000 -2.2338116 -1.8474728), wk = 0.0038462 k( 53) = ( 0.5000000 -2.1997281 -1.9061154), wk = 0.0038462 k( 54) = ( 0.5000000 -2.1656446 -1.9647580), wk = 0.0038462 k( 55) = ( 0.5000000 -2.1315611 -2.0234006), wk = 0.0038462 k( 56) = ( 0.5000000 -2.0974776 -2.0820431), wk = 0.0038462 k( 57) = ( 0.5000000 -2.0633941 -2.1406858), wk = 0.0038462 k( 58) = ( 0.5000000 -2.0293106 -2.1993284), wk = 0.0038462 k( 59) = ( 0.5000000 -1.9952271 -2.2579710), wk = 0.0038462 k( 60) = ( 0.5000000 -1.9611436 -2.3166136), wk = 0.0038462 k( 61) = ( 0.5000000 -1.9270601 -2.3752561), wk = 0.0038462 k( 62) = ( 0.5000000 -1.8929766 -2.4338988), wk = 0.0038462 k( 63) = ( 0.5000000 -1.8588931 -2.4925414), wk = 0.0038462 k( 64) = ( 0.5000000 -1.8248095 -2.5511840), wk = 0.0038462 k( 65) = ( 0.5000000 -1.7907261 -2.6098265), wk = 0.0038462 k( 66) = ( 0.5000000 -1.7566426 -2.6684691), wk = 0.0038462 k( 67) = ( 0.5000000 -1.7225590 -2.7271118), wk = 0.0038462 k( 68) = ( 0.5000000 -1.6884755 -2.7857544), wk = 0.0038462 k( 69) = ( 0.5000000 -1.6543921 -2.8443969), wk = 0.0038462 k( 70) = ( 0.5000000 -1.6203085 -2.9030395), wk = 0.0038462 k( 71) = ( 0.8310991 -1.5871645 -2.8448588), wk = 0.0038462 k( 72) = ( 0.8243419 -1.5537519 -2.7862068), wk = 0.0038462 k( 73) = ( 0.8175848 -1.5203393 -2.7275548), wk = 0.0038462 k( 74) = ( 0.8108277 -1.4869267 -2.6689028), wk = 0.0038462 k( 75) = ( 0.8040706 -1.4535141 -2.6102507), wk = 0.0038462 k( 76) = ( 0.7973134 -1.4201016 -2.5515987), wk = 0.0038462 k( 77) = ( 0.7905563 -1.3866890 -2.4929467), wk = 0.0038462 k( 78) = ( 0.7837992 -1.3532764 -2.4342946), wk = 0.0038462 k( 79) = ( 0.7770421 -1.3198639 -2.3756426), wk = 0.0038462 k( 80) = ( 0.7702849 -1.2864513 -2.3169907), wk = 0.0038462 k( 81) = ( 0.7635278 -1.2530387 -2.2583386), wk = 0.0038462 k( 82) = ( 0.7567707 -1.2196262 -2.1996866), wk = 0.0038462 k( 83) = ( 0.7500136 -1.1862136 -2.1410345), wk = 0.0038462 k( 84) = ( 0.7432564 -1.1528010 -2.0823825), wk = 0.0038462 k( 85) = ( 0.7364993 -1.1193884 -2.0237305), wk = 0.0038462 k( 86) = ( 0.7297422 -1.0859758 -1.9650784), wk = 0.0038462 k( 87) = ( 0.7229851 -1.0525633 -1.9064264), wk = 0.0038462 k( 88) = ( 0.7162280 -1.0191507 -1.8477745), wk = 0.0038462 k( 89) = ( 0.7094708 -0.9857381 -1.7891224), wk = 0.0038462 k( 90) = ( 0.7027137 -0.9523256 -1.7304704), wk = 0.0038462 k( 91) = ( 0.6959566 -0.9189130 -1.6718184), wk = 0.0038462 k( 92) = ( 0.6891995 -0.8855004 -1.6131663), wk = 0.0038462 k( 93) = ( 0.6824423 -0.8520879 -1.5545143), wk = 0.0038462 k( 94) = ( 0.6756852 -0.8186753 -1.4958622), wk = 0.0038462 k( 95) = ( 0.6689281 -0.7852627 -1.4372102), wk = 0.0038462 k( 96) = ( 0.6621710 -0.7518501 -1.3785582), wk = 0.0038462 k( 97) = ( 0.6554138 -0.7184375 -1.3199062), wk = 0.0038462 k( 98) = ( 0.6486567 -0.6850250 -1.2612542), wk = 0.0038462 k( 99) = ( 0.6418996 -0.6516124 -1.2026022), wk = 0.0038462 k( 100) = ( 0.6351425 -0.6181998 -1.1439501), wk = 0.0038462 k( 101) = ( 0.6283853 -0.5847873 -1.0852981), wk = 0.0038462 k( 102) = ( 0.6216282 -0.5513747 -1.0266461), wk = 0.0038462 k( 103) = ( 0.6148711 -0.5179621 -0.9679940), wk = 0.0038462 k( 104) = ( 0.6081140 -0.4845496 -0.9093420), wk = 0.0038462 k( 105) = ( 0.6013569 -0.4511370 -0.8506900), wk = 0.0038462 k( 106) = ( 0.5945997 -0.4177244 -0.7920380), wk = 0.0038462 k( 107) = ( 0.5878426 -0.3843118 -0.7333860), wk = 0.0038462 k( 108) = ( 0.5810855 -0.3508992 -0.6747339), wk = 0.0038462 k( 109) = ( 0.5743284 -0.3174867 -0.6160819), wk = 0.0038462 k( 110) = ( 0.5675712 -0.2840741 -0.5574299), wk = 0.0038462 k( 111) = ( 0.5608141 -0.2506615 -0.4987778), wk = 0.0038462 k( 112) = ( 0.5540570 -0.2172490 -0.4401258), wk = 0.0038462 k( 113) = ( 0.5472999 -0.1838364 -0.3814738), wk = 0.0038462 k( 114) = ( 0.5405427 -0.1504238 -0.3228218), wk = 0.0038462 k( 115) = ( 0.5337856 -0.1170113 -0.2641698), wk = 0.0038462 k( 116) = ( 0.5270285 -0.0835987 -0.2055177), wk = 0.0038462 k( 117) = ( 0.5202714 -0.0501861 -0.1468657), wk = 0.0038462 k( 118) = ( 0.5135142 -0.0167735 -0.0882137), wk = 0.0038462 k( 119) = ( 0.5067571 0.0166391 -0.0295616), wk = 0.0038462 k( 120) = ( 0.5000000 0.0500516 0.0290904), wk = 0.0038462 k( 121) = ( 0.5000000 0.0500516 0.0290904), wk = 0.0038462 k( 122) = ( 0.4375000 0.0437952 0.0254541), wk = 0.0038462 k( 123) = ( 0.3750000 0.0375387 0.0218178), wk = 0.0038462 k( 124) = ( 0.3125000 0.0312823 0.0181815), wk = 0.0038462 k( 125) = ( 0.2500000 0.0250258 0.0145452), wk = 0.0038462 k( 126) = ( 0.1875000 0.0187694 0.0109089), wk = 0.0038462 k( 127) = ( 0.1250000 0.0125129 0.0072726), wk = 0.0038462 k( 128) = ( 0.0625000 0.0062565 0.0036363), wk = 0.0038462 k( 129) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 130) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 131) = ( 0.0066890 -0.0330758 -0.0580608), wk = 0.0038462 k( 132) = ( 0.0133780 -0.0661515 -0.1161216), wk = 0.0038462 k( 133) = ( 0.0200670 -0.0992273 -0.1741824), wk = 0.0038462 k( 134) = ( 0.0267560 -0.1323031 -0.2322432), wk = 0.0038462 k( 135) = ( 0.0334450 -0.1653788 -0.2903040), wk = 0.0038462 k( 136) = ( 0.0401341 -0.1984546 -0.3483648), wk = 0.0038462 k( 137) = ( 0.0468231 -0.2315304 -0.4064256), wk = 0.0038462 k( 138) = ( 0.0535121 -0.2646061 -0.4644864), wk = 0.0038462 k( 139) = ( 0.0602011 -0.2976818 -0.5225471), wk = 0.0038462 k( 140) = ( 0.0668901 -0.3307576 -0.5806079), wk = 0.0038462 k( 141) = ( 0.0735791 -0.3638334 -0.6386687), wk = 0.0038462 k( 142) = ( 0.0802681 -0.3969091 -0.6967295), wk = 0.0038462 k( 143) = ( 0.0869571 -0.4299849 -0.7547903), wk = 0.0038462 k( 144) = ( 0.0936461 -0.4630607 -0.8128511), wk = 0.0038462 k( 145) = ( 0.1003351 -0.4961364 -0.8709119), wk = 0.0038462 k( 146) = ( 0.1070241 -0.5292122 -0.9289727), wk = 0.0038462 k( 147) = ( 0.1137132 -0.5622880 -0.9870334), wk = 0.0038462 k( 148) = ( 0.1204022 -0.5953637 -1.0450942), wk = 0.0038462 k( 149) = ( 0.1270912 -0.6284395 -1.1031550), wk = 0.0038462 k( 150) = ( 0.1337802 -0.6615153 -1.1612158), wk = 0.0038462 k( 151) = ( 0.1404692 -0.6945910 -1.2192766), wk = 0.0038462 k( 152) = ( 0.1471582 -0.7276668 -1.2773374), wk = 0.0038462 k( 153) = ( 0.1538472 -0.7607425 -1.3353982), wk = 0.0038462 k( 154) = ( 0.1605362 -0.7938183 -1.3934590), wk = 0.0038462 k( 155) = ( 0.1672252 -0.8268941 -1.4515198), wk = 0.0038462 k( 156) = ( 0.1739142 -0.8599698 -1.5095805), wk = 0.0038462 k( 157) = ( 0.1806032 -0.8930456 -1.5676413), wk = 0.0038462 k( 158) = ( 0.1872923 -0.9261213 -1.6257021), wk = 0.0038462 k( 159) = ( 0.1939813 -0.9591971 -1.6837629), wk = 0.0038462 k( 160) = ( 0.2006703 -0.9922729 -1.7418237), wk = 0.0038462 k( 161) = ( 0.2073593 -1.0253486 -1.7998845), wk = 0.0038462 k( 162) = ( 0.2140483 -1.0584244 -1.8579453), wk = 0.0038462 k( 163) = ( 0.2207373 -1.0915001 -1.9160061), wk = 0.0038462 k( 164) = ( 0.2274263 -1.1245759 -1.9740669), wk = 0.0038462 k( 165) = ( 0.2341153 -1.1576517 -2.0321277), wk = 0.0038462 k( 166) = ( 0.2408043 -1.1907274 -2.0901885), wk = 0.0038462 k( 167) = ( 0.2474934 -1.2238032 -2.1482493), wk = 0.0038462 k( 168) = ( 0.2541824 -1.2568790 -2.2063101), wk = 0.0038462 k( 169) = ( 0.2608714 -1.2899547 -2.2643709), wk = 0.0038462 k( 170) = ( 0.2675604 -1.3230305 -2.3224317), wk = 0.0038462 k( 171) = ( 0.2742494 -1.3561063 -2.3804925), wk = 0.0038462 k( 172) = ( 0.2809384 -1.3891820 -2.4385533), wk = 0.0038462 k( 173) = ( 0.2876274 -1.4222578 -2.4966141), wk = 0.0038462 k( 174) = ( 0.2943164 -1.4553335 -2.5546748), wk = 0.0038462 k( 175) = ( 0.3010054 -1.4884093 -2.6127356), wk = 0.0038462 k( 176) = ( 0.3076944 -1.5214850 -2.6707964), wk = 0.0038462 k( 177) = ( 0.3143834 -1.5545608 -2.7288572), wk = 0.0038462 k( 178) = ( 0.3210725 -1.5876366 -2.7869180), wk = 0.0038462 k( 179) = ( 0.3277615 -1.6207123 -2.8449787), wk = 0.0038462 k( 180) = ( 0.3344505 -1.6537881 -2.9030395), wk = 0.0038462 k( 181) = ( 0.6655495 -1.6037365 -2.8739492), wk = 0.0038462 k( 182) = ( 0.6589276 -1.5375850 -2.8739492), wk = 0.0038462 k( 183) = ( 0.6523056 -1.4714335 -2.8739492), wk = 0.0038462 k( 184) = ( 0.6456836 -1.4052820 -2.8739492), wk = 0.0038462 k( 185) = ( 0.6390616 -1.3391304 -2.8739492), wk = 0.0038462 k( 186) = ( 0.6324396 -1.2729788 -2.8739492), wk = 0.0038462 k( 187) = ( 0.6258176 -1.2068273 -2.8739492), wk = 0.0038462 k( 188) = ( 0.6191957 -1.1406758 -2.8739492), wk = 0.0038462 k( 189) = ( 0.6125737 -1.0745243 -2.8739492), wk = 0.0038462 k( 190) = ( 0.6059517 -1.0083728 -2.8739492), wk = 0.0038462 k( 191) = ( 0.5993297 -0.9422213 -2.8739492), wk = 0.0038462 k( 192) = ( 0.5927077 -0.8760698 -2.8739492), wk = 0.0038462 k( 193) = ( 0.5860858 -0.8099183 -2.8739492), wk = 0.0038462 k( 194) = ( 0.5794638 -0.7437666 -2.8739492), wk = 0.0038462 k( 195) = ( 0.5728418 -0.6776151 -2.8739492), wk = 0.0038462 k( 196) = ( 0.5662198 -0.6114636 -2.8739492), wk = 0.0038462 k( 197) = ( 0.5595978 -0.5453121 -2.8739492), wk = 0.0038462 k( 198) = ( 0.5529759 -0.4791606 -2.8739492), wk = 0.0038462 k( 199) = ( 0.5463539 -0.4130091 -2.8739492), wk = 0.0038462 k( 200) = ( 0.5397319 -0.3468576 -2.8739492), wk = 0.0038462 k( 201) = ( 0.5331099 -0.2807060 -2.8739492), wk = 0.0038462 k( 202) = ( 0.5264879 -0.2145544 -2.8739492), wk = 0.0038462 k( 203) = ( 0.5198659 -0.1484029 -2.8739492), wk = 0.0038462 k( 204) = ( 0.5132440 -0.0822514 -2.8739492), wk = 0.0038462 k( 205) = ( 0.5066220 -0.0160999 -2.8739492), wk = 0.0038462 k( 206) = ( 0.5000000 0.0500516 -2.8739492), wk = 0.0038462 k( 207) = ( 0.5000000 0.0500516 -2.8739492), wk = 0.0038462 k( 208) = ( 0.5551832 0.0555756 -2.8642524), wk = 0.0038462 k( 209) = ( 0.6103663 0.0610996 -2.8545556), wk = 0.0038462 k( 210) = ( 0.6655495 0.0666237 -2.8448588), wk = 0.0038462 k( 211) = ( 0.6655495 0.0666237 -2.8448588), wk = 0.0038462 k( 212) = ( 0.6616995 0.0662383 -2.7780228), wk = 0.0038462 k( 213) = ( 0.6578496 0.0658529 -2.7111868), wk = 0.0038462 k( 214) = ( 0.6539996 0.0654675 -2.6443507), wk = 0.0038462 k( 215) = ( 0.6501496 0.0650821 -2.5775147), wk = 0.0038462 k( 216) = ( 0.6462996 0.0646967 -2.5106787), wk = 0.0038462 k( 217) = ( 0.6424496 0.0643113 -2.4438426), wk = 0.0038462 k( 218) = ( 0.6385996 0.0639259 -2.3770067), wk = 0.0038462 k( 219) = ( 0.6347496 0.0635405 -2.3101706), wk = 0.0038462 k( 220) = ( 0.6308996 0.0631551 -2.2433346), wk = 0.0038462 k( 221) = ( 0.6270496 0.0627697 -2.1764986), wk = 0.0038462 k( 222) = ( 0.6231996 0.0623843 -2.1096625), wk = 0.0038462 k( 223) = ( 0.6193497 0.0619989 -2.0428265), wk = 0.0038462 k( 224) = ( 0.6154997 0.0616135 -1.9759904), wk = 0.0038462 k( 225) = ( 0.6116497 0.0612281 -1.9091544), wk = 0.0038462 k( 226) = ( 0.6077997 0.0608427 -1.8423184), wk = 0.0038462 k( 227) = ( 0.6039497 0.0604573 -1.7754824), wk = 0.0038462 k( 228) = ( 0.6000997 0.0600719 -1.7086464), wk = 0.0038462 k( 229) = ( 0.5962497 0.0596865 -1.6418103), wk = 0.0038462 k( 230) = ( 0.5923997 0.0593011 -1.5749743), wk = 0.0038462 k( 231) = ( 0.5885497 0.0589157 -1.5081383), wk = 0.0038462 k( 232) = ( 0.5846998 0.0585303 -1.4413023), wk = 0.0038462 k( 233) = ( 0.5808498 0.0581449 -1.3744662), wk = 0.0038462 k( 234) = ( 0.5769998 0.0577595 -1.3076302), wk = 0.0038462 k( 235) = ( 0.5731498 0.0573741 -1.2407941), wk = 0.0038462 k( 236) = ( 0.5692998 0.0569887 -1.1739581), wk = 0.0038462 k( 237) = ( 0.5654498 0.0566034 -1.1071221), wk = 0.0038462 k( 238) = ( 0.5615998 0.0562180 -1.0402861), wk = 0.0038462 k( 239) = ( 0.5577498 0.0558326 -0.9734501), wk = 0.0038462 k( 240) = ( 0.5538998 0.0554472 -0.9066140), wk = 0.0038462 k( 241) = ( 0.5500499 0.0550618 -0.8397780), wk = 0.0038462 k( 242) = ( 0.5461999 0.0546764 -0.7729420), wk = 0.0038462 k( 243) = ( 0.5423499 0.0542910 -0.7061060), wk = 0.0038462 k( 244) = ( 0.5384999 0.0539056 -0.6392699), wk = 0.0038462 k( 245) = ( 0.5346499 0.0535202 -0.5724339), wk = 0.0038462 k( 246) = ( 0.5307999 0.0531348 -0.5055978), wk = 0.0038462 k( 247) = ( 0.5269499 0.0527494 -0.4387618), wk = 0.0038462 k( 248) = ( 0.5230999 0.0523640 -0.3719258), wk = 0.0038462 k( 249) = ( 0.5192499 0.0519786 -0.3050898), wk = 0.0038462 k( 250) = ( 0.5154000 0.0515932 -0.2382538), wk = 0.0038462 k( 251) = ( 0.5115500 0.0512078 -0.1714177), wk = 0.0038462 k( 252) = ( 0.5077000 0.0508224 -0.1045817), wk = 0.0038462 k( 253) = ( 0.5038500 0.0504370 -0.0377457), wk = 0.0038462 k( 254) = ( 0.5000000 0.0500516 0.0290904), wk = 0.0038462 k( 255) = ( 0.5000000 -2.4723961 -1.4369746), wk = 0.0038462 k( 256) = ( 0.5662198 -2.4623858 -1.4311565), wk = 0.0038462 k( 257) = ( 0.6324396 -2.4523755 -1.4253384), wk = 0.0038462 k( 258) = ( 0.6986594 -2.4423652 -1.4195204), wk = 0.0038462 k( 259) = ( 0.7648793 -2.4323548 -1.4137023), wk = 0.0038462 k( 260) = ( 0.8310991 -2.4223445 -1.4078842), wk = 0.0038462 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 2) = ( 0.0116279 0.0000000 0.0000000), wk = 0.0038462 k( 3) = ( 0.0232558 -0.0000000 -0.0000000), wk = 0.0038462 k( 4) = ( 0.0348837 0.0000000 -0.0000000), wk = 0.0038462 k( 5) = ( 0.0465116 0.0000000 -0.0000000), wk = 0.0038462 k( 6) = ( 0.0581395 -0.0000000 -0.0000000), wk = 0.0038462 k( 7) = ( 0.0697674 0.0000000 -0.0000000), wk = 0.0038462 k( 8) = ( 0.0813954 -0.0000000 -0.0000000), wk = 0.0038462 k( 9) = ( 0.0930233 0.0000000 -0.0000000), wk = 0.0038462 k( 10) = ( 0.1046512 -0.0000000 -0.0000000), wk = 0.0038462 k( 11) = ( 0.1162791 0.0000000 -0.0000000), wk = 0.0038462 k( 12) = ( 0.1279070 0.0000000 -0.0000000), wk = 0.0038462 k( 13) = ( 0.1395349 0.0000000 -0.0000000), wk = 0.0038462 k( 14) = ( 0.1511628 0.0000000 0.0000000), wk = 0.0038462 k( 15) = ( 0.1627907 -0.0000000 -0.0000000), wk = 0.0038462 k( 16) = ( 0.1744186 0.0000000 0.0000000), wk = 0.0038462 k( 17) = ( 0.1860465 0.0000000 -0.0000000), wk = 0.0038462 k( 18) = ( 0.1976744 -0.0000000 0.0000000), wk = 0.0038462 k( 19) = ( 0.2093023 -0.0000000 -0.0000000), wk = 0.0038462 k( 20) = ( 0.2209302 -0.0000000 0.0000000), wk = 0.0038462 k( 21) = ( 0.2325581 0.0000000 -0.0000000), wk = 0.0038462 k( 22) = ( 0.2441860 -0.0000000 -0.0000000), wk = 0.0038462 k( 23) = ( 0.2558140 -0.0000000 -0.0000000), wk = 0.0038462 k( 24) = ( 0.2674419 0.0000000 -0.0000000), wk = 0.0038462 k( 25) = ( 0.2790698 0.0000000 0.0000000), wk = 0.0038462 k( 26) = ( 0.2906977 -0.0000000 -0.0000000), wk = 0.0038462 k( 27) = ( 0.3023256 0.0000000 0.0000000), wk = 0.0038462 k( 28) = ( 0.3139535 0.0000000 0.0000000), wk = 0.0038462 k( 29) = ( 0.3255814 -0.0000000 -0.0000000), wk = 0.0038462 k( 30) = ( 0.3372093 0.0000000 -0.0000000), wk = 0.0038462 k( 31) = ( 0.3488372 0.0000000 0.0000000), wk = 0.0038462 k( 32) = ( 0.3604651 -0.0000000 0.0000000), wk = 0.0038462 k( 33) = ( 0.3720930 0.0000000 -0.0000000), wk = 0.0038462 k( 34) = ( 0.3837209 -0.0000000 -0.0000000), wk = 0.0038462 k( 35) = ( 0.3953488 -0.0000000 0.0000000), wk = 0.0038462 k( 36) = ( 0.4069767 0.0000000 -0.0000000), wk = 0.0038462 k( 37) = ( 0.4186047 0.0000000 0.0000000), wk = 0.0038462 k( 38) = ( 0.4302326 -0.0000000 0.0000000), wk = 0.0038462 k( 39) = ( 0.4418605 0.0000000 -0.0000000), wk = 0.0038462 k( 40) = ( 0.4534884 0.0000000 -0.0000000), wk = 0.0038462 k( 41) = ( 0.4651163 0.0000000 -0.0000000), wk = 0.0038462 k( 42) = ( 0.4767442 -0.0000000 -0.0000000), wk = 0.0038462 k( 43) = ( 0.4883721 -0.0000000 -0.0000000), wk = 0.0038462 k( 44) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0038462 k( 45) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0038462 k( 46) = ( 0.5000000 0.0067560 -0.0067560), wk = 0.0038462 k( 47) = ( 0.5000000 0.0135121 -0.0135121), wk = 0.0038462 k( 48) = ( 0.5000000 0.0202681 -0.0202681), wk = 0.0038462 k( 49) = ( 0.5000000 0.0270241 -0.0270242), wk = 0.0038462 k( 50) = ( 0.5000000 0.0337802 -0.0337802), wk = 0.0038462 k( 51) = ( 0.5000000 0.0405362 -0.0405362), wk = 0.0038462 k( 52) = ( 0.5000000 0.0472923 -0.0472923), wk = 0.0038462 k( 53) = ( 0.5000000 0.0540483 -0.0540483), wk = 0.0038462 k( 54) = ( 0.5000000 0.0608043 -0.0608043), wk = 0.0038462 k( 55) = ( 0.5000000 0.0675604 -0.0675604), wk = 0.0038462 k( 56) = ( 0.5000000 0.0743164 -0.0743164), wk = 0.0038462 k( 57) = ( 0.5000000 0.0810724 -0.0810725), wk = 0.0038462 k( 58) = ( 0.5000000 0.0878285 -0.0878285), wk = 0.0038462 k( 59) = ( 0.5000000 0.0945845 -0.0945845), wk = 0.0038462 k( 60) = ( 0.5000000 0.1013406 -0.1013406), wk = 0.0038462 k( 61) = ( 0.5000000 0.1080966 -0.1080966), wk = 0.0038462 k( 62) = ( 0.5000000 0.1148526 -0.1148526), wk = 0.0038462 k( 63) = ( 0.5000000 0.1216087 -0.1216087), wk = 0.0038462 k( 64) = ( 0.5000000 0.1283647 -0.1283647), wk = 0.0038462 k( 65) = ( 0.5000000 0.1351207 -0.1351208), wk = 0.0038462 k( 66) = ( 0.5000000 0.1418768 -0.1418768), wk = 0.0038462 k( 67) = ( 0.5000000 0.1486328 -0.1486328), wk = 0.0038462 k( 68) = ( 0.5000000 0.1553889 -0.1553889), wk = 0.0038462 k( 69) = ( 0.5000000 0.1621449 -0.1621449), wk = 0.0038462 k( 70) = ( 0.5000000 0.1689009 -0.1689009), wk = 0.0038462 k( 71) = ( 0.8310991 0.5000000 0.1689009), wk = 0.0038462 k( 72) = ( 0.8243419 0.5000000 0.1756581), wk = 0.0038462 k( 73) = ( 0.8175848 0.5000000 0.1824152), wk = 0.0038462 k( 74) = ( 0.8108277 0.5000000 0.1891723), wk = 0.0038462 k( 75) = ( 0.8040706 0.5000000 0.1959294), wk = 0.0038462 k( 76) = ( 0.7973134 0.5000000 0.2026866), wk = 0.0038462 k( 77) = ( 0.7905563 0.5000000 0.2094437), wk = 0.0038462 k( 78) = ( 0.7837992 0.5000000 0.2162008), wk = 0.0038462 k( 79) = ( 0.7770421 0.5000000 0.2229579), wk = 0.0038462 k( 80) = ( 0.7702849 0.5000000 0.2297150), wk = 0.0038462 k( 81) = ( 0.7635278 0.5000000 0.2364722), wk = 0.0038462 k( 82) = ( 0.7567707 0.5000000 0.2432293), wk = 0.0038462 k( 83) = ( 0.7500136 0.5000000 0.2499864), wk = 0.0038462 k( 84) = ( 0.7432564 0.5000000 0.2567435), wk = 0.0038462 k( 85) = ( 0.7364993 0.5000000 0.2635007), wk = 0.0038462 k( 86) = ( 0.7297422 0.5000000 0.2702578), wk = 0.0038462 k( 87) = ( 0.7229851 0.5000000 0.2770149), wk = 0.0038462 k( 88) = ( 0.7162280 0.5000000 0.2837720), wk = 0.0038462 k( 89) = ( 0.7094708 0.5000000 0.2905292), wk = 0.0038462 k( 90) = ( 0.7027137 0.5000000 0.2972863), wk = 0.0038462 k( 91) = ( 0.6959566 0.5000000 0.3040434), wk = 0.0038462 k( 92) = ( 0.6891995 0.5000000 0.3108005), wk = 0.0038462 k( 93) = ( 0.6824423 0.5000000 0.3175577), wk = 0.0038462 k( 94) = ( 0.6756852 0.5000000 0.3243148), wk = 0.0038462 k( 95) = ( 0.6689281 0.5000000 0.3310719), wk = 0.0038462 k( 96) = ( 0.6621710 0.5000000 0.3378290), wk = 0.0038462 k( 97) = ( 0.6554138 0.5000000 0.3445862), wk = 0.0038462 k( 98) = ( 0.6486567 0.5000000 0.3513433), wk = 0.0038462 k( 99) = ( 0.6418996 0.5000000 0.3581004), wk = 0.0038462 k( 100) = ( 0.6351425 0.5000000 0.3648575), wk = 0.0038462 k( 101) = ( 0.6283853 0.5000000 0.3716146), wk = 0.0038462 k( 102) = ( 0.6216282 0.5000000 0.3783718), wk = 0.0038462 k( 103) = ( 0.6148711 0.5000000 0.3851289), wk = 0.0038462 k( 104) = ( 0.6081140 0.5000000 0.3918860), wk = 0.0038462 k( 105) = ( 0.6013569 0.5000000 0.3986431), wk = 0.0038462 k( 106) = ( 0.5945997 0.5000000 0.4054003), wk = 0.0038462 k( 107) = ( 0.5878426 0.5000000 0.4121574), wk = 0.0038462 k( 108) = ( 0.5810855 0.5000000 0.4189145), wk = 0.0038462 k( 109) = ( 0.5743284 0.5000000 0.4256716), wk = 0.0038462 k( 110) = ( 0.5675712 0.5000000 0.4324288), wk = 0.0038462 k( 111) = ( 0.5608141 0.5000000 0.4391859), wk = 0.0038462 k( 112) = ( 0.5540570 0.5000000 0.4459430), wk = 0.0038462 k( 113) = ( 0.5472999 0.5000000 0.4527001), wk = 0.0038462 k( 114) = ( 0.5405427 0.5000000 0.4594573), wk = 0.0038462 k( 115) = ( 0.5337856 0.5000000 0.4662144), wk = 0.0038462 k( 116) = ( 0.5270285 0.5000000 0.4729715), wk = 0.0038462 k( 117) = ( 0.5202714 0.5000000 0.4797286), wk = 0.0038462 k( 118) = ( 0.5135142 0.5000000 0.4864857), wk = 0.0038462 k( 119) = ( 0.5067571 0.5000000 0.4932429), wk = 0.0038462 k( 120) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038462 k( 121) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038462 k( 122) = ( 0.4375000 0.4375000 0.4375000), wk = 0.0038462 k( 123) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0038462 k( 124) = ( 0.3125000 0.3125000 0.3125000), wk = 0.0038462 k( 125) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0038462 k( 126) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0038462 k( 127) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0038462 k( 128) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0038462 k( 129) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 130) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 131) = ( 0.0066890 0.0000000 -0.0066890), wk = 0.0038462 k( 132) = ( 0.0133780 0.0000000 -0.0133780), wk = 0.0038462 k( 133) = ( 0.0200670 -0.0000000 -0.0200670), wk = 0.0038462 k( 134) = ( 0.0267560 0.0000000 -0.0267560), wk = 0.0038462 k( 135) = ( 0.0334450 -0.0000000 -0.0334451), wk = 0.0038462 k( 136) = ( 0.0401341 -0.0000000 -0.0401341), wk = 0.0038462 k( 137) = ( 0.0468231 0.0000000 -0.0468231), wk = 0.0038462 k( 138) = ( 0.0535121 0.0000000 -0.0535121), wk = 0.0038462 k( 139) = ( 0.0602011 -0.0000000 -0.0602011), wk = 0.0038462 k( 140) = ( 0.0668901 0.0000000 -0.0668901), wk = 0.0038462 k( 141) = ( 0.0735791 -0.0000000 -0.0735791), wk = 0.0038462 k( 142) = ( 0.0802681 0.0000000 -0.0802681), wk = 0.0038462 k( 143) = ( 0.0869571 -0.0000000 -0.0869571), wk = 0.0038462 k( 144) = ( 0.0936461 -0.0000000 -0.0936461), wk = 0.0038462 k( 145) = ( 0.1003351 -0.0000000 -0.1003351), wk = 0.0038462 k( 146) = ( 0.1070241 -0.0000000 -0.1070242), wk = 0.0038462 k( 147) = ( 0.1137132 -0.0000000 -0.1137132), wk = 0.0038462 k( 148) = ( 0.1204022 0.0000000 -0.1204022), wk = 0.0038462 k( 149) = ( 0.1270912 -0.0000000 -0.1270912), wk = 0.0038462 k( 150) = ( 0.1337802 0.0000000 -0.1337802), wk = 0.0038462 k( 151) = ( 0.1404692 -0.0000000 -0.1404692), wk = 0.0038462 k( 152) = ( 0.1471582 0.0000000 -0.1471582), wk = 0.0038462 k( 153) = ( 0.1538472 0.0000000 -0.1538472), wk = 0.0038462 k( 154) = ( 0.1605362 0.0000000 -0.1605362), wk = 0.0038462 k( 155) = ( 0.1672252 -0.0000000 -0.1672252), wk = 0.0038462 k( 156) = ( 0.1739142 -0.0000000 -0.1739142), wk = 0.0038462 k( 157) = ( 0.1806032 -0.0000000 -0.1806032), wk = 0.0038462 k( 158) = ( 0.1872923 -0.0000000 -0.1872923), wk = 0.0038462 k( 159) = ( 0.1939813 0.0000000 -0.1939813), wk = 0.0038462 k( 160) = ( 0.2006703 -0.0000000 -0.2006703), wk = 0.0038462 k( 161) = ( 0.2073593 -0.0000000 -0.2073593), wk = 0.0038462 k( 162) = ( 0.2140483 -0.0000000 -0.2140483), wk = 0.0038462 k( 163) = ( 0.2207373 -0.0000000 -0.2207373), wk = 0.0038462 k( 164) = ( 0.2274263 -0.0000000 -0.2274263), wk = 0.0038462 k( 165) = ( 0.2341153 0.0000000 -0.2341153), wk = 0.0038462 k( 166) = ( 0.2408043 0.0000000 -0.2408043), wk = 0.0038462 k( 167) = ( 0.2474934 0.0000000 -0.2474934), wk = 0.0038462 k( 168) = ( 0.2541824 -0.0000000 -0.2541824), wk = 0.0038462 k( 169) = ( 0.2608714 0.0000000 -0.2608714), wk = 0.0038462 k( 170) = ( 0.2675604 0.0000000 -0.2675604), wk = 0.0038462 k( 171) = ( 0.2742494 -0.0000000 -0.2742494), wk = 0.0038462 k( 172) = ( 0.2809384 -0.0000000 -0.2809384), wk = 0.0038462 k( 173) = ( 0.2876274 -0.0000000 -0.2876274), wk = 0.0038462 k( 174) = ( 0.2943164 0.0000000 -0.2943164), wk = 0.0038462 k( 175) = ( 0.3010054 -0.0000000 -0.3010054), wk = 0.0038462 k( 176) = ( 0.3076944 -0.0000000 -0.3076944), wk = 0.0038462 k( 177) = ( 0.3143834 -0.0000000 -0.3143834), wk = 0.0038462 k( 178) = ( 0.3210725 0.0000000 -0.3210725), wk = 0.0038462 k( 179) = ( 0.3277615 0.0000000 -0.3277615), wk = 0.0038462 k( 180) = ( 0.3344505 0.0000000 -0.3344505), wk = 0.0038462 k( 181) = ( 0.6655495 0.3344505 -0.0000000), wk = 0.0038462 k( 182) = ( 0.6589276 0.3410724 -0.0000000), wk = 0.0038462 k( 183) = ( 0.6523056 0.3476944 -0.0000000), wk = 0.0038462 k( 184) = ( 0.6456836 0.3543164 -0.0000000), wk = 0.0038462 k( 185) = ( 0.6390616 0.3609384 -0.0000000), wk = 0.0038462 k( 186) = ( 0.6324396 0.3675604 -0.0000000), wk = 0.0038462 k( 187) = ( 0.6258176 0.3741824 0.0000000), wk = 0.0038462 k( 188) = ( 0.6191957 0.3808043 -0.0000000), wk = 0.0038462 k( 189) = ( 0.6125737 0.3874263 -0.0000000), wk = 0.0038462 k( 190) = ( 0.6059517 0.3940483 0.0000000), wk = 0.0038462 k( 191) = ( 0.5993297 0.4006703 -0.0000000), wk = 0.0038462 k( 192) = ( 0.5927077 0.4072923 -0.0000000), wk = 0.0038462 k( 193) = ( 0.5860858 0.4139142 0.0000000), wk = 0.0038462 k( 194) = ( 0.5794638 0.4205362 0.0000000), wk = 0.0038462 k( 195) = ( 0.5728418 0.4271582 0.0000000), wk = 0.0038462 k( 196) = ( 0.5662198 0.4337802 0.0000000), wk = 0.0038462 k( 197) = ( 0.5595978 0.4404022 0.0000000), wk = 0.0038462 k( 198) = ( 0.5529759 0.4470242 0.0000000), wk = 0.0038462 k( 199) = ( 0.5463539 0.4536461 0.0000000), wk = 0.0038462 k( 200) = ( 0.5397319 0.4602681 0.0000000), wk = 0.0038462 k( 201) = ( 0.5331099 0.4668901 -0.0000000), wk = 0.0038462 k( 202) = ( 0.5264879 0.4735121 -0.0000000), wk = 0.0038462 k( 203) = ( 0.5198659 0.4801341 -0.0000000), wk = 0.0038462 k( 204) = ( 0.5132440 0.4867560 -0.0000000), wk = 0.0038462 k( 205) = ( 0.5066220 0.4933780 -0.0000000), wk = 0.0038462 k( 206) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0038462 k( 207) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0038462 k( 208) = ( 0.5551832 0.5551832 0.0563003), wk = 0.0038462 k( 209) = ( 0.6103663 0.6103663 0.1126006), wk = 0.0038462 k( 210) = ( 0.6655495 0.6655495 0.1689009), wk = 0.0038462 k( 211) = ( 0.6655495 0.6655495 0.1689009), wk = 0.0038462 k( 212) = ( 0.6616995 0.6616995 0.1766009), wk = 0.0038462 k( 213) = ( 0.6578496 0.6578496 0.1843009), wk = 0.0038462 k( 214) = ( 0.6539996 0.6539996 0.1920009), wk = 0.0038462 k( 215) = ( 0.6501496 0.6501496 0.1997008), wk = 0.0038462 k( 216) = ( 0.6462996 0.6462996 0.2074008), wk = 0.0038462 k( 217) = ( 0.6424496 0.6424496 0.2151008), wk = 0.0038462 k( 218) = ( 0.6385996 0.6385996 0.2228008), wk = 0.0038462 k( 219) = ( 0.6347496 0.6347496 0.2305008), wk = 0.0038462 k( 220) = ( 0.6308996 0.6308996 0.2382007), wk = 0.0038462 k( 221) = ( 0.6270496 0.6270496 0.2459007), wk = 0.0038462 k( 222) = ( 0.6231996 0.6231996 0.2536007), wk = 0.0038462 k( 223) = ( 0.6193497 0.6193497 0.2613007), wk = 0.0038462 k( 224) = ( 0.6154997 0.6154997 0.2690007), wk = 0.0038462 k( 225) = ( 0.6116497 0.6116497 0.2767006), wk = 0.0038462 k( 226) = ( 0.6077997 0.6077997 0.2844006), wk = 0.0038462 k( 227) = ( 0.6039497 0.6039497 0.2921006), wk = 0.0038462 k( 228) = ( 0.6000997 0.6000997 0.2998006), wk = 0.0038462 k( 229) = ( 0.5962497 0.5962497 0.3075005), wk = 0.0038462 k( 230) = ( 0.5923997 0.5923997 0.3152005), wk = 0.0038462 k( 231) = ( 0.5885497 0.5885497 0.3229005), wk = 0.0038462 k( 232) = ( 0.5846998 0.5846998 0.3306005), wk = 0.0038462 k( 233) = ( 0.5808498 0.5808498 0.3383005), wk = 0.0038462 k( 234) = ( 0.5769998 0.5769998 0.3460004), wk = 0.0038462 k( 235) = ( 0.5731498 0.5731498 0.3537004), wk = 0.0038462 k( 236) = ( 0.5692998 0.5692998 0.3614004), wk = 0.0038462 k( 237) = ( 0.5654498 0.5654498 0.3691004), wk = 0.0038462 k( 238) = ( 0.5615998 0.5615998 0.3768003), wk = 0.0038462 k( 239) = ( 0.5577498 0.5577498 0.3845003), wk = 0.0038462 k( 240) = ( 0.5538998 0.5538998 0.3922003), wk = 0.0038462 k( 241) = ( 0.5500499 0.5500499 0.3999003), wk = 0.0038462 k( 242) = ( 0.5461999 0.5461999 0.4076003), wk = 0.0038462 k( 243) = ( 0.5423499 0.5423499 0.4153002), wk = 0.0038462 k( 244) = ( 0.5384999 0.5384999 0.4230002), wk = 0.0038462 k( 245) = ( 0.5346499 0.5346499 0.4307002), wk = 0.0038462 k( 246) = ( 0.5307999 0.5307999 0.4384002), wk = 0.0038462 k( 247) = ( 0.5269499 0.5269499 0.4461001), wk = 0.0038462 k( 248) = ( 0.5230999 0.5230999 0.4538001), wk = 0.0038462 k( 249) = ( 0.5192499 0.5192499 0.4615001), wk = 0.0038462 k( 250) = ( 0.5154000 0.5154000 0.4692001), wk = 0.0038462 k( 251) = ( 0.5115500 0.5115500 0.4769001), wk = 0.0038462 k( 252) = ( 0.5077000 0.5077000 0.4846000), wk = 0.0038462 k( 253) = ( 0.5038500 0.5038500 0.4923000), wk = 0.0038462 k( 254) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038462 k( 255) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0038462 k( 256) = ( 0.5662198 0.0668901 0.0668901), wk = 0.0038462 k( 257) = ( 0.6324396 0.1337802 0.1337802), wk = 0.0038462 k( 258) = ( 0.6986594 0.2006703 0.2006703), wk = 0.0038462 k( 259) = ( 0.7648793 0.2675604 0.2675604), wk = 0.0038462 k( 260) = ( 0.8310991 0.3344505 0.3344505), wk = 0.0038462 Dense grid: 144103 G-vectors FFT dimensions: ( 216, 216, 216) Smooth grid: 55627 G-vectors FFT dimensions: ( 150, 150, 150) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.31 Mb ( 288, 70) NL pseudopotentials 0.82 Mb ( 144, 374) Each V/rho on FFT grid 3.56 Mb ( 233280) Each G-vector array 0.02 Mb ( 3003) G-vector shells 0.02 Mb ( 2651) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.23 Mb ( 288, 280) Each subspace H/S matrix 1.20 Mb ( 280, 280) Each matrix 0.80 Mb ( 374, 2, 70) The potential is recalculated from file : ./Sb8Te3.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 122.8 secs Computing kpt #: 2 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 202.8 secs Computing kpt #: 3 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 282.9 secs Computing kpt #: 4 total cpu time spent up to now is 343.9 secs Computing kpt #: 5 total cpu time spent up to now is 404.5 secs Computing kpt #: 6 total cpu time spent up to now is 458.0 secs Computing kpt #: 7 total cpu time spent up to now is 510.9 secs Computing kpt #: 8 total cpu time spent up to now is 568.7 secs Computing kpt #: 9 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 649.6 secs Computing kpt #: 10 total cpu time spent up to now is 710.2 secs Computing kpt #: 11 total cpu time spent up to now is 769.1 secs Computing kpt #: 12 total cpu time spent up to now is 827.1 secs Computing kpt #: 13 total cpu time spent up to now is 879.5 secs Computing kpt #: 14 total cpu time spent up to now is 930.9 secs Computing kpt #: 15 total cpu time spent up to now is 982.0 secs Computing kpt #: 16 total cpu time spent up to now is 1035.0 secs Computing kpt #: 17 total cpu time spent up to now is 1092.0 secs Computing kpt #: 18 total cpu time spent up to now is 1147.7 secs Computing kpt #: 19 total cpu time spent up to now is 1202.1 secs Computing kpt #: 20 total cpu time spent up to now is 1255.8 secs Computing kpt #: 21 total cpu time spent up to now is 1308.9 secs Computing kpt #: 22 total cpu time spent up to now is 1357.7 secs Computing kpt #: 23 total cpu time spent up to now is 1406.7 secs Computing kpt #: 24 total cpu time spent up to now is 1455.7 secs Computing kpt #: 25 total cpu time spent up to now is 1504.6 secs Computing kpt #: 26 total cpu time spent up to now is 1558.0 secs Computing kpt #: 27 total cpu time spent up to now is 1607.9 secs Computing kpt #: 28 total cpu time spent up to now is 1662.6 secs Computing kpt #: 29 total cpu time spent up to now is 1716.6 secs Computing kpt #: 30 total cpu time spent up to now is 1770.3 secs Computing kpt #: 31 total cpu time spent up to now is 1821.8 secs Computing kpt #: 32 total cpu time spent up to now is 1872.7 secs Computing kpt #: 33 total cpu time spent up to now is 1923.7 secs Computing kpt #: 34 total cpu time spent up to now is 1975.5 secs Computing kpt #: 35 total cpu time spent up to now is 2033.7 secs Computing kpt #: 36 total cpu time spent up to now is 2103.2 secs Computing kpt #: 37 total cpu time spent up to now is 2172.4 secs Computing kpt #: 38 total cpu time spent up to now is 2231.0 secs Computing kpt #: 39 total cpu time spent up to now is 2288.3 secs Computing kpt #: 40 total cpu time spent up to now is 2345.6 secs Computing kpt #: 41 total cpu time spent up to now is 2413.4 secs Computing kpt #: 42 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2484.9 secs Computing kpt #: 43 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2554.7 secs Computing kpt #: 44 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2625.5 secs Computing kpt #: 45 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2694.3 secs Computing kpt #: 46 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2763.9 secs Computing kpt #: 47 total cpu time spent up to now is 2833.1 secs Computing kpt #: 48 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2903.8 secs Computing kpt #: 49 total cpu time spent up to now is 2968.7 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3041.0 secs Computing kpt #: 51 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3113.0 secs Computing kpt #: 52 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3185.7 secs Computing kpt #: 53 total cpu time spent up to now is 3256.2 secs Computing kpt #: 54 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3326.0 secs Computing kpt #: 55 total cpu time spent up to now is 3394.9 secs Computing kpt #: 56 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3464.2 secs Computing kpt #: 57 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3533.4 secs Computing kpt #: 58 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3602.8 secs Computing kpt #: 59 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3672.8 secs Computing kpt #: 60 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3742.8 secs Computing kpt #: 61 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3815.6 secs Computing kpt #: 62 total cpu time spent up to now is 3867.3 secs Computing kpt #: 63 total cpu time spent up to now is 3918.4 secs Computing kpt #: 64 total cpu time spent up to now is 3975.8 secs Computing kpt #: 65 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 4047.8 secs Computing kpt #: 66 total cpu time spent up to now is 4103.5 secs Computing kpt #: 67 total cpu time spent up to now is 4153.4 secs Computing kpt #: 68 total cpu time spent up to now is 4203.3 secs Computing kpt #: 69 total cpu time spent up to now is 4252.6 secs Computing kpt #: 70 total cpu time spent up to now is 4307.4 secs Computing kpt #: 71 total cpu time spent up to now is 4356.7 secs Computing kpt #: 72 total cpu time spent up to now is 4411.1 secs Computing kpt #: 73 total cpu time spent up to now is 4464.9 secs Computing kpt #: 74 total cpu time spent up to now is 4518.6 secs Computing kpt #: 75 total cpu time spent up to now is 4575.3 secs Computing kpt #: 76 total cpu time spent up to now is 4630.5 secs Computing kpt #: 77 total cpu time spent up to now is 4680.6 secs Computing kpt #: 78 total cpu time spent up to now is 4735.9 secs Computing kpt #: 79 total cpu time spent up to now is 4786.5 secs Computing kpt #: 80 total cpu time spent up to now is 4837.6 secs Computing kpt #: 81 total cpu time spent up to now is 4895.0 secs Computing kpt #: 82 total cpu time spent up to now is 4957.9 secs Computing kpt #: 83 total cpu time spent up to now is 5027.2 secs Computing kpt #: 84 total cpu time spent up to now is 5097.5 secs Computing kpt #: 85 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 5168.6 secs Computing kpt #: 86 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5239.8 secs Computing kpt #: 87 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5313.1 secs Computing kpt #: 88 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5385.2 secs Computing kpt #: 89 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5457.7 secs Computing kpt #: 90 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5530.4 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5603.5 secs Computing kpt #: 92 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5677.5 secs Computing kpt #: 93 total cpu time spent up to now is 5731.6 secs Computing kpt #: 94 total cpu time spent up to now is 5785.3 secs Computing kpt #: 95 total cpu time spent up to now is 5839.6 secs Computing kpt #: 96 total cpu time spent up to now is 5894.2 secs Computing kpt #: 97 total cpu time spent up to now is 5949.2 secs Computing kpt #: 98 total cpu time spent up to now is 6005.0 secs Computing kpt #: 99 total cpu time spent up to now is 6054.8 secs Computing kpt #: 100 total cpu time spent up to now is 6104.0 secs Computing kpt #: 101 total cpu time spent up to now is 6157.1 secs Computing kpt #: 102 total cpu time spent up to now is 6210.2 secs Computing kpt #: 103 total cpu time spent up to now is 6259.6 secs Computing kpt #: 104 total cpu time spent up to now is 6309.1 secs Computing kpt #: 105 total cpu time spent up to now is 6359.2 secs Computing kpt #: 106 total cpu time spent up to now is 6409.8 secs Computing kpt #: 107 total cpu time spent up to now is 6461.3 secs Computing kpt #: 108 total cpu time spent up to now is 6523.4 secs Computing kpt #: 109 total cpu time spent up to now is 6592.5 secs Computing kpt #: 110 total cpu time spent up to now is 6662.7 secs Computing kpt #: 111 total cpu time spent up to now is 6730.0 secs Computing kpt #: 112 total cpu time spent up to now is 6796.8 secs Computing kpt #: 113 total cpu time spent up to now is 6859.2 secs Computing kpt #: 114 total cpu time spent up to now is 6924.6 secs Computing kpt #: 115 total cpu time spent up to now is 6990.3 secs Computing kpt #: 116 total cpu time spent up to now is 7058.4 secs Computing kpt #: 117 total cpu time spent up to now is 7140.5 secs Computing kpt #: 118 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 7222.5 secs Computing kpt #: 119 total cpu time spent up to now is 7298.5 secs Computing kpt #: 120 total cpu time spent up to now is 7356.6 secs Computing kpt #: 121 total cpu time spent up to now is 7415.2 secs Computing kpt #: 122 total cpu time spent up to now is 7475.1 secs Computing kpt #: 123 total cpu time spent up to now is 7536.3 secs Computing kpt #: 124 total cpu time spent up to now is 7596.3 secs Computing kpt #: 125 total cpu time spent up to now is 7661.9 secs Computing kpt #: 126 total cpu time spent up to now is 7732.7 secs Computing kpt #: 127 total cpu time spent up to now is 7803.4 secs Computing kpt #: 128 total cpu time spent up to now is 7876.3 secs Computing kpt #: 129 total cpu time spent up to now is 7953.3 secs Computing kpt #: 130 total cpu time spent up to now is 8019.1 secs Computing kpt #: 131 total cpu time spent up to now is 8099.9 secs Computing kpt #: 132 total cpu time spent up to now is 8177.7 secs Computing kpt #: 133 total cpu time spent up to now is 8237.0 secs Computing kpt #: 134 total cpu time spent up to now is 8292.5 secs Computing kpt #: 135 total cpu time spent up to now is 8345.0 secs Computing kpt #: 136 total cpu time spent up to now is 8397.2 secs Computing kpt #: 137 total cpu time spent up to now is 8449.4 secs Computing kpt #: 138 total cpu time spent up to now is 8501.5 secs Computing kpt #: 139 total cpu time spent up to now is 8567.6 secs Computing kpt #: 140 total cpu time spent up to now is 8642.1 secs Computing kpt #: 141 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 8720.5 secs Computing kpt #: 142 total cpu time spent up to now is 8783.1 secs Computing kpt #: 143 total cpu time spent up to now is 8834.4 secs Computing kpt #: 144 total cpu time spent up to now is 8885.4 secs Computing kpt #: 145 total cpu time spent up to now is 8935.4 secs Computing kpt #: 146 total cpu time spent up to now is 8984.9 secs Computing kpt #: 147 total cpu time spent up to now is 9036.3 secs Computing kpt #: 148 total cpu time spent up to now is 9085.4 secs Computing kpt #: 149 total cpu time spent up to now is 9133.7 secs Computing kpt #: 150 total cpu time spent up to now is 9186.4 secs Computing kpt #: 151 total cpu time spent up to now is 9239.1 secs Computing kpt #: 152 total cpu time spent up to now is 9291.6 secs Computing kpt #: 153 total cpu time spent up to now is 9344.3 secs Computing kpt #: 154 total cpu time spent up to now is 9397.0 secs Computing kpt #: 155 total cpu time spent up to now is 9450.3 secs Computing kpt #: 156 total cpu time spent up to now is 9501.4 secs Computing kpt #: 157 total cpu time spent up to now is 9552.2 secs Computing kpt #: 158 total cpu time spent up to now is 9602.6 secs Computing kpt #: 159 total cpu time spent up to now is 9647.8 secs Computing kpt #: 160 total cpu time spent up to now is 9692.1 secs Computing kpt #: 161 total cpu time spent up to now is 9736.0 secs Computing kpt #: 162 total cpu time spent up to now is 9779.6 secs Computing kpt #: 163 total cpu time spent up to now is 9825.0 secs Computing kpt #: 164 total cpu time spent up to now is 9868.5 secs Computing kpt #: 165 total cpu time spent up to now is 9911.5 secs Computing kpt #: 166 total cpu time spent up to now is 9954.4 secs Computing kpt #: 167 total cpu time spent up to now is 9997.1 secs Computing kpt #: 168 total cpu time spent up to now is 10039.8 secs Computing kpt #: 169 total cpu time spent up to now is 10082.3 secs Computing kpt #: 170 total cpu time spent up to now is 10124.8 secs Computing kpt #: 171 total cpu time spent up to now is 10167.3 secs Computing kpt #: 172 total cpu time spent up to now is 10210.1 secs Computing kpt #: 173 total cpu time spent up to now is 10253.3 secs Computing kpt #: 174 total cpu time spent up to now is 10297.0 secs Computing kpt #: 175 total cpu time spent up to now is 10341.2 secs Computing kpt #: 176 total cpu time spent up to now is 10391.5 secs Computing kpt #: 177 total cpu time spent up to now is 10459.5 secs Computing kpt #: 178 total cpu time spent up to now is 10509.1 secs Computing kpt #: 179 total cpu time spent up to now is 10552.6 secs Computing kpt #: 180 total cpu time spent up to now is 10597.2 secs Computing kpt #: 181 total cpu time spent up to now is 10640.4 secs Computing kpt #: 182 total cpu time spent up to now is 10682.9 secs Computing kpt #: 183 total cpu time spent up to now is 10725.2 secs Computing kpt #: 184 total cpu time spent up to now is 10767.4 secs Computing kpt #: 185 total cpu time spent up to now is 10809.6 secs Computing kpt #: 186 total cpu time spent up to now is 10852.0 secs Computing kpt #: 187 total cpu time spent up to now is 10894.0 secs Computing kpt #: 188 total cpu time spent up to now is 10936.3 secs Computing kpt #: 189 total cpu time spent up to now is 10978.7 secs Computing kpt #: 190 total cpu time spent up to now is 11021.6 secs Computing kpt #: 191 total cpu time spent up to now is 11065.4 secs Computing kpt #: 192 total cpu time spent up to now is 11115.5 secs Computing kpt #: 193 total cpu time spent up to now is 11167.3 secs Computing kpt #: 194 total cpu time spent up to now is 11218.4 secs Computing kpt #: 195 total cpu time spent up to now is 11281.0 secs Computing kpt #: 196 total cpu time spent up to now is 11345.6 secs Computing kpt #: 197 total cpu time spent up to now is 11396.0 secs Computing kpt #: 198 total cpu time spent up to now is 11445.6 secs Computing kpt #: 199 total cpu time spent up to now is 11490.0 secs Computing kpt #: 200 total cpu time spent up to now is 11534.5 secs Computing kpt #: 201 total cpu time spent up to now is 11578.9 secs Computing kpt #: 202 total cpu time spent up to now is 11624.4 secs Computing kpt #: 203 total cpu time spent up to now is 11670.6 secs Computing kpt #: 204 total cpu time spent up to now is 11721.8 secs Computing kpt #: 205 total cpu time spent up to now is 11774.2 secs Computing kpt #: 206 total cpu time spent up to now is 11826.9 secs Computing kpt #: 207 total cpu time spent up to now is 11889.7 secs Computing kpt #: 208 total cpu time spent up to now is 11953.5 secs Computing kpt #: 209 total cpu time spent up to now is 12006.5 secs Computing kpt #: 210 total cpu time spent up to now is 12060.7 secs Computing kpt #: 211 total cpu time spent up to now is 12112.9 secs Computing kpt #: 212 total cpu time spent up to now is 12165.1 secs Computing kpt #: 213 total cpu time spent up to now is 12217.2 secs Computing kpt #: 214 total cpu time spent up to now is 12269.1 secs Computing kpt #: 215 total cpu time spent up to now is 12321.4 secs Computing kpt #: 216 total cpu time spent up to now is 12373.4 secs Computing kpt #: 217 total cpu time spent up to now is 12425.0 secs Computing kpt #: 218 total cpu time spent up to now is 12477.4 secs Computing kpt #: 219 total cpu time spent up to now is 12536.4 secs Computing kpt #: 220 total cpu time spent up to now is 12600.0 secs Computing kpt #: 221 total cpu time spent up to now is 12663.5 secs Computing kpt #: 222 total cpu time spent up to now is 12721.9 secs Computing kpt #: 223 total cpu time spent up to now is 12786.7 secs Computing kpt #: 224 total cpu time spent up to now is 12844.6 secs Computing kpt #: 225 total cpu time spent up to now is 12902.4 secs Computing kpt #: 226 total cpu time spent up to now is 12960.6 secs Computing kpt #: 227 total cpu time spent up to now is 13024.1 secs Computing kpt #: 228 total cpu time spent up to now is 13087.0 secs Computing kpt #: 229 total cpu time spent up to now is 13145.7 secs Computing kpt #: 230 total cpu time spent up to now is 13200.0 secs Computing kpt #: 231 total cpu time spent up to now is 13254.2 secs Computing kpt #: 232 total cpu time spent up to now is 13307.3 secs Computing kpt #: 233 total cpu time spent up to now is 13356.7 secs Computing kpt #: 234 total cpu time spent up to now is 13406.4 secs Computing kpt #: 235 total cpu time spent up to now is 13474.7 secs Computing kpt #: 236 total cpu time spent up to now is 13532.3 secs Computing kpt #: 237 total cpu time spent up to now is 13582.7 secs Computing kpt #: 238 total cpu time spent up to now is 13633.3 secs Computing kpt #: 239 total cpu time spent up to now is 13684.0 secs Computing kpt #: 240 total cpu time spent up to now is 13735.1 secs Computing kpt #: 241 total cpu time spent up to now is 13792.2 secs Computing kpt #: 242 total cpu time spent up to now is 13861.5 secs Computing kpt #: 243 total cpu time spent up to now is 13919.8 secs Computing kpt #: 244 total cpu time spent up to now is 13986.4 secs Computing kpt #: 245 total cpu time spent up to now is 14054.3 secs Computing kpt #: 246 total cpu time spent up to now is 14111.7 secs Computing kpt #: 247 total cpu time spent up to now is 14170.7 secs Computing kpt #: 248 total cpu time spent up to now is 14229.2 secs Computing kpt #: 249 total cpu time spent up to now is 14293.2 secs Computing kpt #: 250 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 14371.8 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 14453.6 secs Computing kpt #: 252 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 14534.5 secs Computing kpt #: 253 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 14614.5 secs Computing kpt #: 254 total cpu time spent up to now is 14673.6 secs Computing kpt #: 255 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 14742.2 secs Computing kpt #: 256 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 14814.2 secs Computing kpt #: 257 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 14884.4 secs Computing kpt #: 258 total cpu time spent up to now is 14948.3 secs Computing kpt #: 259 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 15019.9 secs Computing kpt #: 260 total cpu time spent up to now is 15072.0 secs ethr = 1.72E-11, avg # of iterations = 64.1 total cpu time spent up to now is 15072.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6973 PWs) bands (ev): -6.6302 -6.6302 -6.4463 -6.4463 -5.5797 -5.5797 -5.0713 -5.0713 -4.9677 -4.9677 -4.3764 -4.3764 -2.3197 -2.3197 -1.1415 -1.1415 -1.1158 -1.1158 0.4057 0.4057 1.3053 1.3053 3.7613 3.7613 3.9769 3.9769 4.3900 4.3900 4.5614 4.5614 4.6891 4.6891 4.7108 4.7108 4.9478 4.9478 5.1109 5.1109 5.2993 5.2993 5.3405 5.3405 5.5787 5.5787 5.5907 5.5907 5.6274 5.6274 5.8785 5.8785 5.8843 5.8843 5.9072 5.9072 6.4608 6.4608 6.4917 6.4917 6.9721 6.9721 7.1522 7.1522 7.3258 7.3258 7.6362 7.6362 7.7781 7.7781 7.8434 7.8434 k = 0.0116-0.0575-0.0334 ( 6981 PWs) bands (ev): -6.6290 -6.6290 -6.4451 -6.4451 -5.5784 -5.5784 -5.0701 -5.0701 -4.9666 -4.9666 -4.3754 -4.3754 -2.3191 -2.3191 -1.1430 -1.1430 -1.1146 -1.1146 0.4032 0.4032 1.3025 1.3025 3.7571 3.7571 3.9678 3.9678 4.3859 4.3859 4.5448 4.5448 4.6906 4.6906 4.6987 4.6987 4.9545 4.9545 5.1057 5.1057 5.2857 5.2857 5.3249 5.3249 5.5417 5.5417 5.6032 5.6032 5.6431 5.6431 5.8606 5.8606 5.8824 5.8824 5.9300 5.9300 6.4891 6.4891 6.5075 6.5075 6.9742 6.9742 7.1317 7.1317 7.3303 7.3303 7.6225 7.6225 7.7680 7.7680 7.8659 7.8659 k = 0.0233-0.1150-0.0668 ( 6982 PWs) bands (ev): -6.6254 -6.6254 -6.4416 -6.4416 -5.5744 -5.5744 -5.0665 -5.0665 -4.9633 -4.9633 -4.3724 -4.3724 -2.3175 -2.3175 -1.1468 -1.1468 -1.1114 -1.1114 0.3957 0.3957 1.2943 1.2943 3.7444 3.7444 3.9412 3.9412 4.3729 4.3729 4.5010 4.5010 4.6471 4.6471 4.7141 4.7141 4.9594 4.9594 5.0970 5.0970 5.2424 5.2424 5.2861 5.2861 5.5064 5.5064 5.5641 5.5641 5.7122 5.7122 5.8035 5.8035 5.8569 5.8569 6.0153 6.0153 6.5247 6.5247 6.5740 6.5740 6.9824 6.9824 7.0920 7.0920 7.3329 7.3329 7.6012 7.6012 7.7351 7.7351 7.8906 7.8906 k = 0.0349-0.1725-0.1003 ( 6976 PWs) bands (ev): -6.6192 -6.6192 -6.4357 -6.4357 -5.5676 -5.5676 -5.0604 -5.0604 -4.9577 -4.9577 -4.3673 -4.3673 -2.3147 -2.3147 -1.1523 -1.1523 -1.1074 -1.1074 0.3831 0.3831 1.2805 1.2805 3.7235 3.7235 3.8996 3.8996 4.3485 4.3485 4.4364 4.4364 4.5947 4.5947 4.7290 4.7290 4.9336 4.9336 5.0936 5.0936 5.1744 5.1744 5.2436 5.2436 5.4651 5.4651 5.5427 5.5427 5.7146 5.7146 5.7965 5.7965 5.8350 5.8350 6.1213 6.1213 6.5405 6.5405 6.6541 6.6541 7.0031 7.0031 7.0786 7.0786 7.3139 7.3139 7.6067 7.6067 7.6820 7.6820 7.8582 7.8582 k = 0.0465-0.2300-0.1337 ( 6973 PWs) bands (ev): -6.6107 -6.6107 -6.4274 -6.4274 -5.5582 -5.5582 -5.0520 -5.0520 -4.9500 -4.9500 -4.3603 -4.3603 -2.3110 -2.3110 -1.1588 -1.1588 -1.1028 -1.1028 0.3656 0.3656 1.2611 1.2611 3.6944 3.6944 3.8461 3.8461 4.3058 4.3058 4.3615 4.3615 4.5438 4.5438 4.7340 4.7340 4.8723 4.8723 5.0399 5.0399 5.1404 5.1404 5.2142 5.2142 5.4217 5.4217 5.5314 5.5314 5.6454 5.6454 5.7876 5.7876 5.8908 5.8908 6.2326 6.2326 6.5234 6.5234 6.7048 6.7048 7.0585 7.0585 7.1130 7.1130 7.2756 7.2756 7.6060 7.6060 7.6562 7.6562 7.8046 7.8046 k = 0.0581-0.2875-0.1671 ( 6966 PWs) bands (ev): -6.5997 -6.5997 -6.4168 -6.4168 -5.5461 -5.5461 -5.0412 -5.0412 -4.9400 -4.9400 -4.3512 -4.3512 -2.3062 -2.3062 -1.1664 -1.1664 -1.0981 -1.0981 0.3431 0.3431 1.2360 1.2360 3.6567 3.6567 3.7837 3.7837 4.2297 4.2297 4.2991 4.2991 4.4950 4.4950 4.7089 4.7089 4.7994 4.7994 4.9444 4.9444 5.1084 5.1084 5.2223 5.2223 5.3836 5.3836 5.5038 5.5038 5.6082 5.6082 5.7564 5.7564 5.9581 5.9581 6.3358 6.3358 6.4816 6.4816 6.7259 6.7259 7.1389 7.1389 7.1686 7.1686 7.2593 7.2593 7.5378 7.5378 7.7065 7.7065 7.7652 7.7652 k = 0.0698-0.3450-0.2005 ( 6961 PWs) bands (ev): -6.5863 -6.5863 -6.4039 -6.4039 -5.5313 -5.5313 -5.0281 -5.0281 -4.9278 -4.9278 -4.3402 -4.3402 -2.3006 -2.3006 -1.1751 -1.1751 -1.0934 -1.0934 0.3158 0.3158 1.2052 1.2052 3.6079 3.6079 3.7168 3.7168 4.1327 4.1327 4.2447 4.2447 4.4453 4.4453 4.6244 4.6244 4.7432 4.7432 4.8522 4.8522 5.0638 5.0638 5.2272 5.2272 5.3620 5.3620 5.4664 5.4664 5.6094 5.6094 5.7202 5.7202 5.9959 5.9959 6.3891 6.3891 6.4766 6.4766 6.7300 6.7300 7.1460 7.1460 7.2422 7.2422 7.3115 7.3115 7.5127 7.5127 7.6792 7.6792 7.8277 7.8277 k = 0.0814-0.4025-0.2339 ( 6972 PWs) bands (ev): -6.5705 -6.5705 -6.3887 -6.3887 -5.5138 -5.5138 -5.0128 -5.0128 -4.9134 -4.9134 -4.3272 -4.3272 -2.2941 -2.2941 -1.1851 -1.1851 -1.0888 -1.0888 0.2836 0.2836 1.1687 1.1687 3.5437 3.5437 3.6509 3.6509 4.0313 4.0313 4.1874 4.1874 4.3906 4.3906 4.5136 4.5136 4.6698 4.6698 4.7748 4.7748 5.0255 5.0255 5.1884 5.1884 5.3667 5.3667 5.4546 5.4546 5.6229 5.6229 5.6810 5.6810 5.9808 5.9808 6.3948 6.3948 6.5197 6.5197 6.7194 6.7194 7.1381 7.1381 7.2684 7.2684 7.3875 7.3875 7.5772 7.5772 7.6493 7.6493 7.9265 7.9265 k = 0.0930-0.4600-0.2673 ( 6972 PWs) bands (ev): -6.5523 -6.5523 -6.3712 -6.3712 -5.4936 -5.4936 -4.9952 -4.9952 -4.8968 -4.8968 -4.3122 -4.3122 -2.2869 -2.2869 -1.1964 -1.1964 -1.0845 -1.0845 0.2468 0.2468 1.1263 1.1263 3.4619 3.4619 3.5891 3.5891 3.9305 3.9305 4.1251 4.1251 4.3215 4.3215 4.4106 4.4106 4.5731 4.5731 4.6998 4.6998 4.9963 4.9963 5.1279 5.1279 5.3673 5.3673 5.4793 5.4793 5.6202 5.6202 5.6594 5.6594 5.9161 5.9161 6.4179 6.4179 6.5272 6.5272 6.6927 6.6927 7.1500 7.1500 7.2790 7.2790 7.4850 7.4850 7.5768 7.5768 7.7433 7.7433 8.0260 8.0260 k = 0.1047-0.5175-0.3008 ( 6962 PWs) bands (ev): -6.5317 -6.5317 -6.3514 -6.3514 -5.4708 -5.4708 -4.9755 -4.9755 -4.8780 -4.8780 -4.2953 -4.2953 -2.2791 -2.2791 -1.2094 -1.2094 -1.0806 -1.0806 0.2054 0.2054 1.0782 1.0782 3.3658 3.3658 3.5281 3.5281 3.8323 3.8323 4.0571 4.0571 4.2304 4.2304 4.3318 4.3318 4.4689 4.4689 4.6160 4.6160 4.9639 4.9639 5.0749 5.0749 5.3574 5.3574 5.5175 5.5175 5.5840 5.5840 5.6720 5.6720 5.8304 5.8304 6.4240 6.4240 6.5004 6.5004 6.6586 6.6586 7.1782 7.1782 7.3325 7.3325 7.5312 7.5312 7.6059 7.6059 7.8733 7.8733 7.9837 7.9837 k = 0.1163-0.5750-0.3342 ( 6962 PWs) bands (ev): -6.5088 -6.5088 -6.3293 -6.3293 -5.4454 -5.4454 -4.9537 -4.9537 -4.8568 -4.8568 -4.2765 -4.2765 -2.2709 -2.2709 -1.2244 -1.2244 -1.0773 -1.0773 0.1596 0.1596 1.0243 1.0243 3.2604 3.2604 3.4622 3.4622 3.7380 3.7380 3.9830 3.9830 4.1329 4.1329 4.2636 4.2636 4.3679 4.3679 4.5257 4.5257 4.9137 4.9137 5.0446 5.0446 5.3404 5.3404 5.5211 5.5211 5.5737 5.5737 5.6640 5.6640 5.7706 5.7706 6.3690 6.3690 6.4446 6.4446 6.6642 6.6642 7.2120 7.2120 7.4105 7.4105 7.5282 7.5282 7.7010 7.7010 7.9112 7.9112 8.0346 8.0346 k = 0.1279-0.6325-0.3676 ( 6962 PWs) bands (ev): -6.4835 -6.4835 -6.3050 -6.3050 -5.4173 -5.4173 -4.9300 -4.9300 -4.8334 -4.8334 -4.2557 -4.2557 -2.2624 -2.2624 -1.2414 -1.2414 -1.0747 -1.0747 0.1097 0.1097 0.9650 0.9650 3.1495 3.1495 3.3859 3.3859 3.6501 3.6501 3.9037 3.9037 4.0394 4.0394 4.1901 4.1901 4.2804 4.2804 4.4334 4.4334 4.8505 4.8505 5.0297 5.0297 5.3136 5.3136 5.4872 5.4872 5.5537 5.5537 5.6332 5.6332 5.7836 5.7836 6.2699 6.2699 6.3604 6.3604 6.7112 6.7112 7.2381 7.2381 7.4521 7.4521 7.5904 7.5904 7.7682 7.7682 7.9166 7.9166 8.1370 8.1370 k = 0.1395-0.6900-0.4010 ( 6962 PWs) bands (ev): -6.4559 -6.4559 -6.2785 -6.2785 -5.3866 -5.3866 -4.9044 -4.9044 -4.8077 -4.8077 -4.2331 -4.2331 -2.2538 -2.2538 -1.2610 -1.2610 -1.0732 -1.0732 0.0559 0.0559 0.9004 0.9004 3.0355 3.0355 3.2960 3.2960 3.5706 3.5706 3.8218 3.8218 3.9475 3.9475 4.1113 4.1113 4.2101 4.2101 4.3428 4.3428 4.7837 4.7837 5.0180 5.0180 5.2739 5.2739 5.4345 5.4345 5.4902 5.4902 5.6433 5.6433 5.8244 5.8244 6.1454 6.1454 6.2717 6.2717 6.7702 6.7702 7.2437 7.2437 7.4728 7.4728 7.6805 7.6805 7.7921 7.7921 7.9882 7.9882 8.1527 8.1527 k = 0.1512-0.7475-0.4344 ( 6956 PWs) bands (ev): -6.4260 -6.4260 -6.2499 -6.2499 -5.3533 -5.3533 -4.8772 -4.8772 -4.7796 -4.7796 -4.2087 -4.2087 -2.2455 -2.2455 -1.2832 -1.2832 -1.0729 -1.0729 -0.0014 -0.0014 0.8307 0.8307 2.9201 2.9201 3.1937 3.1937 3.4975 3.4975 3.7392 3.7392 3.8532 3.8532 4.0383 4.0383 4.1492 4.1492 4.2577 4.2577 4.7169 4.7169 5.0035 5.0035 5.2202 5.2202 5.3465 5.3465 5.4651 5.4651 5.6520 5.6520 5.8692 5.8692 6.0112 6.0112 6.1840 6.1840 6.8301 6.8301 7.2268 7.2268 7.4991 7.4991 7.7186 7.7186 7.8416 7.8416 8.0765 8.0765 8.1504 8.1504 k = 0.1628-0.8050-0.4679 ( 6955 PWs) bands (ev): -6.3939 -6.3939 -6.2191 -6.2191 -5.3174 -5.3174 -4.8486 -4.8486 -4.7491 -4.7491 -4.1824 -4.1824 -2.2376 -2.2376 -1.3083 -1.3083 -1.0742 -1.0742 -0.0618 -0.0618 0.7563 0.7563 2.8041 2.8041 3.0836 3.0836 3.4250 3.4250 3.6569 3.6569 3.7590 3.7590 3.9757 3.9757 4.0905 4.0905 4.1819 4.1819 4.6515 4.6515 4.9826 4.9826 5.1490 5.1490 5.2644 5.2644 5.4538 5.4538 5.6523 5.6523 5.8498 5.8498 5.9365 5.9365 6.0988 6.0988 6.8867 6.8867 7.1947 7.1947 7.5197 7.5197 7.7403 7.7403 7.8615 7.8615 8.1430 8.1430 8.2354 8.2354 k = 0.1744-0.8625-0.5013 ( 6952 PWs) bands (ev): -6.3595 -6.3595 -6.1863 -6.1863 -5.2790 -5.2790 -4.8186 -4.8186 -4.7161 -4.7161 -4.1544 -4.1544 -2.2304 -2.2304 -1.3367 -1.3367 -1.0775 -1.0775 -0.1249 -0.1249 0.6777 0.6777 2.6882 2.6882 2.9712 2.9712 3.3455 3.3455 3.5763 3.5763 3.6714 3.6714 3.9201 3.9201 4.0306 4.0306 4.1200 4.1200 4.5878 4.5878 4.9526 4.9526 5.0595 5.0595 5.2031 5.2031 5.4461 5.4461 5.6349 5.6349 5.7275 5.7275 5.9609 5.9609 6.0255 6.0255 6.9379 6.9379 7.1539 7.1539 7.5276 7.5276 7.7721 7.7721 7.8345 7.8345 8.2282 8.2282 8.3607 8.3607 k = 0.1860-0.9200-0.5347 ( 6943 PWs) bands (ev): -6.3230 -6.3230 -6.1514 -6.1514 -5.2380 -5.2380 -4.7874 -4.7874 -4.6806 -4.6806 -4.1246 -4.1246 -2.2244 -2.2244 -1.3683 -1.3683 -1.0832 -1.0832 -0.1903 -0.1903 0.5951 0.5951 2.5726 2.5726 2.8607 2.8607 3.2536 3.2536 3.4985 3.4985 3.5958 3.5958 3.8659 3.8659 3.9705 3.9705 4.0738 4.0738 4.5258 4.5258 4.9094 4.9094 4.9633 4.9633 5.1581 5.1581 5.4358 5.4358 5.5492 5.5492 5.6654 5.6654 5.9154 5.9154 6.0246 6.0246 6.9807 6.9807 7.1101 7.1101 7.5282 7.5282 7.7489 7.7489 7.8595 7.8595 8.3098 8.3098 8.4958 8.4958 k = 0.1977-0.9775-0.5681 ( 6939 PWs) bands (ev): -6.2843 -6.2843 -6.1146 -6.1146 -5.1945 -5.1945 -4.7554 -4.7554 -4.6426 -4.6426 -4.0932 -4.0932 -2.2198 -2.2198 -1.4034 -1.4034 -1.0919 -1.0919 -0.2573 -0.2573 0.5092 0.5092 2.4573 2.4573 2.7550 2.7550 3.1499 3.1499 3.4228 3.4228 3.5339 3.5339 3.8088 3.8088 3.9136 3.9136 4.0421 4.0421 4.4657 4.4657 4.8362 4.8362 4.8858 4.8858 5.1222 5.1222 5.3836 5.3836 5.4617 5.4617 5.6430 5.6430 5.8393 5.8393 6.0487 6.0487 7.0021 7.0021 7.0779 7.0779 7.5277 7.5277 7.6932 7.6932 7.9250 7.9250 8.3625 8.3625 8.5544 8.5544 k = 0.2093-1.0350-0.6015 ( 6940 PWs) bands (ev): -6.2435 -6.2435 -6.0759 -6.0759 -5.1486 -5.1486 -4.7225 -4.7225 -4.6021 -4.6021 -4.0602 -4.0602 -2.2171 -2.2171 -1.4419 -1.4419 -1.1040 -1.1040 -0.3255 -0.3255 0.4203 0.4203 2.3428 2.3428 2.6555 2.6555 3.0389 3.0389 3.3472 3.3472 3.4847 3.4847 3.7483 3.7483 3.8612 3.8612 4.0225 4.0225 4.4073 4.4073 4.7369 4.7369 4.8281 4.8281 5.0892 5.0892 5.2618 5.2618 5.4425 5.4425 5.6196 5.6196 5.7658 5.7658 6.0636 6.0636 6.9741 6.9741 7.0875 7.0875 7.5281 7.5281 7.6429 7.6429 7.9970 7.9970 8.3749 8.3749 8.5930 8.5930 k = 0.2209-1.0925-0.6349 ( 6941 PWs) bands (ev): -6.2007 -6.2007 -6.0353 -6.0353 -5.1002 -5.1002 -4.6891 -4.6891 -4.5592 -4.5592 -4.0255 -4.0255 -2.2168 -2.2168 -1.4838 -1.4838 -1.1202 -1.1202 -0.3943 -0.3943 0.3290 0.3290 2.2297 2.2297 2.5625 2.5625 2.9263 2.9263 3.2713 3.2713 3.4449 3.4449 3.6859 3.6859 3.8124 3.8124 4.0129 4.0129 4.3505 4.3505 4.6339 4.6339 4.7716 4.7716 5.0457 5.0457 5.1468 5.1468 5.4304 5.4304 5.5881 5.5881 5.7017 5.7017 6.0647 6.0647 6.9228 6.9228 7.1139 7.1139 7.5280 7.5280 7.6073 7.6073 8.0688 8.0688 8.3626 8.3626 8.6351 8.6351 k = 0.2326-1.1500-0.6684 ( 6931 PWs) bands (ev): -6.1559 -6.1559 -5.9931 -5.9931 -5.0495 -5.0495 -4.6552 -4.6552 -4.5139 -4.5139 -3.9894 -3.9894 -2.2195 -2.2195 -1.5289 -1.5289 -1.1411 -1.1411 -0.4631 -0.4631 0.2359 0.2359 2.1189 2.1189 2.4749 2.4749 2.8170 2.8170 3.1957 3.1957 3.4114 3.4114 3.6236 3.6236 3.7660 3.7660 4.0107 4.0107 4.2953 4.2953 4.5319 4.5319 4.7138 4.7138 4.9585 4.9585 5.0811 5.0811 5.4140 5.4140 5.5446 5.5446 5.6525 5.6525 6.0509 6.0509 6.8667 6.8667 7.1404 7.1404 7.5258 7.5258 7.5913 7.5913 8.1347 8.1347 8.3451 8.3451 8.6592 8.6592 k = 0.2442-1.2074-0.7018 ( 6931 PWs) bands (ev): -6.1092 -6.1092 -5.9491 -5.9491 -4.9965 -4.9965 -4.6210 -4.6210 -4.4662 -4.4662 -3.9519 -3.9519 -2.2256 -2.2256 -1.5768 -1.5768 -1.1674 -1.1674 -0.5314 -0.5314 0.1415 0.1415 2.0115 2.0115 2.3905 2.3905 2.7155 2.7155 3.1213 3.1213 3.3820 3.3820 3.5625 3.5625 3.7216 3.7216 4.0129 4.0129 4.2415 4.2415 4.4329 4.4329 4.6549 4.6549 4.8456 4.8456 5.0490 5.0490 5.3882 5.3882 5.4943 5.4943 5.6168 5.6168 6.0226 6.0226 6.8092 6.8092 7.1648 7.1648 7.5256 7.5256 7.5911 7.5911 8.1822 8.1822 8.3406 8.3406 8.6578 8.6578 k = 0.2558-1.2649-0.7352 ( 6930 PWs) bands (ev): -6.0607 -6.0607 -5.9036 -5.9036 -4.9412 -4.9412 -4.5867 -4.5867 -4.4165 -4.4165 -3.9130 -3.9130 -2.2358 -2.2358 -1.6270 -1.6270 -1.1996 -1.1996 -0.5988 -0.5988 0.0465 0.0465 1.9086 1.9086 2.3062 2.3062 2.6261 2.6261 3.0488 3.0488 3.3550 3.3550 3.5032 3.5032 3.6787 3.6787 4.0150 4.0150 4.1890 4.1890 4.3403 4.3403 4.5939 4.5939 4.7358 4.7358 5.0245 5.0245 5.3475 5.3475 5.4478 5.4478 5.5881 5.5881 5.9828 5.9828 6.7512 6.7512 7.1868 7.1868 7.5345 7.5345 7.5989 7.5989 8.1936 8.1936 8.3685 8.3685 8.6380 8.6380 k = 0.2674-1.3224-0.7686 ( 6932 PWs) bands (ev): -6.0105 -6.0105 -5.8567 -5.8567 -4.8839 -4.8839 -4.5523 -4.5523 -4.3647 -4.3647 -3.8728 -3.8728 -2.2506 -2.2506 -1.6792 -1.6792 -1.2380 -1.2380 -0.6652 -0.6652 -0.0485 -0.0485 1.8110 1.8110 2.2195 2.2195 2.5521 2.5521 2.9791 2.9791 3.3292 3.3292 3.4458 3.4458 3.6370 3.6370 4.0089 4.0089 4.1367 4.1367 4.2620 4.2620 4.5290 4.5290 4.6384 4.6384 5.0019 5.0019 5.2928 5.2928 5.4069 5.4069 5.5618 5.5618 5.9357 5.9357 6.6935 6.6935 7.2067 7.2067 7.5544 7.5544 7.6103 7.6103 8.1775 8.1775 8.4209 8.4209 8.6089 8.6089 k = 0.2791-1.3799-0.8020 ( 6935 PWs) bands (ev): -5.9587 -5.9587 -5.8085 -5.8085 -4.8246 -4.8246 -4.5181 -4.5181 -4.3110 -4.3110 -3.8316 -3.8316 -2.2707 -2.2707 -1.7325 -1.7325 -1.2829 -1.2829 -0.7307 -0.7307 -0.1428 -0.1428 1.7197 1.7197 2.1296 2.1296 2.4949 2.4949 2.9127 2.9127 3.3036 3.3036 3.3906 3.3906 3.5959 3.5959 3.9823 3.9823 4.0814 4.0814 4.2121 4.2121 4.4588 4.4588 4.5584 4.5584 4.9798 4.9798 5.2311 5.2311 5.3650 5.3650 5.5358 5.5358 5.8870 5.8870 6.6362 6.6362 7.2246 7.2246 7.5837 7.5837 7.6240 7.6240 8.1519 8.1519 8.4776 8.4776 8.5778 8.5778 k = 0.2907-1.4374-0.8355 ( 6931 PWs) bands (ev): -5.9054 -5.9054 -5.7592 -5.7592 -4.7636 -4.7636 -4.4840 -4.4840 -4.2557 -4.2557 -3.7893 -3.7893 -2.2964 -2.2964 -1.7864 -1.7864 -1.3339 -1.3339 -0.7957 -0.7957 -0.2356 -0.2356 1.6353 1.6353 2.0377 2.0377 2.4532 2.4532 2.8503 2.8503 3.2769 3.2769 3.3377 3.3377 3.5539 3.5539 3.9307 3.9307 4.0225 4.0225 4.1942 4.1942 4.3890 4.3890 4.4943 4.4943 4.9574 4.9574 5.1677 5.1677 5.3156 5.3156 5.5091 5.5091 5.8422 5.8422 6.5799 6.5799 7.2407 7.2407 7.6152 7.6152 7.6434 7.6434 8.1251 8.1251 8.5085 8.5085 8.5693 8.5693 k = 0.3023-1.4949-0.8689 ( 6931 PWs) bands (ev): -5.8508 -5.8508 -5.7089 -5.7089 -4.7011 -4.7011 -4.4502 -4.4502 -4.1990 -4.1990 -3.7462 -3.7462 -2.3281 -2.3281 -1.8404 -1.8404 -1.3905 -1.3905 -0.8609 -0.8609 -0.3263 -0.3263 1.5583 1.5583 1.9459 1.9459 2.4250 2.4250 2.7927 2.7927 3.2468 3.2468 3.2883 3.2883 3.5092 3.5092 3.8658 3.8658 3.9629 3.9629 4.1886 4.1886 4.3328 4.3328 4.4406 4.4406 4.9338 4.9338 5.1054 5.1054 5.2553 5.2553 5.4819 5.4819 5.8055 5.8055 6.5248 6.5248 7.2551 7.2551 7.6358 7.6358 7.6778 7.6778 8.1013 8.1013 8.4822 8.4822 8.6109 8.6109 k = 0.3140-1.5524-0.9023 ( 6931 PWs) bands (ev): -5.7949 -5.7949 -5.6578 -5.6578 -4.6378 -4.6378 -4.4164 -4.4164 -4.1411 -4.1411 -3.7023 -3.7023 -2.3656 -2.3656 -1.8940 -1.8940 -1.4518 -1.4518 -0.9272 -0.9272 -0.4141 -0.4141 1.4891 1.4891 1.8566 1.8566 2.4075 2.4075 2.7407 2.7407 3.2084 3.2084 3.2462 3.2462 3.4599 3.4599 3.8020 3.8020 3.9029 3.9029 4.1698 4.1698 4.3067 4.3067 4.3945 4.3945 4.9077 4.9077 5.0465 5.0465 5.1835 5.1835 5.4555 5.4555 5.7786 5.7786 6.4711 6.4711 7.2681 7.2681 7.6485 7.6485 7.7187 7.7187 8.0844 8.0844 8.4403 8.4403 8.5503 8.5503 k = 0.3256-1.6099-0.9357 ( 6931 PWs) bands (ev): -5.7381 -5.7381 -5.6062 -5.6062 -4.5745 -4.5745 -4.3821 -4.3821 -4.0824 -4.0824 -3.6580 -3.6580 -2.4088 -2.4088 -1.9471 -1.9471 -1.5166 -1.5166 -0.9954 -0.9954 -0.4987 -0.4987 1.4278 1.4278 1.7714 1.7714 2.3983 2.3983 2.6952 2.6952 3.1592 3.1592 3.2122 3.2122 3.4051 3.4051 3.7475 3.7475 3.8420 3.8420 4.1330 4.1330 4.3057 4.3057 4.3601 4.3601 4.8760 4.8760 4.9934 4.9934 5.1025 5.1025 5.4309 5.4309 5.7609 5.7609 6.4191 6.4191 7.2798 7.2798 7.6582 7.6582 7.7546 7.7546 8.0795 8.0795 8.3802 8.3802 8.4560 8.4560 k = 0.3372-1.6674-0.9691 ( 6932 PWs) bands (ev): -5.6805 -5.6805 -5.5544 -5.5544 -4.5129 -4.5129 -4.3461 -4.3461 -4.0233 -4.0233 -3.6134 -3.6134 -2.4568 -2.4568 -1.9998 -1.9998 -1.5836 -1.5836 -1.0660 -1.0660 -0.5797 -0.5797 1.3740 1.3740 1.6923 1.6923 2.3944 2.3944 2.6577 2.6577 3.1026 3.1026 3.1812 3.1812 3.3473 3.3473 3.7044 3.7044 3.7814 3.7814 4.0920 4.0920 4.2908 4.2908 4.3583 4.3583 4.8347 4.8347 4.9478 4.9478 5.0181 5.0181 5.4089 5.4089 5.7509 5.7509 6.3688 6.3688 7.2903 7.2903 7.6657 7.6657 7.7774 7.7774 8.0900 8.0900 8.2880 8.2880 8.4000 8.4000 k = 0.3488-1.7249-1.0025 ( 6937 PWs) bands (ev): -5.6224 -5.6224 -5.5026 -5.5026 -4.4558 -4.4558 -4.3060 -4.3060 -3.9642 -3.9642 -3.5688 -3.5688 -2.5086 -2.5086 -2.0526 -2.0526 -1.6513 -1.6513 -1.1391 -1.1391 -0.6570 -0.6570 1.3271 1.3271 1.6206 1.6206 2.3925 2.3925 2.6300 2.6300 3.0398 3.0398 3.1506 3.1506 3.2908 3.2908 3.6696 3.6696 3.7241 3.7241 4.0539 4.0539 4.2599 4.2599 4.3805 4.3805 4.7805 4.7805 4.9002 4.9002 4.9471 4.9471 5.3898 5.3898 5.7469 5.7469 6.3204 6.3204 7.2996 7.2996 7.6702 7.6702 7.7841 7.7841 8.1035 8.1035 8.1998 8.1998 8.3635 8.3635 k = 0.3605-1.7824-1.0360 ( 6941 PWs) bands (ev): -5.5640 -5.5640 -5.4512 -5.4512 -4.4071 -4.4071 -4.2584 -4.2584 -3.9055 -3.9055 -3.5246 -3.5246 -2.5629 -2.5629 -2.1061 -2.1061 -1.7184 -1.7184 -1.2145 -1.2145 -0.7308 -0.7308 1.2861 1.2861 1.5582 1.5582 2.3889 2.3889 2.6136 2.6136 2.9720 2.9720 3.1198 3.1198 3.2400 3.2400 3.6320 3.6320 3.6797 3.6797 4.0204 4.0204 4.2285 4.2285 4.4054 4.4054 4.7121 4.7121 4.8348 4.8348 4.9109 4.9109 5.3738 5.3738 5.7476 5.7476 6.2741 6.2741 7.3077 7.3077 7.6700 7.6700 7.7777 7.7777 8.0495 8.0495 8.1913 8.1913 8.3408 8.3408 k = 0.3721-1.8399-1.0694 ( 6953 PWs) bands (ev): -5.5058 -5.5058 -5.4006 -5.4006 -4.3692 -4.3692 -4.2014 -4.2014 -3.8479 -3.8479 -3.4813 -3.4813 -2.6182 -2.6182 -2.1610 -2.1610 -1.7833 -1.7833 -1.2913 -1.2913 -0.8013 -0.8013 1.2491 1.2491 1.5071 1.5071 2.3802 2.3802 2.6083 2.6083 2.9030 2.9030 3.0890 3.0890 3.1966 3.1966 3.5826 3.5826 3.6556 3.6556 3.9915 3.9915 4.1996 4.1996 4.4241 4.4241 4.6318 4.6318 4.7743 4.7743 4.8906 4.8906 5.3611 5.3611 5.7521 5.7521 6.2299 6.2299 7.3144 7.3144 7.6614 7.6614 7.7637 7.7637 7.9632 7.9632 8.2111 8.2111 8.3473 8.3473 k = 0.3837-1.8974-1.1028 ( 6954 PWs) bands (ev): -5.4482 -5.4482 -5.3511 -5.3511 -4.3413 -4.3413 -4.1362 -4.1362 -3.7919 -3.7919 -3.4395 -3.4395 -2.6727 -2.6727 -2.2179 -2.2179 -1.8447 -1.8447 -1.3683 -1.3683 -0.8689 -0.8689 1.2143 1.2143 1.4689 1.4689 2.3650 2.3650 2.6086 2.6086 2.8409 2.8409 3.0590 3.0590 3.1603 3.1603 3.5299 3.5299 3.6424 3.6424 3.9668 3.9668 4.1738 4.1738 4.4225 4.4225 4.5545 4.5545 4.7276 4.7276 4.8764 4.8764 5.3518 5.3518 5.7598 5.7598 6.1880 6.1880 7.3190 7.3190 7.6379 7.6379 7.7463 7.7463 7.8902 7.8902 8.2048 8.2048 8.3944 8.3944 k = 0.3953-1.9549-1.1362 ( 6950 PWs) bands (ev): -5.3917 -5.3917 -5.3035 -5.3035 -4.3214 -4.3214 -4.0655 -4.0655 -3.7382 -3.7382 -3.4005 -3.4005 -2.7246 -2.7246 -2.2770 -2.2770 -1.9020 -1.9020 -1.4438 -1.4438 -0.9337 -0.9337 1.1804 1.1804 1.4451 1.4451 2.3427 2.3427 2.6016 2.6016 2.8003 2.8003 3.0308 3.0308 3.1298 3.1298 3.4791 3.4791 3.6339 3.6339 3.9455 3.9455 4.1511 4.1511 4.3744 4.3744 4.5080 4.5080 4.6960 4.6960 4.8664 4.8664 5.3462 5.3462 5.7703 5.7703 6.1486 6.1486 7.3200 7.3200 7.5951 7.5951 7.7267 7.7267 7.8431 7.8431 8.1836 8.1836 8.4606 8.4606 k = 0.4070-2.0124-1.1696 ( 6940 PWs) bands (ev): -5.3369 -5.3369 -5.2581 -5.2581 -4.3075 -4.3075 -3.9915 -3.9915 -3.6872 -3.6872 -3.3660 -3.3660 -2.7717 -2.7717 -2.3375 -2.3375 -1.9553 -1.9553 -1.5158 -1.5158 -0.9957 -0.9957 1.1469 1.1469 1.4356 1.4356 2.3121 2.3121 2.5762 2.5762 2.7938 2.7938 3.0058 3.0058 3.1040 3.1040 3.4322 3.4322 3.6280 3.6280 3.9268 3.9268 4.1300 4.1300 4.2917 4.2917 4.4825 4.4825 4.6798 4.6798 4.8600 4.8600 5.3440 5.3440 5.7830 5.7830 6.1117 6.1117 7.3144 7.3144 7.5400 7.5400 7.7052 7.7052 7.8208 7.8208 8.1587 8.1587 8.5163 8.5163 k = 0.4186-2.0699-1.2030 ( 6940 PWs) bands (ev): -5.2845 -5.2845 -5.2156 -5.2156 -4.2987 -4.2987 -3.9159 -3.9159 -3.6394 -3.6394 -3.3384 -3.3384 -2.8121 -2.8121 -2.3976 -2.3976 -2.0058 -2.0058 -1.5817 -1.5817 -1.0547 -1.0547 1.1146 1.1146 1.4391 1.4391 2.2709 2.2709 2.5414 2.5414 2.8127 2.8127 2.9868 2.9868 3.0824 3.0824 3.3899 3.3899 3.6234 3.6234 3.9094 3.9094 4.1041 4.1041 4.2095 4.2095 4.4549 4.4549 4.6754 4.6754 4.8567 4.8567 5.3453 5.3453 5.7977 5.7977 6.0777 6.0777 7.2962 7.2962 7.4891 7.4891 7.6834 7.6834 7.8138 7.8138 8.1337 8.1337 8.5331 8.5331 k = 0.4302-2.1274-1.2365 ( 6944 PWs) bands (ev): -5.2354 -5.2354 -5.1768 -5.1768 -4.2939 -4.2939 -3.8399 -3.8399 -3.5950 -3.5950 -3.3207 -3.3207 -2.8442 -2.8442 -2.4541 -2.4541 -2.0555 -2.0555 -1.6392 -1.6392 -1.1101 -1.1101 1.0845 1.0845 1.4538 1.4538 2.2185 2.2185 2.5111 2.5111 2.8373 2.8373 2.9798 2.9798 3.0654 3.0654 3.3528 3.3528 3.6195 3.6195 3.8906 3.8906 4.0543 4.0543 4.1586 4.1586 4.4228 4.4228 4.6770 4.6770 4.8563 4.8563 5.3494 5.3494 5.8139 5.8139 6.0467 6.0467 7.2599 7.2599 7.4560 7.4560 7.6627 7.6627 7.8142 7.8142 8.1099 8.1099 8.5330 8.5330 k = 0.4419-2.1849-1.2699 ( 6943 PWs) bands (ev): -5.1907 -5.1907 -5.1423 -5.1423 -4.2925 -4.2925 -3.7648 -3.7648 -3.5539 -3.5539 -3.3152 -3.3152 -2.8690 -2.8690 -2.5018 -2.5018 -2.1064 -2.1064 -1.6857 -1.6857 -1.1609 -1.1609 1.0577 1.0577 1.4777 1.4777 2.1574 2.1574 2.4902 2.4902 2.8503 2.8503 2.9918 2.9918 3.0558 3.0558 3.3214 3.3214 3.6158 3.6158 3.8628 3.8628 3.9878 3.9878 4.1423 4.1423 4.3890 4.3890 4.6800 4.6800 4.8578 4.8578 5.3557 5.3557 5.8308 5.8308 6.0190 6.0190 7.2102 7.2102 7.4411 7.4411 7.6437 7.6437 7.8181 7.8181 8.0880 8.0880 8.5315 8.5315 k = 0.4535-2.2424-1.3033 ( 6946 PWs) bands (ev): -5.1513 -5.1513 -5.1129 -5.1129 -4.2936 -4.2936 -3.6923 -3.6923 -3.5161 -3.5161 -3.3223 -3.3223 -2.8906 -2.8906 -2.5342 -2.5342 -2.1597 -2.1597 -1.7204 -1.7204 -1.2060 -1.2060 1.0350 1.0350 1.5088 1.5088 2.0921 2.0921 2.4777 2.4777 2.8480 2.8480 3.0084 3.0084 3.0681 3.0681 3.2958 3.2958 3.6115 3.6115 3.8128 3.8128 3.9404 3.9404 4.1402 4.1402 4.3558 4.3558 4.6827 4.6827 4.8605 4.8605 5.3633 5.3633 5.8478 5.8478 5.9949 5.9949 7.1579 7.1579 7.4368 7.4368 7.6269 7.6269 7.8235 7.8235 8.0687 8.0687 8.5321 8.5321 k = 0.4651-2.2999-1.3367 ( 6944 PWs) bands (ev): -5.1187 -5.1187 -5.0893 -5.0893 -4.2960 -4.2960 -3.6242 -3.6242 -3.4820 -3.4820 -3.3403 -3.3403 -2.9141 -2.9141 -2.5461 -2.5461 -2.2143 -2.2143 -1.7437 -1.7437 -1.2438 -1.2438 1.0169 1.0169 1.5445 1.5445 2.0279 2.0279 2.4710 2.4710 2.8388 2.8388 3.0088 3.0088 3.1115 3.1115 3.2765 3.2765 3.6051 3.6051 3.7455 3.7455 3.9178 3.9178 4.1447 4.1447 4.3251 4.3251 4.6845 4.6845 4.8635 4.8635 5.3709 5.3709 5.8637 5.8637 5.9748 5.9748 7.1110 7.1110 7.4371 7.4371 7.6128 7.6128 7.8293 7.8293 8.0526 8.0526 8.5356 8.5356 k = 0.4767-2.3574-1.3701 ( 6942 PWs) bands (ev): -5.0940 -5.0940 -5.0721 -5.0721 -4.2989 -4.2989 -3.5630 -3.5630 -3.4529 -3.4529 -3.3659 -3.3659 -2.9398 -2.9398 -2.5385 -2.5385 -2.2669 -2.2669 -1.7577 -1.7577 -1.2727 -1.2727 1.0038 1.0038 1.5809 1.5809 1.9703 1.9703 2.4680 2.4680 2.8294 2.8294 3.0046 3.0046 3.1633 3.1633 3.2642 3.2642 3.5917 3.5917 3.6849 3.6849 3.9071 3.9071 4.1526 4.1526 4.2988 4.2988 4.6855 4.6855 4.8660 4.8660 5.3774 5.3774 5.8774 5.8774 5.9590 5.9590 7.0744 7.0744 7.4391 7.4391 7.6020 7.6020 7.8343 7.8343 8.0403 8.0403 8.5423 8.5423 k = 0.4884-2.4149-1.4036 ( 6942 PWs) bands (ev): -5.0785 -5.0785 -5.0617 -5.0617 -4.3010 -4.3010 -3.5128 -3.5128 -3.4322 -3.4322 -3.3948 -3.3948 -2.9612 -2.9612 -2.5209 -2.5209 -2.3095 -2.3095 -1.7648 -1.7648 -1.2909 -1.2909 0.9958 0.9958 1.6107 1.6107 1.9273 1.9273 2.4668 2.4668 2.8227 2.8227 3.0013 3.0013 3.2040 3.2040 3.2612 3.2612 3.5663 3.5663 3.6520 3.6520 3.9019 3.9019 4.1606 4.1606 4.2799 4.2799 4.6860 4.6860 4.8677 4.8677 5.3818 5.3818 5.8873 5.8873 5.9483 5.9483 7.0513 7.0513 7.4410 7.4410 7.5952 7.5952 7.8378 7.8378 8.0325 8.0325 8.5516 8.5516 k = 0.5000-2.4724-1.4370 ( 6948 PWs) bands (ev): -5.0732 -5.0732 -5.0583 -5.0583 -4.3018 -4.3018 -3.4880 -3.4880 -3.4250 -3.4250 -3.4120 -3.4120 -2.9696 -2.9696 -2.5110 -2.5110 -2.3274 -2.3274 -1.7669 -1.7669 -1.2971 -1.2971 0.9932 0.9932 1.6230 1.6230 1.9107 1.9107 2.4665 2.4665 2.8204 2.8204 3.0001 3.0001 3.2175 3.2175 3.2643 3.2643 3.5508 3.5508 3.6440 3.6440 3.9003 3.9003 4.1642 4.1642 4.2727 4.2727 4.6861 4.6861 4.8683 4.8683 5.3833 5.3833 5.8910 5.8910 5.9443 5.9443 7.0434 7.0434 7.4417 7.4417 7.5928 7.5928 7.8390 7.8390 8.0298 8.0298 8.5583 8.5583 k = 0.5000-2.4724-1.4370 ( 6948 PWs) bands (ev): -5.0732 -5.0732 -5.0583 -5.0583 -4.3018 -4.3018 -3.4880 -3.4880 -3.4250 -3.4250 -3.4120 -3.4120 -2.9696 -2.9696 -2.5110 -2.5110 -2.3274 -2.3274 -1.7669 -1.7669 -1.2971 -1.2971 0.9932 0.9932 1.6230 1.6230 1.9107 1.9107 2.4665 2.4665 2.8204 2.8204 3.0001 3.0001 3.2175 3.2175 3.2643 3.2643 3.5508 3.5508 3.6440 3.6440 3.9003 3.9003 4.1642 4.1642 4.2727 4.2727 4.6861 4.6861 4.8683 4.8683 5.3833 5.3833 5.8910 5.8910 5.9443 5.9443 7.0434 7.0434 7.4417 7.4417 7.5928 7.5928 7.8390 7.8390 8.0298 8.0298 8.5583 8.5583 k = 0.5000-2.4383-1.4956 ( 6938 PWs) bands (ev): -5.0723 -5.0723 -5.0575 -5.0575 -4.3010 -4.3010 -3.4867 -3.4867 -3.4236 -3.4236 -3.4106 -3.4106 -2.9694 -2.9694 -2.5118 -2.5118 -2.3276 -2.3276 -1.7685 -1.7685 -1.2994 -1.2994 0.9939 0.9939 1.6233 1.6233 1.9113 1.9113 2.4629 2.4629 2.8037 2.8037 3.0143 3.0143 3.2163 3.2163 3.2626 3.2626 3.5485 3.5485 3.6329 3.6329 3.8545 3.8545 4.2069 4.2069 4.3020 4.3020 4.6471 4.6471 4.8773 4.8773 5.3661 5.3661 5.9119 5.9119 5.9653 5.9653 7.0431 7.0431 7.4035 7.4035 7.5322 7.5322 7.9116 7.9116 8.0674 8.0674 8.5626 8.5626 k = 0.5000-2.4042-1.5543 ( 6940 PWs) bands (ev): -5.0698 -5.0698 -5.0550 -5.0550 -4.2986 -4.2986 -3.4826 -3.4826 -3.4196 -3.4196 -3.4065 -3.4065 -2.9688 -2.9688 -2.5144 -2.5144 -2.3280 -2.3280 -1.7732 -1.7732 -1.3065 -1.3065 0.9962 0.9962 1.6242 1.6242 1.9132 1.9132 2.4525 2.4525 2.7646 2.7646 3.0433 3.0433 3.2084 3.2084 3.2608 3.2608 3.5415 3.5415 3.6090 3.6090 3.7638 3.7638 4.2952 4.2952 4.3739 4.3739 4.5570 4.5570 4.8800 4.8800 5.3304 5.3304 5.9602 5.9602 6.0230 6.0230 7.0416 7.0416 7.3161 7.3161 7.4290 7.4290 8.0496 8.0496 8.1559 8.1559 8.5764 8.5764 k = 0.5000-2.3701-1.6129 ( 6934 PWs) bands (ev): -5.0656 -5.0656 -5.0509 -5.0509 -4.2946 -4.2946 -3.4759 -3.4759 -3.4128 -3.4128 -3.3996 -3.3996 -2.9678 -2.9678 -2.5188 -2.5188 -2.3288 -2.3288 -1.7811 -1.7811 -1.3183 -1.3183 1.0000 1.0000 1.6258 1.6258 1.9162 1.9162 2.4362 2.4362 2.7168 2.7168 3.0632 3.0632 3.1876 3.1876 3.2684 3.2684 3.5336 3.5336 3.5752 3.5752 3.6805 3.6805 4.3988 4.3988 4.4204 4.4204 4.4801 4.4801 4.8616 4.8616 5.3008 5.3008 6.0176 6.0176 6.0961 6.0961 7.0363 7.0363 7.2217 7.2217 7.3351 7.3351 8.2025 8.2025 8.2579 8.2579 8.6028 8.6028 k = 0.5000-2.3361-1.6715 ( 6940 PWs) bands (ev): -5.0598 -5.0598 -5.0453 -5.0453 -4.2891 -4.2891 -3.4664 -3.4664 -3.4034 -3.4034 -3.3900 -3.3900 -2.9665 -2.9665 -2.5251 -2.5251 -2.3299 -2.3299 -1.7921 -1.7921 -1.3349 -1.3349 1.0053 1.0053 1.6279 1.6279 1.9203 1.9203 2.4154 2.4154 2.6660 2.6660 3.0448 3.0448 3.1693 3.1693 3.2889 3.2889 3.5009 3.5009 3.5403 3.5403 3.6461 3.6461 4.3023 4.3023 4.4954 4.4954 4.5418 4.5418 4.8484 4.8484 5.2864 5.2864 6.0680 6.0680 6.1575 6.1575 7.0234 7.0234 7.1510 7.1510 7.2719 7.2719 8.3331 8.3331 8.3668 8.3668 8.6480 8.6480 k = 0.5000-2.3020-1.7302 ( 6940 PWs) bands (ev): -5.0524 -5.0524 -5.0380 -5.0380 -4.2820 -4.2820 -3.4543 -3.4543 -3.3914 -3.3914 -3.3776 -3.3776 -2.9648 -2.9648 -2.5332 -2.5332 -2.3315 -2.3315 -1.8062 -1.8062 -1.3563 -1.3563 1.0121 1.0121 1.6306 1.6306 1.9253 1.9253 2.3915 2.3915 2.6144 2.6144 2.9833 2.9833 3.1556 3.1556 3.3170 3.3170 3.4264 3.4264 3.5518 3.5518 3.6441 3.6441 4.1670 4.1670 4.4918 4.4918 4.6484 4.6484 4.8872 4.8872 5.2841 5.2841 6.0921 6.0921 6.1834 6.1834 7.0081 7.0081 7.1252 7.1252 7.2527 7.2527 8.3775 8.3775 8.5108 8.5108 8.7176 8.7176 k = 0.5000-2.2679-1.7888 ( 6942 PWs) bands (ev): -5.0434 -5.0434 -5.0293 -5.0293 -4.2733 -4.2733 -3.4396 -3.4396 -3.3768 -3.3768 -3.3624 -3.3624 -2.9629 -2.9629 -2.5434 -2.5434 -2.3335 -2.3335 -1.8232 -1.8232 -1.3825 -1.3825 1.0204 1.0204 1.6338 1.6338 1.9310 1.9310 2.3656 2.3656 2.5624 2.5624 2.9031 2.9031 3.1191 3.1191 3.3273 3.3273 3.4000 3.4000 3.5724 3.5724 3.6520 3.6520 4.0305 4.0305 4.4173 4.4173 4.7697 4.7697 4.9734 4.9734 5.2892 5.2892 6.0755 6.0755 6.1596 6.1596 7.0078 7.0078 7.1516 7.1516 7.2779 7.2779 8.3712 8.3712 8.5962 8.5962 8.7422 8.7422 k = 0.5000-2.2338-1.8475 ( 6936 PWs) bands (ev): -5.0330 -5.0330 -5.0191 -5.0191 -4.2633 -4.2633 -3.4222 -3.4222 -3.3596 -3.3596 -3.3444 -3.3444 -2.9608 -2.9608 -2.5556 -2.5556 -2.3360 -2.3360 -1.8431 -1.8431 -1.4136 -1.4136 1.0301 1.0301 1.6375 1.6375 1.9373 1.9373 2.3381 2.3381 2.5100 2.5100 2.8188 2.8188 3.0514 3.0514 3.3174 3.3174 3.4297 3.4297 3.5961 3.5961 3.6582 3.6582 3.9037 3.9037 4.3192 4.3192 4.8906 4.8906 5.0766 5.0766 5.2998 5.2998 6.0189 6.0189 6.0892 6.0892 7.0252 7.0252 7.2254 7.2254 7.3433 7.3433 8.3268 8.3268 8.5392 8.5392 8.8301 8.8301 k = 0.5000-2.1997-1.9061 ( 6944 PWs) bands (ev): -5.0212 -5.0212 -5.0076 -5.0076 -4.2518 -4.2518 -3.4022 -3.4022 -3.3399 -3.3399 -3.3236 -3.3236 -2.9586 -2.9586 -2.5702 -2.5702 -2.3391 -2.3391 -1.8657 -1.8657 -1.4496 -1.4496 1.0413 1.0413 1.6417 1.6417 1.9439 1.9439 2.3080 2.3080 2.4575 2.4575 2.7375 2.7375 2.9690 2.9690 3.3173 3.3173 3.4655 3.4655 3.6158 3.6158 3.6361 3.6361 3.8190 3.8190 4.2187 4.2187 5.0046 5.0046 5.1792 5.1792 5.3189 5.3189 5.9354 5.9354 5.9867 5.9867 7.0491 7.0491 7.3357 7.3357 7.4431 7.4431 8.2564 8.2564 8.4344 8.4344 8.9326 8.9326 k = 0.5000-2.1656-1.9648 ( 6956 PWs) bands (ev): -5.0081 -5.0081 -4.9948 -4.9948 -4.2389 -4.2389 -3.3797 -3.3797 -3.3178 -3.3178 -3.3000 -3.3000 -2.9563 -2.9563 -2.5870 -2.5870 -2.3430 -2.3430 -1.8911 -1.8911 -1.4904 -1.4904 1.0540 1.0540 1.6464 1.6464 1.9508 1.9508 2.2722 2.2722 2.4060 2.4060 2.6630 2.6630 2.8873 2.8873 3.3232 3.3232 3.4812 3.4812 3.5458 3.5458 3.6481 3.6481 3.8090 3.8090 4.1292 4.1292 5.0996 5.0996 5.2660 5.2660 5.3601 5.3601 5.8393 5.8393 5.8690 5.8690 7.0727 7.0727 7.4704 7.4704 7.5672 7.5672 8.1710 8.1710 8.3186 8.3186 9.0335 9.0335 k = 0.5000-2.1316-2.0234 ( 6960 PWs) bands (ev): -4.9938 -4.9938 -4.9808 -4.9808 -4.2249 -4.2249 -3.3547 -3.3547 -3.2933 -3.2933 -3.2736 -3.2736 -2.9541 -2.9541 -2.6062 -2.6062 -2.3476 -2.3476 -1.9190 -1.9190 -1.5361 -1.5361 1.0680 1.0680 1.6518 1.6518 1.9580 1.9580 2.2266 2.2266 2.3581 2.3581 2.5978 2.5978 2.8153 2.8153 3.3276 3.3276 3.3946 3.3946 3.5191 3.5191 3.6738 3.6738 3.8340 3.8340 4.0644 4.0644 5.1517 5.1517 5.3359 5.3359 5.4307 5.4307 5.7277 5.7277 5.7695 5.7695 7.0948 7.0948 7.6181 7.6181 7.7031 7.7031 8.0824 8.0824 8.2017 8.2017 9.1324 9.1324 k = 0.5000-2.0975-2.0820 ( 6956 PWs) bands (ev): -4.9785 -4.9785 -4.9658 -4.9658 -4.2096 -4.2096 -3.3273 -3.3273 -3.2664 -3.2664 -3.2443 -3.2443 -2.9519 -2.9519 -2.6277 -2.6277 -2.3531 -2.3531 -1.9494 -1.9494 -1.5864 -1.5864 1.0834 1.0834 1.6578 1.6578 1.9655 1.9655 2.1695 2.1695 2.3128 2.3128 2.5439 2.5439 2.7577 2.7577 3.2625 3.2625 3.3279 3.3279 3.5078 3.5078 3.7005 3.7005 3.8687 3.8687 4.0358 4.0358 5.1475 5.1475 5.4049 5.4049 5.4800 5.4800 5.6284 5.6284 5.7155 5.7155 7.1159 7.1159 7.7614 7.7614 7.8247 7.8247 8.0187 8.0187 8.0969 8.0969 9.2248 9.2248 k = 0.5000-2.0634-2.1407 ( 6956 PWs) bands (ev): -4.9622 -4.9622 -4.9499 -4.9499 -4.1934 -4.1934 -3.2976 -3.2976 -3.2372 -3.2372 -3.2123 -3.2123 -2.9498 -2.9498 -2.6516 -2.6516 -2.3596 -2.3596 -1.9821 -1.9821 -1.6414 -1.6414 1.1002 1.1002 1.6646 1.6646 1.9731 1.9731 2.1050 2.1050 2.2639 2.2639 2.5046 2.5046 2.7160 2.7160 3.1348 3.1348 3.2988 3.2988 3.4941 3.4941 3.7267 3.7267 3.9077 3.9077 4.0432 4.0432 5.0974 5.0974 5.3961 5.3961 5.4614 5.4614 5.6451 5.6451 5.7196 5.7196 7.1367 7.1367 7.8019 7.8019 7.8704 7.8704 8.0481 8.0481 8.0952 8.0952 9.2994 9.2994 k = 0.5000-2.0293-2.1993 ( 6948 PWs) bands (ev): -4.9453 -4.9453 -4.9333 -4.9333 -4.1763 -4.1763 -3.2659 -3.2659 -3.2059 -3.2059 -3.1775 -3.1775 -2.9477 -2.9477 -2.6775 -2.6775 -2.3671 -2.3671 -2.0170 -2.0170 -1.7008 -1.7008 1.1182 1.1182 1.6723 1.6723 1.9780 1.9780 2.0416 2.0416 2.2073 2.2073 2.4814 2.4814 2.6886 2.6886 3.0104 3.0104 3.2375 3.2375 3.4945 3.4945 3.7521 3.7521 3.9511 3.9511 4.0750 4.0750 5.0150 5.0150 5.2639 5.2639 5.4843 5.4843 5.7119 5.7119 5.7703 5.7703 7.1573 7.1573 7.7314 7.7314 7.8058 7.8058 8.1746 8.1746 8.2369 8.2369 9.3338 9.3338 k = 0.5000-1.9952-2.2580 ( 6952 PWs) bands (ev): -4.9279 -4.9279 -4.9161 -4.9161 -4.1584 -4.1584 -3.2323 -3.2323 -3.1725 -3.1725 -3.1400 -3.1400 -2.9454 -2.9454 -2.7053 -2.7053 -2.3759 -2.3759 -2.0542 -2.0542 -1.7644 -1.7644 1.1373 1.1373 1.6809 1.6809 1.9527 1.9527 2.0109 2.0109 2.1444 2.1444 2.4707 2.4707 2.6725 2.6725 2.8941 2.8941 3.1530 3.1530 3.5091 3.5091 3.7768 3.7768 3.9982 3.9982 4.1199 4.1199 4.9143 4.9143 5.1233 5.1233 5.4992 5.4992 5.7844 5.7844 5.8316 5.8316 7.1779 7.1779 7.6510 7.6510 7.7147 7.7147 8.3388 8.3388 8.3996 8.3996 9.3409 9.3409 k = 0.5000-1.9611-2.3166 ( 6942 PWs) bands (ev): -4.9102 -4.9102 -4.8986 -4.8986 -4.1401 -4.1401 -3.1973 -3.1973 -3.1373 -3.1373 -3.0999 -3.0999 -2.9426 -2.9426 -2.7344 -2.7344 -2.3859 -2.3859 -2.0936 -2.0936 -1.8319 -1.8319 1.1573 1.1573 1.6903 1.6903 1.8950 1.8950 2.0174 2.0174 2.0804 2.0804 2.4649 2.4649 2.6621 2.6621 2.7929 2.7929 3.0586 3.0586 3.5319 3.5319 3.8005 3.8005 4.0463 4.0463 4.1711 4.1711 4.8070 4.8070 4.9833 4.9833 5.5149 5.5149 5.8491 5.8491 5.8861 5.8861 7.1981 7.1981 7.5781 7.5781 7.6321 7.6321 8.5087 8.5087 8.5671 8.5671 9.3367 9.3367 k = 0.5000-1.9271-2.3753 ( 6938 PWs) bands (ev): -4.8925 -4.8925 -4.8810 -4.8810 -4.1216 -4.1216 -3.1618 -3.1618 -3.1007 -3.1007 -3.0572 -3.0572 -2.9387 -2.9387 -2.7638 -2.7638 -2.3973 -2.3973 -2.1351 -2.1351 -1.9032 -1.9032 1.1780 1.1780 1.6999 1.6999 1.8386 1.8386 2.0060 2.0060 2.0433 2.0433 2.4516 2.4516 2.6442 2.6442 2.7262 2.7262 2.9640 2.9640 3.5593 3.5593 3.8219 3.8219 4.0919 4.0919 4.2245 4.2245 4.7026 4.7026 4.8476 4.8476 5.5330 5.5330 5.8964 5.8964 5.9281 5.9281 7.2179 7.2179 7.5183 7.5183 7.5676 7.5676 8.6776 8.6776 8.7347 8.7347 9.3025 9.3025 k = 0.5000-1.8930-2.4339 ( 6942 PWs) bands (ev): -4.8750 -4.8750 -4.8637 -4.8637 -4.1032 -4.1032 -3.1270 -3.1270 -3.0634 -3.0634 -3.0123 -3.0123 -2.9322 -2.9322 -2.7922 -2.7922 -2.4103 -2.4103 -2.1788 -2.1788 -1.9777 -1.9777 1.1989 1.1989 1.7072 1.7072 1.7911 1.7911 1.9496 1.9496 2.0590 2.0590 2.4136 2.4136 2.6133 2.6133 2.7082 2.7082 2.8791 2.8791 3.5891 3.5891 3.8386 3.8386 4.1301 4.1301 4.2760 4.2760 4.6109 4.6109 4.7209 4.7209 5.5530 5.5530 5.9198 5.9198 5.9549 5.9549 7.2369 7.2369 7.4756 7.4756 7.5265 7.5265 8.8402 8.8402 8.8971 8.8971 9.2390 9.2390 k = 0.5000-1.8589-2.4925 ( 6938 PWs) bands (ev): -4.8582 -4.8582 -4.8469 -4.8469 -4.0853 -4.0853 -3.0950 -3.0950 -3.0271 -3.0271 -2.9658 -2.9658 -2.9210 -2.9210 -2.8165 -2.8165 -2.4250 -2.4250 -2.2247 -2.2247 -2.0553 -2.0553 1.2194 1.2194 1.7035 1.7035 1.7623 1.7623 1.8956 1.8956 2.0822 2.0822 2.3481 2.3481 2.5865 2.5865 2.7070 2.7070 2.8217 2.8217 3.6197 3.6197 3.8460 3.8460 4.1532 4.1532 4.3158 4.3158 4.5445 4.5445 4.6147 4.6147 5.5741 5.5741 5.9183 5.9183 5.9626 5.9626 7.2558 7.2558 7.4536 7.4536 7.5101 7.5101 8.9707 8.9707 9.0404 9.0404 9.1989 9.1989 k = 0.5000-1.8248-2.5512 ( 6950 PWs) bands (ev): -4.8424 -4.8424 -4.8310 -4.8310 -4.0683 -4.0683 -3.0688 -3.0688 -2.9962 -2.9962 -2.9194 -2.9194 -2.9021 -2.9021 -2.8301 -2.8301 -2.4415 -2.4415 -2.2727 -2.2727 -2.1354 -2.1354 1.2388 1.2388 1.6829 1.6829 1.7570 1.7570 1.8505 1.8505 2.1093 2.1093 2.2714 2.2714 2.5430 2.5430 2.7113 2.7113 2.8087 2.8087 3.6483 3.6483 3.8375 3.8375 4.1547 4.1547 4.3183 4.3183 4.5175 4.5175 4.5569 4.5569 5.5949 5.5949 5.8943 5.8943 5.9490 5.9490 7.2757 7.2757 7.4545 7.4545 7.5164 7.5164 8.9601 8.9601 9.1695 9.1695 9.2800 9.2800 k = 0.5000-1.7907-2.6098 ( 6948 PWs) bands (ev): -4.8279 -4.8279 -4.8165 -4.8165 -4.0527 -4.0527 -3.0505 -3.0505 -2.9791 -2.9791 -2.8775 -2.8775 -2.8730 -2.8730 -2.8194 -2.8194 -2.4601 -2.4601 -2.3230 -2.3230 -2.2176 -2.2176 1.2560 1.2560 1.6609 1.6609 1.7530 1.7530 1.8225 1.8225 2.1393 2.1393 2.1958 2.1958 2.4765 2.4765 2.7304 2.7304 2.8262 2.8262 3.6690 3.6690 3.8092 3.8092 4.1336 4.1336 4.2760 4.2760 4.5317 4.5317 4.5646 4.5646 5.6133 5.6133 5.8511 5.8511 5.9164 5.9164 7.2978 7.2978 7.4776 7.4776 7.5415 7.5415 8.8679 8.8679 9.2529 9.2529 9.3694 9.3694 k = 0.5000-1.7566-2.6685 ( 6946 PWs) bands (ev): -4.8153 -4.8153 -4.8037 -4.8037 -4.0391 -4.0391 -3.0400 -3.0400 -2.9802 -2.9802 -2.8380 -2.8380 -2.8352 -2.8352 -2.7800 -2.7800 -2.4813 -2.4813 -2.3753 -2.3753 -2.3011 -2.3011 1.2704 1.2704 1.6465 1.6465 1.7346 1.7346 1.8186 1.8186 2.1216 2.1216 2.1770 2.1770 2.4025 2.4025 2.7616 2.7616 2.8572 2.8572 3.6647 3.6647 3.7717 3.7717 4.0873 4.0873 4.2453 4.2453 4.5679 4.5679 4.6102 4.6102 5.6241 5.6241 5.7932 5.7932 5.8726 5.8726 7.3220 7.3220 7.5198 7.5198 7.5820 7.5820 8.7590 8.7590 9.2134 9.2134 9.3359 9.3359 k = 0.5000-1.7226-2.7271 ( 6954 PWs) bands (ev): -4.8048 -4.8048 -4.7932 -4.7932 -4.0281 -4.0281 -3.0350 -3.0350 -2.9905 -2.9905 -2.7947 -2.7947 -2.7903 -2.7903 -2.7265 -2.7265 -2.5061 -2.5061 -2.4292 -2.4292 -2.3843 -2.3843 1.2812 1.2812 1.6414 1.6414 1.7109 1.7109 1.8264 1.8264 2.0598 2.0598 2.2139 2.2139 2.3317 2.3317 2.7996 2.7996 2.8954 2.8954 3.6140 3.6140 3.7419 3.7419 4.0341 4.0341 4.2481 4.2481 4.6159 4.6159 4.6685 4.6685 5.6158 5.6158 5.7253 5.7253 5.8327 5.8327 7.3476 7.3476 7.5772 7.5772 7.6350 7.6350 8.6449 8.6449 9.1061 9.1061 9.3236 9.3236 k = 0.5000-1.6885-2.7858 ( 6952 PWs) bands (ev): -4.7972 -4.7972 -4.7854 -4.7854 -4.0202 -4.0202 -3.0339 -3.0339 -3.0010 -3.0010 -2.7485 -2.7485 -2.7404 -2.7404 -2.6674 -2.6674 -2.5382 -2.5382 -2.4839 -2.4839 -2.4628 -2.4628 1.2889 1.2889 1.6449 1.6449 1.6909 1.6909 1.8340 1.8340 2.0076 2.0076 2.2549 2.2549 2.2707 2.2707 2.8408 2.8408 2.9376 2.9376 3.5345 3.5345 3.6966 3.6966 4.0088 4.0088 4.2706 4.2706 4.6702 4.6702 4.7307 4.7307 5.5748 5.5748 5.6509 5.6509 5.8153 5.8153 7.3736 7.3736 7.6459 7.6459 7.6980 7.6980 8.5294 8.5294 8.9863 8.9863 9.3135 9.3135 k = 0.5000-1.6544-2.8444 ( 6948 PWs) bands (ev): -4.7927 -4.7927 -4.7810 -4.7810 -4.0158 -4.0158 -3.0348 -3.0348 -3.0070 -3.0070 -2.7037 -2.7037 -2.6912 -2.6912 -2.6091 -2.6091 -2.5831 -2.5831 -2.5361 -2.5361 -2.5224 -2.5224 1.2942 1.2942 1.6540 1.6540 1.6778 1.6778 1.8352 1.8352 1.9674 1.9674 2.2251 2.2251 2.2991 2.2991 2.8827 2.8827 2.9810 2.9810 3.4482 3.4482 3.6254 3.6254 4.0181 4.0181 4.3035 4.3035 4.7270 4.7270 4.7930 4.7930 5.5050 5.5050 5.5727 5.5727 5.8219 5.8219 7.3990 7.3990 7.7224 7.7224 7.7689 7.7689 8.4145 8.4145 8.8643 8.8643 9.3018 9.3018 k = 0.5000-1.6203-2.9030 ( 6942 PWs) bands (ev): -4.7921 -4.7921 -4.7803 -4.7803 -4.0151 -4.0151 -3.0351 -3.0351 -3.0079 -3.0079 -2.6959 -2.6959 -2.6742 -2.6742 -2.6091 -2.6091 -2.5734 -2.5734 -2.5620 -2.5620 -2.5315 -2.5315 1.2984 1.2984 1.6605 1.6605 1.6771 1.6771 1.8261 1.8261 1.9410 1.9410 2.1999 2.1999 2.3460 2.3460 2.9212 2.9212 3.0210 3.0210 3.3680 3.3680 3.5433 3.5433 4.0489 4.0489 4.3425 4.3425 4.7833 4.7833 4.8523 4.8523 5.4206 5.4206 5.4959 5.4959 5.8416 5.8416 7.4235 7.4235 7.8032 7.8032 7.8459 7.8459 8.3020 8.3020 8.7427 8.7427 9.2882 9.2882 k = 0.8311-1.5872-2.8449 ( 6942 PWs) bands (ev): -4.7921 -4.7921 -4.7803 -4.7803 -4.0151 -4.0151 -3.0351 -3.0351 -3.0079 -3.0079 -2.6959 -2.6959 -2.6742 -2.6742 -2.6091 -2.6091 -2.5734 -2.5734 -2.5620 -2.5620 -2.5315 -2.5315 1.2984 1.2984 1.6605 1.6605 1.6771 1.6771 1.8261 1.8261 1.9410 1.9410 2.1999 2.1999 2.3460 2.3460 2.9212 2.9212 3.0210 3.0210 3.3680 3.3680 3.5433 3.5433 4.0489 4.0489 4.3425 4.3425 4.7833 4.7833 4.8523 4.8523 5.4206 5.4206 5.4959 5.4959 5.8416 5.8416 7.4235 7.4235 7.8032 7.8032 7.8459 7.8459 8.3020 8.3020 8.7427 8.7427 9.2882 9.2882 k = 0.8243-1.5538-2.7862 ( 6942 PWs) bands (ev): -4.7957 -4.7957 -4.7838 -4.7838 -4.0182 -4.0182 -3.0318 -3.0318 -3.0048 -3.0048 -2.7717 -2.7717 -2.7015 -2.7015 -2.6058 -2.6058 -2.5547 -2.5547 -2.5449 -2.5449 -2.4649 -2.4649 1.3026 1.3026 1.6614 1.6614 1.6879 1.6879 1.8061 1.8061 1.9310 1.9310 2.1961 2.1961 2.3953 2.3953 2.9486 2.9486 3.0477 3.0477 3.3093 3.3093 3.4657 3.4657 4.0906 4.0906 4.3857 4.3857 4.8343 4.8343 4.9048 4.9048 5.3310 5.3310 5.4286 5.4286 5.8675 5.8675 7.4467 7.4467 7.8835 7.8835 7.9275 7.9275 8.1957 8.1957 8.6232 8.6232 9.2728 9.2728 k = 0.8176-1.5203-2.7276 ( 6936 PWs) bands (ev): -4.8042 -4.8042 -4.7919 -4.7919 -4.0248 -4.0248 -3.0243 -3.0243 -2.9985 -2.9985 -2.8571 -2.8571 -2.7574 -2.7574 -2.6386 -2.6386 -2.5059 -2.5059 -2.4844 -2.4844 -2.3933 -2.3933 1.3081 1.3081 1.6638 1.6638 1.6990 1.6990 1.7798 1.7798 1.9392 1.9392 2.2105 2.2105 2.4465 2.4465 2.9498 2.9498 3.0486 3.0486 3.2910 3.2910 3.4083 3.4083 4.1386 4.1386 4.4318 4.4318 4.8705 4.8705 4.9454 4.9454 5.2443 5.2443 5.3820 5.3820 5.8965 5.8965 7.4683 7.4683 7.9460 7.9460 8.0120 8.0120 8.1119 8.1119 8.5070 8.5070 9.2556 9.2556 k = 0.8108-1.4869-2.6689 ( 6934 PWs) bands (ev): -4.8180 -4.8180 -4.8046 -4.8046 -4.0343 -4.0343 -3.0186 -3.0186 -2.9915 -2.9915 -2.9347 -2.9347 -2.8194 -2.8194 -2.6756 -2.6756 -2.4499 -2.4499 -2.4181 -2.4181 -2.3189 -2.3189 1.3155 1.3155 1.6637 1.6637 1.7091 1.7091 1.7581 1.7581 1.9640 1.9640 2.2380 2.2380 2.4986 2.4986 2.9134 2.9134 3.0243 3.0243 3.3091 3.3091 3.3900 3.3900 4.1905 4.1905 4.4800 4.4800 4.8769 4.8769 4.9638 4.9638 5.1779 5.1779 5.3674 5.3674 5.9270 5.9270 7.4881 7.4881 7.9237 7.9237 8.0935 8.0935 8.1198 8.1198 8.3974 8.3974 9.2369 9.2369 k = 0.8041-1.4535-2.6103 ( 6938 PWs) bands (ev): -4.8376 -4.8376 -4.8219 -4.8219 -4.0461 -4.0461 -3.0628 -3.0628 -2.9845 -2.9845 -2.9586 -2.9586 -2.8790 -2.8790 -2.7151 -2.7151 -2.3912 -2.3912 -2.3490 -2.3490 -2.2418 -2.2418 1.3254 1.3254 1.6503 1.6503 1.7228 1.7228 1.7537 1.7537 2.0018 2.0018 2.2742 2.2742 2.5494 2.5494 2.8547 2.8547 2.9775 2.9775 3.3430 3.3430 3.4176 3.4176 4.2449 4.2449 4.5296 4.5296 4.8480 4.8480 4.9336 4.9336 5.1634 5.1634 5.3867 5.3867 5.9584 5.9584 7.5059 7.5059 7.8387 7.8387 8.1541 8.1541 8.1987 8.1987 8.3101 8.3101 9.2169 9.2169 k = 0.7973-1.4201-2.5516 ( 6938 PWs) bands (ev): -4.8631 -4.8631 -4.8439 -4.8439 -4.0597 -4.0597 -3.1472 -3.1472 -2.9887 -2.9887 -2.9558 -2.9558 -2.9054 -2.9054 -2.7571 -2.7571 -2.3310 -2.3310 -2.2775 -2.2775 -2.1624 -2.1624 1.3384 1.3384 1.6250 1.6250 1.7435 1.7435 1.7667 1.7667 2.0489 2.0489 2.3161 2.3161 2.5920 2.5920 2.7967 2.7967 2.9159 2.9159 3.3883 3.3883 3.4733 3.4733 4.3011 4.3011 4.5798 4.5798 4.7945 4.7945 4.8605 4.8605 5.1953 5.1953 5.4307 5.4307 5.9902 5.9902 7.5213 7.5213 7.7465 7.7465 8.1282 8.1282 8.2849 8.2849 8.3188 8.3188 9.1963 9.1963 k = 0.7906-1.3867-2.4929 ( 6942 PWs) bands (ev): -4.8946 -4.8946 -4.8703 -4.8703 -4.0745 -4.0745 -3.2372 -3.2372 -3.0441 -3.0441 -2.9385 -2.9385 -2.8814 -2.8814 -2.8010 -2.8010 -2.2700 -2.2700 -2.2041 -2.2041 -2.0805 -2.0805 1.3548 1.3548 1.5974 1.5974 1.7695 1.7695 1.7918 1.7918 2.1029 2.1029 2.3609 2.3609 2.6061 2.6061 2.7656 2.7656 2.8527 2.8527 3.4432 3.4432 3.5416 3.5416 4.3578 4.3578 4.6277 4.6277 4.7305 4.7305 4.7745 4.7745 5.2437 5.2437 5.4890 5.4890 6.0220 6.0220 7.5339 7.5339 7.6576 7.6576 8.0395 8.0395 8.3696 8.3696 8.3974 8.3974 9.1758 9.1758 k = 0.7838-1.3533-2.4343 ( 6930 PWs) bands (ev): -4.9315 -4.9315 -4.9011 -4.9011 -4.0901 -4.0901 -3.3281 -3.3281 -3.1119 -3.1119 -2.9164 -2.9164 -2.8491 -2.8491 -2.8380 -2.8380 -2.2084 -2.2084 -2.1290 -2.1290 -1.9964 -1.9964 1.3748 1.3748 1.5728 1.5728 1.7993 1.7993 1.8266 1.8266 2.1621 2.1621 2.4050 2.4050 2.5763 2.5763 2.7549 2.7549 2.8220 2.8220 3.5042 3.5042 3.6169 3.6169 4.4127 4.4127 4.6400 4.6400 4.6717 4.6717 4.7150 4.7150 5.2959 5.2959 5.5547 5.5547 6.0536 6.0536 7.5405 7.5405 7.5782 7.5782 7.9448 7.9448 8.4530 8.4530 8.4854 8.4854 9.1567 9.1567 k = 0.7770-1.3199-2.3756 ( 6930 PWs) bands (ev): -4.9735 -4.9735 -4.9359 -4.9359 -4.1066 -4.1066 -3.4189 -3.4189 -3.1822 -3.1822 -2.9134 -2.9134 -2.8695 -2.8695 -2.7941 -2.7941 -2.1468 -2.1468 -2.0525 -2.0525 -1.9101 -1.9101 1.3982 1.3982 1.5536 1.5536 1.8327 1.8327 1.8687 1.8687 2.2252 2.2252 2.4394 2.4394 2.5328 2.5328 2.7128 2.7128 2.8598 2.8598 3.5684 3.5684 3.6967 3.6967 4.4569 4.4569 4.5735 4.5735 4.6101 4.6101 4.7509 4.7509 5.3472 5.3472 5.6237 5.6237 6.0846 6.0846 7.4939 7.4939 7.5567 7.5567 7.8533 7.8533 8.5326 8.5326 8.5723 8.5723 9.1411 9.1411 k = 0.7703-1.2865-2.3170 ( 6938 PWs) bands (ev): -5.0200 -5.0200 -4.9746 -4.9746 -4.1238 -4.1238 -3.5092 -3.5092 -3.2533 -3.2533 -2.9567 -2.9567 -2.8453 -2.8453 -2.7418 -2.7418 -2.0854 -2.0854 -1.9746 -1.9746 -1.8217 -1.8217 1.4242 1.4242 1.5417 1.5417 1.8692 1.8692 1.9164 1.9164 2.2910 2.2910 2.4404 2.4404 2.5072 2.5072 2.6842 2.6842 2.9173 2.9173 3.6333 3.6333 3.7799 3.7799 4.4536 4.4536 4.4972 4.4972 4.5983 4.5983 4.8021 4.8021 5.3948 5.3948 5.6933 5.6933 6.1149 6.1149 7.4291 7.4291 7.5595 7.5595 7.7677 7.7677 8.6045 8.6045 8.6543 8.6543 9.1323 9.1323 k = 0.7635-1.2530-2.2583 ( 6936 PWs) bands (ev): -5.0703 -5.0703 -5.0166 -5.0166 -4.1420 -4.1420 -3.5987 -3.5987 -3.3243 -3.3243 -3.0087 -3.0087 -2.8114 -2.8114 -2.6850 -2.6850 -2.0246 -2.0246 -1.8957 -1.8957 -1.7312 -1.7312 1.4509 1.4509 1.5395 1.5395 1.9070 1.9070 1.9686 1.9686 2.3548 2.3548 2.4155 2.4155 2.4895 2.4895 2.6934 2.6934 2.9801 2.9801 3.6963 3.6963 3.8655 3.8655 4.3900 4.3900 4.4382 4.4382 4.6405 4.6405 4.8551 4.8551 5.4369 5.4369 5.7616 5.7616 6.1444 6.1444 7.3740 7.3740 7.5593 7.5593 7.6905 7.6905 8.6633 8.6633 8.7276 8.7276 9.1350 9.1350 k = 0.7568-1.2196-2.1997 ( 6940 PWs) bands (ev): -5.1238 -5.1238 -5.0617 -5.0617 -4.1613 -4.1613 -3.6872 -3.6872 -3.3949 -3.3949 -3.0634 -3.0634 -2.7738 -2.7738 -2.6245 -2.6245 -1.9646 -1.9646 -1.8158 -1.8158 -1.6388 -1.6388 1.4744 1.4744 1.5505 1.5505 1.9439 1.9439 2.0237 2.0237 2.3715 2.3715 2.4347 2.4347 2.4682 2.4682 2.7338 2.7338 3.0449 3.0449 3.7537 3.7537 3.9521 3.9521 4.3144 4.3144 4.3934 4.3934 4.6986 4.6986 4.9084 4.9084 5.4718 5.4718 5.8267 5.8267 6.1728 6.1728 7.3312 7.3312 7.5520 7.5520 7.6261 7.6261 8.7030 8.7030 8.7872 8.7872 9.1531 9.1531 k = 0.7500-1.1862-2.1410 ( 6944 PWs) bands (ev): -5.1799 -5.1799 -5.1093 -5.1093 -4.1821 -4.1821 -3.7746 -3.7746 -3.4645 -3.4645 -3.1198 -3.1198 -2.7338 -2.7338 -2.5609 -2.5609 -1.9058 -1.9058 -1.7353 -1.7353 -1.5445 -1.5445 1.4932 1.4932 1.5758 1.5758 1.9769 1.9769 2.0797 2.0797 2.3607 2.3607 2.4245 2.4245 2.5205 2.5205 2.7889 2.7889 3.1101 3.1101 3.8005 3.8005 4.0360 4.0360 4.2461 4.2461 4.3652 4.3652 4.7611 4.7611 4.9613 4.9613 5.4980 5.4980 5.8867 5.8867 6.2001 6.2001 7.3021 7.3021 7.5277 7.5277 7.5859 7.5859 8.7204 8.7204 8.8275 8.8275 9.1835 9.1835 k = 0.7433-1.1528-2.0824 ( 6946 PWs) bands (ev): -5.2380 -5.2380 -5.1592 -5.1592 -4.2045 -4.2045 -3.8607 -3.8607 -3.5328 -3.5328 -3.1775 -3.1775 -2.6919 -2.6919 -2.4947 -2.4947 -1.8485 -1.8485 -1.6542 -1.6542 -1.4484 -1.4484 1.5109 1.5109 1.6105 1.6105 2.0043 2.0043 2.1325 2.1325 2.3616 2.3616 2.4105 2.4105 2.5960 2.5960 2.8507 2.8507 3.1742 3.1742 3.8313 3.8313 4.0946 4.0946 4.2100 4.2100 4.3608 4.3608 4.8256 4.8256 5.0136 5.0136 5.5146 5.5146 5.9398 5.9398 6.2262 6.2262 7.2878 7.2878 7.4895 7.4895 7.5685 7.5685 8.7180 8.7180 8.8450 8.8450 9.2059 9.2059 k = 0.7365-1.1194-2.0237 ( 6934 PWs) bands (ev): -5.2976 -5.2976 -5.2107 -5.2107 -4.2288 -4.2288 -3.9454 -3.9454 -3.5995 -3.5995 -3.2361 -3.2361 -2.6488 -2.6488 -2.4265 -2.4265 -1.7930 -1.7930 -1.5729 -1.5729 -1.3507 -1.3507 1.5315 1.5315 1.6488 1.6488 2.0275 2.0275 2.1746 2.1746 2.3740 2.3740 2.4234 2.4234 2.6753 2.6753 2.9159 2.9159 3.2358 3.2358 3.8430 3.8430 4.0767 4.0767 4.2584 4.2584 4.3847 4.3847 4.8912 4.8912 5.0648 5.0648 5.5210 5.5210 5.9839 5.9839 6.2510 6.2510 7.2888 7.2888 7.4567 7.4567 7.5564 7.5564 8.7012 8.7012 8.8412 8.8412 9.1901 9.1901 k = 0.7297-1.0860-1.9651 ( 6938 PWs) bands (ev): -5.3582 -5.3582 -5.2636 -5.2636 -4.2553 -4.2553 -4.0286 -4.0286 -3.6644 -3.6644 -3.2954 -3.2954 -2.6048 -2.6048 -2.3566 -2.3566 -1.7394 -1.7394 -1.4915 -1.4915 -1.2515 -1.2515 1.5570 1.5570 1.6867 1.6867 2.0512 2.0512 2.1984 2.1984 2.4048 2.4048 2.4631 2.4631 2.7571 2.7571 2.9828 2.9828 3.2929 3.2929 3.8382 3.8382 4.0346 4.0346 4.3400 4.3400 4.4364 4.4364 4.9573 4.9573 5.1146 5.1146 5.5175 5.5175 6.0175 6.0175 6.2746 6.2746 7.3049 7.3049 7.4364 7.4364 7.5442 7.5442 8.6748 8.6748 8.8216 8.8216 9.1305 9.1305 k = 0.7230-1.0526-1.9064 ( 6932 PWs) bands (ev): -5.4193 -5.4193 -5.3175 -5.3175 -4.2841 -4.2841 -4.1101 -4.1101 -3.7270 -3.7270 -3.3552 -3.3552 -2.5607 -2.5607 -2.2857 -2.2857 -1.6881 -1.6881 -1.4103 -1.4103 -1.1509 -1.1509 1.5880 1.5880 1.7215 1.7215 2.0811 2.0811 2.2080 2.2080 2.4566 2.4566 2.5197 2.5197 2.8411 2.8411 3.0505 3.0505 3.3430 3.3430 3.8232 3.8232 4.0002 4.0002 4.4249 4.4249 4.5106 4.5106 5.0237 5.0237 5.1625 5.1625 5.5050 5.5050 6.0392 6.0392 6.2970 6.2970 7.3354 7.3354 7.4305 7.4305 7.5312 7.5312 8.6421 8.6421 8.7914 8.7914 9.0484 9.0484 k = 0.7162-1.0192-1.8478 ( 6934 PWs) bands (ev): -5.4807 -5.4807 -5.3721 -5.3721 -4.3153 -4.3153 -4.1899 -4.1899 -3.7871 -3.7871 -3.4151 -3.4151 -2.5168 -2.5168 -2.2143 -2.2143 -1.6391 -1.6391 -1.3295 -1.3295 -1.0491 -1.0491 1.6242 1.6242 1.7527 1.7527 2.1199 2.1199 2.2154 2.2154 2.5210 2.5210 2.5866 2.5866 2.9270 2.9270 3.1178 3.1178 3.3836 3.3836 3.8049 3.8049 3.9810 3.9810 4.5104 4.5104 4.5993 4.5993 5.0903 5.0903 5.2078 5.2078 5.4856 5.4856 6.0489 6.0489 6.3183 6.3183 7.3788 7.3788 7.4378 7.4378 7.5190 7.5190 8.6052 8.6052 8.7544 8.7544 8.9574 8.9574 k = 0.7095-0.9857-1.7891 ( 6940 PWs) bands (ev): -5.5420 -5.5420 -5.4270 -5.4270 -4.3490 -4.3490 -4.2679 -4.2679 -3.8446 -3.8446 -3.4749 -3.4749 -2.4736 -2.4736 -2.1430 -2.1430 -1.5923 -1.5923 -1.2494 -1.2494 -0.9462 -0.9462 1.6653 1.6653 1.7819 1.7819 2.1631 2.1631 2.2330 2.2330 2.5912 2.5912 2.6600 2.6600 3.0149 3.0149 3.1838 3.1838 3.4129 3.4129 3.7889 3.7889 3.9804 3.9804 4.5975 4.5975 4.6957 4.6957 5.1569 5.1569 5.2490 5.2490 5.4621 5.4621 6.0470 6.0470 6.3384 6.3384 7.4327 7.4327 7.4510 7.4510 7.5151 7.5151 8.5654 8.5654 8.7123 8.7123 8.8612 8.8612 k = 0.7027-0.9523-1.7305 ( 6938 PWs) bands (ev): -5.6029 -5.6029 -5.4820 -5.4820 -4.3851 -4.3851 -4.3440 -4.3440 -3.8993 -3.8993 -3.5345 -3.5345 -2.4317 -2.4317 -2.0726 -2.0726 -1.5476 -1.5476 -1.1701 -1.1701 -0.8423 -0.8423 1.7097 1.7097 1.8128 1.8128 2.1977 2.1977 2.2766 2.2766 2.6633 2.6633 2.7373 2.7373 3.1047 3.1047 3.2468 3.2468 3.4322 3.4322 3.7795 3.7795 3.9987 3.9987 4.6862 4.6862 4.7954 4.7954 5.2230 5.2230 5.2831 5.2831 5.4402 5.4402 6.0354 6.0354 6.3575 6.3575 7.4483 7.4483 7.4978 7.4978 7.5370 7.5370 8.5232 8.5232 8.6649 8.6649 8.7657 8.7657 k = 0.6960-0.9189-1.6718 ( 6930 PWs) bands (ev): -5.6631 -5.6631 -5.5368 -5.5368 -4.4235 -4.4235 -4.4182 -4.4182 -3.9512 -3.9512 -3.5935 -3.5935 -2.3915 -2.3915 -2.0039 -2.0039 -1.5046 -1.5046 -1.0918 -1.0918 -0.7377 -0.7377 1.7554 1.7554 1.8501 1.8501 2.2246 2.2246 2.3447 2.3447 2.7345 2.7345 2.8161 2.8161 3.1963 3.1963 3.3035 3.3035 3.4480 3.4480 3.7798 3.7798 4.0339 4.0339 4.7758 4.7758 4.8950 4.8950 5.2836 5.2836 5.3075 5.3075 5.4304 5.4304 6.0161 6.0161 6.3755 6.3755 7.4330 7.4330 7.5656 7.5656 7.5856 7.5856 8.4791 8.4791 8.6075 8.6075 8.6788 8.6788 k = 0.6892-0.8855-1.6132 ( 6936 PWs) bands (ev): -5.7225 -5.7225 -5.5911 -5.5911 -4.4903 -4.4903 -4.4638 -4.4638 -4.0003 -4.0003 -3.6519 -3.6519 -2.3533 -2.3533 -1.9381 -1.9381 -1.4627 -1.4627 -1.0149 -1.0149 -0.6326 -0.6326 1.8003 1.8003 1.8980 1.8980 2.2541 2.2541 2.4260 2.4260 2.8027 2.8027 2.8941 2.8941 3.2882 3.2882 3.3486 3.3486 3.4726 3.4726 3.7916 3.7916 4.0821 4.0821 4.8652 4.8652 4.9897 4.9897 5.2956 5.2956 5.3608 5.3608 5.4420 5.4420 5.9919 5.9919 6.3925 6.3925 7.4118 7.4118 7.6306 7.6306 7.6550 7.6550 8.4326 8.4326 8.5320 8.5320 8.6072 8.6072 k = 0.6824-0.8521-1.5545 ( 6936 PWs) bands (ev): -5.7809 -5.7809 -5.6448 -5.6448 -4.5604 -4.5604 -4.5059 -4.5059 -4.0467 -4.0467 -3.7094 -3.7094 -2.3175 -2.3175 -1.8761 -1.8761 -1.4211 -1.4211 -0.9394 -0.9394 -0.5271 -0.5271 1.8447 1.8447 1.9575 1.9575 2.2901 2.2901 2.5153 2.5153 2.8663 2.8663 2.9687 2.9687 3.3594 3.3594 3.3997 3.3997 3.5163 3.5163 3.8156 3.8156 4.1394 4.1394 4.9531 4.9531 5.0676 5.0676 5.2943 5.2943 5.4257 5.4257 5.4697 5.4697 5.9658 5.9658 6.4085 6.4085 7.3879 7.3879 7.6942 7.6942 7.7347 7.7347 8.3823 8.3823 8.4453 8.4453 8.5395 8.5395 k = 0.6757-0.8187-1.4959 ( 6930 PWs) bands (ev): -5.8380 -5.8380 -5.6977 -5.6977 -4.6282 -4.6282 -4.5493 -4.5493 -4.0906 -4.0906 -3.7659 -3.7659 -2.2845 -2.2845 -1.8195 -1.8195 -1.3787 -1.3787 -0.8656 -0.8656 -0.4216 -0.4216 1.8912 1.8912 2.0267 2.0267 2.3338 2.3338 2.6103 2.6103 2.9244 2.9244 3.0365 3.0365 3.3848 3.3848 3.4921 3.4921 3.5763 3.5763 3.8514 3.8514 4.2030 4.2030 5.0375 5.0375 5.1048 5.1048 5.3240 5.3240 5.4879 5.4879 5.5069 5.5069 5.9413 5.9413 6.4236 6.4236 7.3625 7.3625 7.7551 7.7551 7.8175 7.8175 8.3214 8.3214 8.3643 8.3643 8.4784 8.4784 k = 0.6689-0.7853-1.4372 ( 6928 PWs) bands (ev): -5.8938 -5.8938 -5.7496 -5.7496 -4.6939 -4.6939 -4.5936 -4.5936 -4.1322 -4.1322 -3.8212 -3.8212 -2.2543 -2.2543 -1.7693 -1.7693 -1.3346 -1.3346 -0.7937 -0.7937 -0.3161 -0.3161 1.9419 1.9419 2.1039 2.1039 2.3854 2.3854 2.7092 2.7092 2.9770 2.9770 3.0940 3.0940 3.4107 3.4107 3.5919 3.5919 3.6466 3.6466 3.8978 3.8978 4.2704 4.2704 5.0924 5.0924 5.1217 5.1217 5.3910 5.3910 5.5380 5.5380 5.5593 5.5593 5.9234 5.9234 6.4378 6.4378 7.3360 7.3360 7.8059 7.8059 7.9003 7.9003 8.2413 8.2413 8.3033 8.3033 8.4303 8.4303 k = 0.6622-0.7519-1.3786 ( 6924 PWs) bands (ev): -5.9481 -5.9481 -5.8003 -5.8003 -4.7573 -4.7573 -4.6384 -4.6384 -4.1716 -4.1716 -3.8752 -3.8752 -2.2272 -2.2272 -1.7266 -1.7266 -1.2879 -1.2879 -0.7238 -0.7238 -0.2110 -0.2110 1.9983 1.9983 2.1875 2.1875 2.4447 2.4447 2.8104 2.8104 3.0251 3.0251 3.1398 3.1398 3.4490 3.4490 3.6933 3.6933 3.7250 3.7250 3.9536 3.9536 4.3402 4.3402 5.0667 5.0667 5.1919 5.1919 5.4660 5.4660 5.5877 5.5877 5.6158 5.6158 5.9191 5.9191 6.4512 6.4512 7.3090 7.3090 7.8362 7.8362 7.9770 7.9770 8.1568 8.1568 8.2559 8.2559 8.3955 8.3955 k = 0.6554-0.7184-1.3199 ( 6926 PWs) bands (ev): -6.0008 -6.0008 -5.8497 -5.8497 -4.8184 -4.8184 -4.6834 -4.6834 -4.2091 -4.2091 -3.9277 -3.9277 -2.2032 -2.2032 -1.6919 -1.6919 -1.2382 -1.2382 -0.6562 -0.6562 -0.1064 -0.1064 2.0610 2.0610 2.2765 2.2765 2.5115 2.5115 2.9117 2.9117 3.0705 3.0705 3.1770 3.1770 3.5007 3.5007 3.7904 3.7904 3.8138 3.8138 4.0180 4.0180 4.4113 4.4113 5.0330 5.0330 5.2541 5.2541 5.5266 5.5266 5.6408 5.6408 5.6764 5.6764 5.9367 5.9367 6.4640 6.4640 7.2816 7.2816 7.8375 7.8375 8.0132 8.0132 8.1041 8.1041 8.2198 8.2198 8.3685 8.3685 k = 0.6487-0.6850-1.2613 ( 6932 PWs) bands (ev): -6.0519 -6.0519 -5.8977 -5.8977 -4.8772 -4.8772 -4.7281 -4.7281 -4.2448 -4.2448 -3.9786 -3.9786 -2.1824 -2.1824 -1.6650 -1.6650 -1.1858 -1.1858 -0.5911 -0.5911 -0.0028 -0.0028 2.1301 2.1301 2.3701 2.3701 2.5855 2.5855 3.0092 3.0092 3.1150 3.1150 3.2140 3.2140 3.5626 3.5626 3.8773 3.8773 3.9153 3.9153 4.0911 4.0911 4.4828 4.4828 4.9990 4.9990 5.3031 5.3031 5.5698 5.5698 5.6756 5.6756 5.7598 5.7598 5.9800 5.9800 6.4763 6.4763 7.2542 7.2542 7.8102 7.8102 7.9518 7.9518 8.1212 8.1212 8.2033 8.2033 8.3519 8.3519 k = 0.6419-0.6516-1.2026 ( 6936 PWs) bands (ev): -6.1011 -6.1011 -5.9442 -5.9442 -4.9336 -4.9336 -4.7722 -4.7722 -4.2788 -4.2788 -4.0279 -4.0279 -2.1646 -2.1646 -1.6453 -1.6453 -1.1313 -1.1313 -0.5286 -0.5286 0.0998 0.0998 2.2055 2.2055 2.4674 2.4674 2.6660 2.6660 3.0953 3.0953 3.1608 3.1608 3.2626 3.2626 3.6308 3.6308 3.9581 3.9581 4.0212 4.0212 4.1731 4.1731 4.5540 4.5540 4.9676 4.9676 5.3361 5.3361 5.6033 5.6033 5.7015 5.7015 5.8544 5.8544 6.0438 6.0438 6.4883 6.4883 7.2270 7.2270 7.7627 7.7627 7.8706 7.8706 8.1094 8.1094 8.2038 8.2038 8.3677 8.3677 k = 0.6351-0.6182-1.1440 ( 6936 PWs) bands (ev): -6.1484 -6.1484 -5.9891 -5.9891 -4.9876 -4.9876 -4.8154 -4.8154 -4.3113 -4.3113 -4.0754 -4.0754 -2.1499 -2.1499 -1.6319 -1.6319 -1.0756 -1.0756 -0.4690 -0.4690 0.2009 0.2009 2.2869 2.2869 2.5675 2.5675 2.7527 2.7527 3.1607 3.1607 3.2124 3.2124 3.3321 3.3321 3.7030 3.7030 4.0336 4.0336 4.1275 4.1275 4.2642 4.2642 4.6243 4.6243 4.9413 4.9413 5.3520 5.3520 5.6319 5.6319 5.7305 5.7305 5.9507 5.9507 6.1190 6.1190 6.5003 6.5003 7.2004 7.2004 7.7039 7.7039 7.7912 7.7912 8.0788 8.0788 8.1849 8.1849 8.4206 8.4206 k = 0.6284-0.5848-1.0853 ( 6932 PWs) bands (ev): -6.1938 -6.1938 -6.0322 -6.0322 -5.0391 -5.0391 -4.8575 -4.8575 -4.3423 -4.3423 -4.1211 -4.1211 -2.1379 -2.1379 -1.6237 -1.6237 -1.0198 -1.0198 -0.4124 -0.4124 0.3005 0.3005 2.3736 2.3736 2.6695 2.6695 2.8449 2.8449 3.2085 3.2085 3.2736 3.2736 3.4185 3.4185 3.7781 3.7781 4.1032 4.1032 4.2322 4.2322 4.3629 4.3629 4.6928 4.6928 4.9226 4.9226 5.3534 5.3534 5.6584 5.6584 5.7667 5.7667 6.0444 6.0444 6.1979 6.1979 6.5125 6.5125 7.1746 7.1746 7.6403 7.6403 7.7182 7.7182 8.0437 8.0437 8.1520 8.1520 8.4864 8.4864 k = 0.6216-0.5514-1.0266 ( 6946 PWs) bands (ev): -6.2372 -6.2372 -6.0735 -6.0735 -5.0881 -5.0881 -4.8983 -4.8983 -4.3719 -4.3719 -4.1648 -4.1648 -2.1285 -2.1285 -1.6198 -1.6198 -0.9647 -0.9647 -0.3590 -0.3590 0.3981 0.3981 2.4652 2.4652 2.7720 2.7720 2.9419 2.9419 3.2520 3.2520 3.3433 3.3433 3.5107 3.5107 3.8563 3.8563 4.1675 4.1675 4.3332 4.3332 4.4668 4.4668 4.7575 4.7575 4.9152 4.9152 5.3448 5.3448 5.6843 5.6843 5.8096 5.8096 6.1322 6.1322 6.2742 6.2742 6.5253 6.5253 7.1499 7.1499 7.5766 7.5766 7.6548 7.6548 8.0073 8.0073 8.1132 8.1132 8.5491 8.5491 k = 0.6149-0.5180-0.9680 ( 6952 PWs) bands (ev): -6.2785 -6.2785 -6.1129 -6.1129 -5.1346 -5.1346 -4.9376 -4.9376 -4.4000 -4.4000 -4.2065 -4.2065 -2.1215 -2.1215 -1.6194 -1.6194 -0.9111 -0.9111 -0.3090 -0.3090 0.4936 0.4936 2.5609 2.5609 2.8739 2.8739 3.0430 3.0430 3.2987 3.2987 3.4219 3.4219 3.6010 3.6010 3.9378 3.9378 4.2271 4.2271 4.4283 4.4283 4.5729 4.5729 4.8137 4.8137 4.9261 4.9261 5.3310 5.3310 5.7108 5.7108 5.8577 5.8577 6.2104 6.2104 6.3420 6.3420 6.5392 6.5392 7.1268 7.1268 7.5177 7.5177 7.6043 7.6043 7.9702 7.9702 8.0712 8.0712 8.5974 8.5974 k = 0.6081-0.4845-0.9093 ( 6962 PWs) bands (ev): -6.3177 -6.3177 -6.1504 -6.1504 -5.1786 -5.1786 -4.9752 -4.9752 -4.4267 -4.4267 -4.2462 -4.2462 -2.1166 -2.1166 -1.6217 -1.6217 -0.8596 -0.8596 -0.2624 -0.2624 0.5866 0.5866 2.6600 2.6600 2.9741 2.9741 3.1471 3.1471 3.3520 3.3520 3.5105 3.5105 3.6853 3.6853 4.0226 4.0226 4.2830 4.2830 4.5155 4.5155 4.6781 4.6781 4.8567 4.8567 4.9621 4.9621 5.3160 5.3160 5.7387 5.7387 5.9101 5.9101 6.2745 6.2745 6.3958 6.3958 6.5543 6.5543 7.1056 7.1056 7.4686 7.4686 7.5701 7.5701 7.9327 7.9327 8.0261 8.0261 8.6144 8.6144 k = 0.6014-0.4511-0.8507 ( 6954 PWs) bands (ev): -6.3547 -6.3547 -6.1858 -6.1858 -5.2200 -5.2200 -5.0109 -5.0109 -4.4520 -4.4520 -4.2836 -4.2836 -2.1136 -2.1136 -1.6261 -1.6261 -0.8108 -0.8108 -0.2195 -0.2195 0.6770 0.6770 2.7617 2.7617 3.0715 3.0715 3.2525 3.2525 3.4138 3.4138 3.6095 3.6095 3.7621 3.7621 4.1090 4.1090 4.3359 4.3359 4.5936 4.5936 4.7780 4.7780 4.8957 4.8957 5.0159 5.0159 5.3038 5.3038 5.7691 5.7691 5.9663 5.9663 6.3199 6.3199 6.4314 6.4314 6.5703 6.5703 7.0861 7.0861 7.4344 7.4344 7.5557 7.5557 7.8944 7.8944 7.9773 7.9773 8.5782 8.5782 k = 0.5946-0.4177-0.7920 ( 6960 PWs) bands (ev): -6.3895 -6.3895 -6.2192 -6.2192 -5.2589 -5.2589 -5.0448 -5.0448 -4.4758 -4.4758 -4.3189 -4.3189 -2.1121 -2.1121 -1.6320 -1.6320 -0.7650 -0.7650 -0.1801 -0.1801 0.7643 0.7643 2.8652 2.8652 3.1653 3.1653 3.3570 3.3570 3.4860 3.4860 3.7183 3.7183 3.8322 3.8322 4.1937 4.1937 4.3869 4.3869 4.6648 4.6648 4.8638 4.8638 4.9469 4.9469 5.0726 5.0726 5.2992 5.2992 5.8026 5.8026 6.0261 6.0261 6.3427 6.3427 6.4463 6.4463 6.5866 6.5866 7.0680 7.0680 7.4195 7.4195 7.5621 7.5621 7.8548 7.8548 7.9239 7.9239 8.4965 8.4965 k = 0.5878-0.3843-0.7334 ( 6962 PWs) bands (ev): -6.4220 -6.4220 -6.2505 -6.2505 -5.2951 -5.2951 -5.0766 -5.0766 -4.4982 -4.4982 -4.3520 -4.3520 -2.1119 -2.1119 -1.6391 -1.6391 -0.7224 -0.7224 -0.1444 -0.1444 0.8483 0.8483 2.9697 2.9697 3.2545 3.2545 3.4577 3.4577 3.5702 3.5702 3.8350 3.8350 3.8990 3.8990 4.2717 4.2717 4.4373 4.4373 4.7338 4.7338 4.9274 4.9274 5.0179 5.0179 5.1211 5.1211 5.3088 5.3088 5.8393 5.8393 6.0885 6.0885 6.3426 6.3426 6.4410 6.4410 6.6044 6.6044 7.0506 7.0506 7.4247 7.4247 7.5843 7.5843 7.8142 7.8142 7.8667 7.8667 8.3989 8.3989 k = 0.5811-0.3509-0.6747 ( 6966 PWs) bands (ev): -6.4522 -6.4522 -6.2796 -6.2796 -5.3287 -5.3287 -5.1063 -5.1063 -4.5190 -4.5190 -4.3827 -4.3827 -2.1127 -2.1127 -1.6468 -1.6468 -0.6834 -0.6834 -0.1121 -0.1121 0.9287 0.9287 3.0744 3.0744 3.3380 3.3380 3.5536 3.5536 3.6658 3.6658 3.9459 3.9459 3.9784 3.9784 4.3393 4.3393 4.4880 4.4880 4.8052 4.8052 4.9781 4.9781 5.0924 5.0924 5.1578 5.1578 5.3369 5.3369 5.8775 5.8775 6.1492 6.1492 6.3249 6.3249 6.4203 6.4203 6.6255 6.6255 7.0338 7.0338 7.4444 7.4444 7.6025 7.6025 7.7761 7.7761 7.8163 7.8163 8.2941 8.2941 k = 0.5743-0.3175-0.6161 ( 6956 PWs) bands (ev): -6.4802 -6.4802 -6.3065 -6.3065 -5.3597 -5.3597 -5.1339 -5.1339 -4.5384 -4.5384 -4.4111 -4.4111 -2.1144 -2.1144 -1.6549 -1.6549 -0.6478 -0.6478 -0.0834 -0.0834 1.0051 1.0051 3.1785 3.1785 3.4140 3.4140 3.6465 3.6465 3.7683 3.7683 4.0214 4.0214 4.1020 4.1020 4.3957 4.3957 4.5391 4.5391 4.8784 4.8784 5.0273 5.0273 5.1415 5.1415 5.2036 5.2036 5.3785 5.3785 5.9116 5.9116 6.1907 6.1907 6.3037 6.3037 6.4008 6.4008 6.6515 6.6515 7.0182 7.0182 7.4600 7.4600 7.5796 7.5796 7.7375 7.7375 7.8155 7.8155 8.1826 8.1826 k = 0.5676-0.2841-0.5574 ( 6958 PWs) bands (ev): -6.5057 -6.5057 -6.3312 -6.3312 -5.3880 -5.3880 -5.1592 -5.1592 -4.5562 -4.5562 -4.4372 -4.4372 -2.1167 -2.1167 -1.6631 -1.6631 -0.6158 -0.6158 -0.0580 -0.0580 1.0770 1.0770 3.2809 3.2809 3.4813 3.4813 3.7393 3.7393 3.8721 3.8721 4.0947 4.0947 4.2377 4.2377 4.4443 4.4443 4.5899 4.5899 4.9444 4.9444 5.0858 5.0858 5.1614 5.1614 5.2661 5.2661 5.4243 5.4243 5.9292 5.9292 6.1828 6.1828 6.2896 6.2896 6.4216 6.4216 6.6832 6.6832 7.0046 7.0046 7.4274 7.4274 7.5270 7.5270 7.7145 7.7145 7.8664 7.8664 8.0836 8.0836 k = 0.5608-0.2507-0.4988 ( 6962 PWs) bands (ev): -6.5290 -6.5290 -6.3536 -6.3536 -5.4137 -5.4137 -5.1823 -5.1823 -4.5724 -4.5724 -4.4609 -4.4609 -2.1194 -2.1194 -1.6712 -1.6712 -0.5874 -0.5874 -0.0357 -0.0357 1.1442 1.1442 3.3795 3.3795 3.5395 3.5395 3.8334 3.8334 3.9724 3.9724 4.1742 4.1742 4.3754 4.3754 4.4907 4.4907 4.6403 4.6403 4.9926 4.9926 5.1614 5.1614 5.1764 5.1764 5.3264 5.3264 5.4688 5.4688 5.9148 5.9148 6.1365 6.1365 6.2845 6.2845 6.4891 6.4891 6.7196 6.7196 6.9944 6.9944 7.3365 7.3365 7.4565 7.4565 7.7337 7.7337 7.9275 7.9275 8.0016 8.0016 k = 0.5541-0.2172-0.4401 ( 6958 PWs) bands (ev): -6.5498 -6.5498 -6.3737 -6.3737 -5.4367 -5.4367 -5.2030 -5.2030 -4.5869 -4.5869 -4.4821 -4.4821 -2.1222 -2.1222 -1.6789 -1.6789 -0.5623 -0.5623 -0.0164 -0.0164 1.2061 1.2061 3.4696 3.4696 3.5924 3.5924 3.9294 3.9294 4.0652 4.0652 4.2591 4.2591 4.5044 4.5044 4.5466 4.5466 4.6917 4.6917 5.0267 5.0267 5.1853 5.1853 5.2567 5.2567 5.3796 5.3796 5.5104 5.5104 5.8664 5.8664 6.0690 6.0690 6.3022 6.3022 6.5729 6.5729 6.7563 6.7563 6.9895 6.9895 7.2305 7.2305 7.3623 7.3623 7.7767 7.7767 7.9117 7.9117 7.9730 7.9730 k = 0.5473-0.1838-0.3815 ( 6964 PWs) bands (ev): -6.5682 -6.5682 -6.3916 -6.3916 -5.4570 -5.4570 -5.2214 -5.2214 -4.5999 -4.5999 -4.5010 -4.5010 -2.1252 -2.1252 -1.6861 -1.6861 -0.5407 -0.5407 0.0000 0.0000 1.2622 1.2622 3.5408 3.5408 3.6503 3.6503 4.0263 4.0263 4.1477 4.1477 4.3449 4.3449 4.5825 4.5825 4.6499 4.6499 4.7499 4.7499 5.0576 5.0576 5.1954 5.1954 5.3536 5.3536 5.4259 5.4259 5.5491 5.5491 5.7976 5.7976 5.9900 5.9900 6.3321 6.3321 6.6503 6.6503 6.7829 6.7829 6.9912 6.9912 7.1408 7.1408 7.2636 7.2636 7.7829 7.7829 7.8350 7.8350 7.9514 7.9514 k = 0.5405-0.1504-0.3228 ( 6958 PWs) bands (ev): -6.5842 -6.5842 -6.4070 -6.4070 -5.4747 -5.4747 -5.2374 -5.2374 -4.6111 -4.6111 -4.5173 -4.5173 -2.1280 -2.1280 -1.6926 -1.6926 -0.5222 -0.5222 0.0138 0.0138 1.3121 1.3121 3.5846 3.5846 3.7220 3.7220 4.1212 4.1212 4.2193 4.2193 4.4256 4.4256 4.6480 4.6480 4.7415 4.7415 4.8332 4.8332 5.0939 5.0939 5.2021 5.2021 5.4435 5.4435 5.4706 5.4706 5.5843 5.5843 5.7247 5.7247 5.9061 5.9061 6.3564 6.3564 6.6821 6.6821 6.7964 6.7964 6.9916 6.9916 7.0997 7.0997 7.1918 7.1918 7.6424 7.6424 7.8672 7.8672 7.9226 7.9226 k = 0.5338-0.1170-0.2642 ( 6968 PWs) bands (ev): -6.5977 -6.5977 -6.4202 -6.4202 -5.4896 -5.4896 -5.2509 -5.2509 -4.6207 -4.6207 -4.5312 -4.5312 -2.1305 -2.1305 -1.6983 -1.6983 -0.5068 -0.5068 0.0252 0.0252 1.3553 1.3553 3.6091 3.6091 3.7992 3.7992 4.2054 4.2054 4.2870 4.2870 4.4974 4.4974 4.7145 4.7145 4.8041 4.8041 4.9353 4.9353 5.1385 5.1385 5.2077 5.2077 5.4930 5.4930 5.5353 5.5353 5.6039 5.6039 5.6809 5.6809 5.8230 5.8230 6.3563 6.3563 6.6469 6.6469 6.7830 6.7830 6.9934 6.9934 7.1038 7.1038 7.1928 7.1928 7.5002 7.5002 7.8924 7.8924 7.9090 7.9090 k = 0.5270-0.0836-0.2055 ( 6984 PWs) bands (ev): -6.6088 -6.6088 -6.4309 -6.4309 -5.5018 -5.5018 -5.2621 -5.2621 -4.6286 -4.6286 -4.5425 -4.5425 -2.1328 -2.1328 -1.7031 -1.7031 -0.4945 -0.4945 0.0342 0.0342 1.3913 1.3913 3.6236 3.6236 3.8719 3.8719 4.2625 4.2625 4.3670 4.3670 4.5598 4.5598 4.7656 4.7656 4.8674 4.8674 5.0233 5.0233 5.1693 5.1693 5.2359 5.2359 5.5078 5.5078 5.5542 5.5542 5.6293 5.6293 5.7073 5.7073 5.7543 5.7543 6.3122 6.3122 6.5980 6.5980 6.7117 6.7117 7.0114 7.0114 7.1337 7.1337 7.2469 7.2469 7.3899 7.3899 7.9019 7.9019 7.9163 7.9163 k = 0.5203-0.0502-0.1469 ( 6974 PWs) bands (ev): -6.6175 -6.6175 -6.4393 -6.4393 -5.5113 -5.5113 -5.2707 -5.2707 -4.6347 -4.6347 -4.5514 -4.5514 -2.1346 -2.1346 -1.7069 -1.7069 -0.4850 -0.4850 0.0411 0.0411 1.4198 1.4198 3.6324 3.6324 3.9342 3.9342 4.2940 4.2940 4.4592 4.4592 4.6126 4.6126 4.7928 4.7928 4.9307 4.9307 5.0809 5.0809 5.1763 5.1763 5.2960 5.2960 5.4710 5.4710 5.5828 5.5828 5.6579 5.6579 5.6853 5.6853 5.8000 5.8000 6.2268 6.2268 6.5570 6.5570 6.6164 6.6164 7.0229 7.0229 7.1571 7.1571 7.3047 7.3047 7.3579 7.3579 7.9143 7.9143 7.9260 7.9260 k = 0.5135-0.0168-0.0882 ( 6978 PWs) bands (ev): -6.6237 -6.6237 -6.4453 -6.4453 -5.5181 -5.5181 -5.2769 -5.2769 -4.6391 -4.6391 -4.5577 -4.5577 -2.1360 -2.1360 -1.7097 -1.7097 -0.4782 -0.4782 0.0460 0.0460 1.4404 1.4404 3.6375 3.6375 3.9820 3.9820 4.3112 4.3112 4.5532 4.5532 4.6538 4.6538 4.7980 4.7980 4.9683 4.9683 5.1090 5.1090 5.1964 5.1964 5.3432 5.3432 5.4421 5.4421 5.6093 5.6093 5.6301 5.6301 5.7180 5.7180 5.8837 5.8837 6.1252 6.1252 6.5096 6.5096 6.5282 6.5282 7.0069 7.0069 7.1764 7.1764 7.3541 7.3541 7.3915 7.3915 7.8697 7.8697 7.9473 7.9473 k = 0.5068 0.0166-0.0296 ( 6982 PWs) bands (ev): -6.6274 -6.6274 -6.4489 -6.4489 -5.5222 -5.5222 -5.2807 -5.2807 -4.6417 -4.6417 -4.5615 -4.5615 -2.1368 -2.1368 -1.7114 -1.7114 -0.4742 -0.4742 0.0488 0.0488 1.4529 1.4529 3.6402 3.6402 4.0121 4.0121 4.3197 4.3197 4.6424 4.6424 4.6802 4.6802 4.7758 4.7758 4.9731 4.9731 5.1316 5.1316 5.2192 5.2192 5.3511 5.3511 5.4450 5.4450 5.5789 5.5789 5.6760 5.6760 5.7467 5.7467 5.9581 5.9581 6.0354 6.0354 6.4444 6.4444 6.4787 6.4787 6.9821 6.9821 7.2092 7.2092 7.3947 7.3947 7.4177 7.4177 7.8052 7.8052 7.9741 7.9741 k = 0.5000 0.0501 0.0291 ( 6972 PWs) bands (ev): -6.6286 -6.6286 -6.4501 -6.4501 -5.5236 -5.5236 -5.2819 -5.2819 -4.6426 -4.6426 -4.5627 -4.5627 -2.1371 -2.1371 -1.7119 -1.7119 -0.4729 -0.4729 0.0498 0.0498 1.4571 1.4571 3.6411 3.6411 4.0223 4.0223 4.3223 4.3223 4.6891 4.6891 4.7107 4.7107 4.7307 4.7307 4.9710 4.9710 5.1421 5.1421 5.2282 5.2282 5.3467 5.3467 5.4522 5.4522 5.5681 5.5681 5.7008 5.7008 5.7579 5.7579 5.9907 5.9907 5.9953 5.9953 6.4139 6.4139 6.4605 6.4605 6.9723 6.9723 7.2262 7.2262 7.4125 7.4125 7.4221 7.4221 7.7808 7.7808 7.9831 7.9831 k = 0.5000 0.0501 0.0291 ( 6972 PWs) bands (ev): -6.6286 -6.6286 -6.4501 -6.4501 -5.5236 -5.5236 -5.2819 -5.2819 -4.6426 -4.6426 -4.5627 -4.5627 -2.1371 -2.1371 -1.7119 -1.7119 -0.4729 -0.4729 0.0498 0.0498 1.4571 1.4571 3.6411 3.6411 4.0223 4.0223 4.3223 4.3223 4.6891 4.6891 4.7107 4.7107 4.7307 4.7307 4.9710 4.9710 5.1421 5.1421 5.2282 5.2282 5.3467 5.3467 5.4522 5.4522 5.5681 5.5681 5.7008 5.7008 5.7579 5.7579 5.9907 5.9907 5.9953 5.9953 6.4139 6.4139 6.4605 6.4605 6.9723 6.9723 7.2262 7.2262 7.4125 7.4125 7.4221 7.4221 7.7808 7.7808 7.9831 7.9831 k = 0.4375 0.0438 0.0255 ( 6987 PWs) bands (ev): -6.6287 -6.6287 -6.4500 -6.4500 -5.5265 -5.5265 -5.2759 -5.2759 -4.6658 -4.6658 -4.5421 -4.5421 -2.1478 -2.1478 -1.6951 -1.6951 -0.4951 -0.4951 0.0690 0.0690 1.4520 1.4520 3.6450 3.6450 4.0212 4.0212 4.3239 4.3239 4.6891 4.6891 4.7107 4.7107 4.7254 4.7254 4.9692 4.9692 5.1417 5.1417 5.2281 5.2281 5.3521 5.3521 5.4536 5.4536 5.5686 5.5686 5.6959 5.6959 5.7637 5.7637 5.9890 5.9890 5.9915 5.9915 6.4159 6.4159 6.4616 6.4616 6.9721 6.9721 7.2291 7.2291 7.3662 7.3662 7.4703 7.4703 7.7822 7.7822 7.9380 7.9380 k = 0.3750 0.0375 0.0218 ( 6987 PWs) bands (ev): -6.6289 -6.6289 -6.4495 -6.4495 -5.5343 -5.5343 -5.2588 -5.2588 -4.7096 -4.7096 -4.5059 -4.5059 -2.1752 -2.1752 -1.6495 -1.6495 -0.5535 -0.5535 0.1182 0.1182 1.4373 1.4373 3.6565 3.6565 4.0176 4.0176 4.3285 4.3285 4.6891 4.6891 4.7098 4.7098 4.7107 4.7107 4.9647 4.9647 5.1394 5.1394 5.2299 5.2299 5.3639 5.3639 5.4595 5.4595 5.5702 5.5702 5.6848 5.6848 5.7775 5.7775 5.9806 5.9806 5.9838 5.9838 6.4213 6.4213 6.4649 6.4649 6.9715 6.9715 7.2374 7.2374 7.3182 7.3182 7.5241 7.5241 7.7862 7.7862 7.8764 7.8764 k = 0.3125 0.0313 0.0182 ( 6984 PWs) bands (ev): -6.6291 -6.6291 -6.4489 -6.4489 -5.5448 -5.5448 -5.2330 -5.2330 -4.7582 -4.7582 -4.4701 -4.4701 -2.2101 -2.2101 -1.5840 -1.5840 -0.6338 -0.6338 0.1821 0.1821 1.4147 1.4147 3.6743 3.6743 4.0119 4.0119 4.3362 4.3362 4.6856 4.6856 4.6891 4.6891 4.7108 4.7108 4.9595 4.9595 5.1345 5.1345 5.2367 5.2367 5.3729 5.3729 5.4737 5.4737 5.5728 5.5728 5.6720 5.6720 5.7949 5.7949 5.9639 5.9639 5.9753 5.9753 6.4292 6.4292 6.4699 6.4699 6.9709 6.9709 7.2507 7.2507 7.2738 7.2738 7.5783 7.5783 7.7924 7.7924 7.8169 7.8169 k = 0.2500 0.0250 0.0145 ( 6996 PWs) bands (ev): -6.6294 -6.6294 -6.4482 -6.4482 -5.5557 -5.5557 -5.2008 -5.2008 -4.8083 -4.8083 -4.4383 -4.4383 -2.2452 -2.2452 -1.5056 -1.5056 -0.7258 -0.7258 0.2490 0.2490 1.3868 1.3868 3.6961 3.6961 4.0043 4.0043 4.3467 4.3467 4.6554 4.6554 4.6891 4.6891 4.7108 4.7108 4.9549 4.9549 5.1278 5.1278 5.2484 5.2484 5.3736 5.3736 5.4973 5.4973 5.5762 5.5762 5.6593 5.6593 5.8140 5.8140 5.9430 5.9430 5.9640 5.9640 6.4383 6.4383 6.4758 6.4758 6.9704 6.9704 7.2342 7.2342 7.2679 7.2679 7.6318 7.6318 7.7616 7.7616 7.8002 7.8002 k = 0.1875 0.0188 0.0109 ( 7003 PWs) bands (ev): -6.6297 -6.6297 -6.4475 -6.4475 -5.5656 -5.5656 -5.1643 -5.1643 -4.8581 -4.8581 -4.4120 -4.4120 -2.2761 -2.2761 -1.4186 -1.4186 -0.8238 -0.8238 0.3108 0.3108 1.3573 1.3573 3.7194 3.7194 3.9954 3.9954 4.3596 4.3596 4.6230 4.6230 4.6891 4.6891 4.7108 4.7108 4.9516 4.9516 5.1211 5.1211 5.2630 5.2630 5.3674 5.3674 5.5255 5.5255 5.5805 5.5805 5.6476 5.6476 5.8338 5.8338 5.9206 5.9206 5.9502 5.9502 6.4471 6.4471 6.4818 6.4818 6.9705 6.9705 7.2006 7.2006 7.2872 7.2872 7.6834 7.6834 7.7127 7.7127 7.8092 7.8092 k = 0.1250 0.0125 0.0073 ( 6979 PWs) bands (ev): -6.6300 -6.6300 -6.4469 -6.4469 -5.5733 -5.5733 -5.1258 -5.1258 -4.9059 -4.9059 -4.3925 -4.3925 -2.2998 -2.2998 -1.3259 -1.3259 -0.9248 -0.9248 0.3611 0.3611 1.3307 1.3307 3.7406 3.7406 3.9865 3.9865 4.3734 4.3734 4.5927 4.5927 4.6891 4.6891 4.7108 4.7108 4.9494 4.9494 5.1157 5.1157 5.2786 5.2786 5.3572 5.3572 5.5522 5.5522 5.5850 5.5850 5.6375 5.6375 5.8537 5.8537 5.8997 5.8997 5.9345 5.9345 6.4544 6.4544 6.4870 6.4870 6.9710 6.9710 7.1746 7.1746 7.3060 7.3060 7.6728 7.6728 7.7303 7.7303 7.8193 7.8193 k = 0.0625 0.0063 0.0036 ( 6976 PWs) bands (ev): -6.6302 -6.6302 -6.4464 -6.4464 -5.5781 -5.5781 -5.0897 -5.0897 -4.9474 -4.9474 -4.3805 -4.3805 -2.3146 -2.3146 -1.2293 -1.2293 -1.0263 -1.0263 0.3941 0.3941 1.3120 1.3120 3.7557 3.7557 3.9796 3.9796 4.3851 4.3851 4.5700 4.5700 4.6891 4.6891 4.7108 4.7108 4.9482 4.9482 5.1121 5.1121 5.2926 5.2926 5.3462 5.3462 5.5716 5.5716 5.5890 5.5890 5.6302 5.6302 5.8727 5.8727 5.8842 5.8842 5.9180 5.9180 6.4592 6.4592 6.4905 6.4905 6.9718 6.9718 7.1580 7.1580 7.3204 7.3204 7.6459 7.6459 7.7653 7.7653 7.8326 7.8326 k = 0.0000 0.0000 0.0000 ( 6973 PWs) bands (ev): -6.6302 -6.6302 -6.4463 -6.4463 -5.5797 -5.5797 -5.0713 -5.0713 -4.9677 -4.9677 -4.3764 -4.3764 -2.3197 -2.3197 -1.1415 -1.1415 -1.1158 -1.1158 0.4057 0.4057 1.3053 1.3053 3.7613 3.7613 3.9769 3.9769 4.3900 4.3900 4.5614 4.5614 4.6891 4.6891 4.7108 4.7108 4.9478 4.9478 5.1109 5.1109 5.2993 5.2993 5.3405 5.3405 5.5787 5.5787 5.5907 5.5907 5.6274 5.6274 5.8785 5.8785 5.8843 5.8843 5.9072 5.9072 6.4608 6.4608 6.4917 6.4917 6.9721 6.9721 7.1522 7.1522 7.3258 7.3258 7.6362 7.6362 7.7781 7.7781 7.8434 7.8434 k = 0.0000 0.0000 0.0000 ( 6973 PWs) bands (ev): -6.6302 -6.6302 -6.4463 -6.4463 -5.5797 -5.5797 -5.0713 -5.0713 -4.9677 -4.9677 -4.3764 -4.3764 -2.3197 -2.3197 -1.1415 -1.1415 -1.1158 -1.1158 0.4057 0.4057 1.3053 1.3053 3.7613 3.7613 3.9769 3.9769 4.3900 4.3900 4.5614 4.5614 4.6891 4.6891 4.7108 4.7108 4.9478 4.9478 5.1109 5.1109 5.2993 5.2993 5.3405 5.3405 5.5787 5.5787 5.5907 5.5907 5.6274 5.6274 5.8785 5.8785 5.8843 5.8843 5.9072 5.9072 6.4608 6.4608 6.4917 6.4917 6.9721 6.9721 7.1522 7.1522 7.3258 7.3258 7.6362 7.6362 7.7781 7.7781 7.8434 7.8434 k = 0.0067-0.0331-0.0581 ( 6979 PWs) bands (ev): -6.6290 -6.6290 -6.4451 -6.4451 -5.5784 -5.5784 -5.0700 -5.0700 -4.9667 -4.9667 -4.3754 -4.3754 -2.3191 -2.3191 -1.1415 -1.1415 -1.1160 -1.1160 0.4033 0.4033 1.3025 1.3025 3.7571 3.7571 3.9678 3.9678 4.3860 4.3860 4.5449 4.5449 4.6910 4.6910 4.6983 4.6983 4.9546 4.9546 5.1057 5.1057 5.2858 5.2858 5.3250 5.3250 5.5422 5.5422 5.6026 5.6026 5.6433 5.6433 5.8616 5.8616 5.8814 5.8814 5.9299 5.9299 6.4889 6.4889 6.5074 6.5074 6.9742 6.9742 7.1318 7.1318 7.3305 7.3305 7.6223 7.6223 7.7681 7.7681 7.8657 7.8657 k = 0.0134-0.0662-0.1161 ( 6983 PWs) bands (ev): -6.6254 -6.6254 -6.4416 -6.4416 -5.5744 -5.5744 -5.0662 -5.0662 -4.9637 -4.9637 -4.3723 -4.3723 -2.3176 -2.3176 -1.1416 -1.1416 -1.1167 -1.1167 0.3959 0.3959 1.2942 1.2942 3.7446 3.7446 3.9414 3.9414 4.3732 4.3732 4.5012 4.5012 4.6485 4.6485 4.7119 4.7119 4.9608 4.9608 5.0972 5.0972 5.2432 5.2432 5.2851 5.2851 5.5124 5.5124 5.5565 5.5565 5.7148 5.7148 5.8104 5.8104 5.8490 5.8490 6.0155 6.0155 6.5245 6.5245 6.5742 6.5742 6.9822 6.9822 7.0890 7.0890 7.3400 7.3400 7.5954 7.5954 7.7352 7.7352 7.8903 7.8903 k = 0.0201-0.0992-0.1742 ( 6977 PWs) bands (ev): -6.6193 -6.6193 -6.4358 -6.4358 -5.5678 -5.5678 -5.0597 -5.0597 -4.9586 -4.9586 -4.3672 -4.3672 -2.3150 -2.3150 -1.1417 -1.1417 -1.1180 -1.1180 0.3837 0.3837 1.2804 1.2804 3.7240 3.7240 3.9002 3.9002 4.3491 4.3491 4.4366 4.4366 4.5979 4.5979 4.7201 4.7201 4.9423 4.9423 5.0982 5.0982 5.1717 5.1717 5.2386 5.2386 5.4887 5.4887 5.5154 5.5154 5.7342 5.7342 5.7945 5.7945 5.8208 5.8208 6.1220 6.1220 6.5436 6.5436 6.6579 6.6579 6.9969 6.9969 7.0613 7.0613 7.3539 7.3539 7.5772 7.5772 7.6826 7.6826 7.8534 7.8534 k = 0.0268-0.1323-0.2322 ( 6981 PWs) bands (ev): -6.6108 -6.6108 -6.4276 -6.4276 -5.5585 -5.5585 -5.0507 -5.0507 -4.9516 -4.9516 -4.3601 -4.3601 -2.3114 -2.3114 -1.1419 -1.1419 -1.1198 -1.1198 0.3667 0.3667 1.2609 1.2609 3.6955 3.6955 3.8475 3.8475 4.3088 4.3088 4.3586 4.3586 4.5489 4.5489 4.7116 4.7116 4.8961 4.8961 5.0456 5.0456 5.1443 5.1443 5.1984 5.1984 5.4615 5.4615 5.4910 5.4910 5.6728 5.6728 5.7467 5.7467 5.9019 5.9019 6.2343 6.2343 6.5434 6.5434 6.7084 6.7084 7.0192 7.0192 7.0803 7.0803 7.3823 7.3823 7.5717 7.5717 7.6246 7.6246 7.7852 7.7852 k = 0.0334-0.1654-0.2903 ( 6971 PWs) bands (ev): -6.6000 -6.6000 -6.4170 -6.4170 -5.5465 -5.5465 -5.0392 -5.0392 -4.9426 -4.9426 -4.3510 -4.3510 -2.3068 -2.3068 -1.1423 -1.1423 -1.1224 -1.1224 0.3449 0.3449 1.2357 1.2357 3.6586 3.6586 3.7866 3.7866 4.2399 4.2399 4.2849 4.2849 4.5016 4.5016 4.6789 4.6789 4.8342 4.8342 4.9308 4.9308 5.1646 5.1646 5.1790 5.1790 5.4292 5.4292 5.4815 5.4815 5.6055 5.6055 5.6929 5.6929 5.9840 5.9840 6.3441 6.3441 6.5336 6.5336 6.7057 6.7057 7.0625 7.0625 7.1299 7.1299 7.4317 7.4317 7.5252 7.5252 7.6282 7.6282 7.7104 7.7104 k = 0.0401-0.1985-0.3484 ( 6963 PWs) bands (ev): -6.5867 -6.5867 -6.4042 -6.4042 -5.5318 -5.5318 -5.0251 -5.0251 -4.9317 -4.9317 -4.3399 -4.3399 -2.3015 -2.3015 -1.1430 -1.1430 -1.1258 -1.1258 0.3185 0.3185 1.2047 1.2047 3.6116 3.6116 3.7217 3.7217 4.1469 4.1469 4.2171 4.2171 4.4522 4.4522 4.6218 4.6218 4.7599 4.7599 4.8141 4.8141 5.1554 5.1554 5.2058 5.2058 5.3934 5.3934 5.4795 5.4795 5.5338 5.5338 5.6429 5.6429 6.0455 6.0455 6.4426 6.4426 6.5336 6.5336 6.6755 6.6755 7.1004 7.1004 7.1922 7.1922 7.4322 7.4322 7.5021 7.5021 7.6468 7.6468 7.7104 7.7104 k = 0.0468-0.2315-0.4064 ( 6965 PWs) bands (ev): -6.5710 -6.5710 -6.3891 -6.3891 -5.5146 -5.5146 -5.0085 -5.0085 -4.9189 -4.9189 -4.3267 -4.3267 -2.2953 -2.2953 -1.1441 -1.1441 -1.1302 -1.1302 0.2875 0.2875 1.1678 1.1678 3.5511 3.5511 3.6580 3.6580 4.0475 4.0475 4.1427 4.1427 4.3947 4.3947 4.5462 4.5462 4.6564 4.6564 4.7306 4.7306 5.1469 5.1469 5.2318 5.2318 5.3486 5.3486 5.4441 5.4441 5.4965 5.4965 5.6054 5.6054 6.0752 6.0752 6.5109 6.5109 6.5567 6.5567 6.6502 6.6502 7.1247 7.1247 7.2473 7.2473 7.3696 7.3696 7.4693 7.4693 7.7203 7.7203 7.8073 7.8073 k = 0.0535-0.2646-0.4645 ( 6971 PWs) bands (ev): -6.5529 -6.5529 -6.3717 -6.3717 -5.4947 -5.4947 -4.9893 -4.9893 -4.9042 -4.9042 -4.3116 -4.3116 -2.2885 -2.2885 -1.1457 -1.1457 -1.1358 -1.1358 0.2521 0.2521 1.1250 1.1250 3.4756 3.4756 3.5986 3.5986 3.9475 3.9475 4.0611 4.0611 4.3206 4.3206 4.4615 4.4615 4.5447 4.5447 4.6714 4.6714 5.1337 5.1337 5.2459 5.2459 5.2892 5.2892 5.3578 5.3578 5.5124 5.5124 5.5901 5.5901 6.0759 6.0759 6.5108 6.5108 6.6092 6.6092 6.6509 6.6509 7.1435 7.1435 7.2764 7.2764 7.3294 7.3294 7.4213 7.4213 7.8528 7.8528 7.9343 7.9343 k = 0.0602-0.2977-0.5225 ( 6965 PWs) bands (ev): -6.5325 -6.5325 -6.3520 -6.3520 -5.4722 -5.4722 -4.9677 -4.9677 -4.8877 -4.8877 -4.2945 -4.2945 -2.2812 -2.2812 -1.1484 -1.1484 -1.1424 -1.1424 0.2125 0.2125 1.0763 1.0763 3.3878 3.3878 3.5412 3.5412 3.8486 3.8486 3.9744 3.9744 4.2238 4.2238 4.3742 4.3742 4.4493 4.4493 4.6202 4.6202 5.1084 5.1084 5.2127 5.2127 5.2343 5.2343 5.2777 5.2777 5.5408 5.5408 5.5987 5.5987 6.0598 6.0598 6.4731 6.4731 6.6380 6.6380 6.6669 6.6669 7.1589 7.1589 7.2711 7.2711 7.3405 7.3405 7.4082 7.4082 8.0032 8.0032 8.0708 8.0708 k = 0.0669-0.3308-0.5806 ( 6961 PWs) bands (ev): -6.5097 -6.5097 -6.3301 -6.3301 -5.4470 -5.4470 -4.9435 -4.9435 -4.8694 -4.8694 -4.2754 -4.2754 -2.2735 -2.2735 -1.1543 -1.1543 -1.1484 -1.1484 0.1690 0.1690 1.0217 1.0217 3.2920 3.2920 3.4816 3.4816 3.7521 3.7521 3.8842 3.8842 4.1094 4.1094 4.2875 4.2875 4.3718 4.3718 4.5728 4.5728 5.0613 5.0613 5.1243 5.1243 5.1626 5.1626 5.2505 5.2505 5.5789 5.5789 5.6245 5.6245 6.0364 6.0364 6.4228 6.4228 6.6102 6.6102 6.6791 6.6791 7.1720 7.1720 7.2844 7.2844 7.3832 7.3832 7.4273 7.4273 8.1406 8.1406 8.1800 8.1800 k = 0.0736-0.3638-0.6387 ( 6961 PWs) bands (ev): -6.4846 -6.4846 -6.3060 -6.3060 -5.4193 -5.4193 -4.9169 -4.9169 -4.8494 -4.8494 -4.2544 -4.2544 -2.2657 -2.2657 -1.1645 -1.1645 -1.1529 -1.1529 0.1217 0.1217 0.9615 0.9615 3.1915 3.1915 3.4160 3.4160 3.6588 3.6588 3.7917 3.7917 3.9887 3.9887 4.2062 4.2062 4.3027 4.3027 4.5271 4.5271 4.9859 4.9859 5.0162 5.0162 5.1037 5.1037 5.2280 5.2280 5.6223 5.6223 5.6616 5.6616 6.0105 6.0105 6.3617 6.3617 6.5644 6.5644 6.6474 6.6474 7.1928 7.1928 7.3316 7.3316 7.4295 7.4295 7.4815 7.4815 8.1396 8.1396 8.3298 8.3298 k = 0.0803-0.3969-0.6967 ( 6951 PWs) bands (ev): -6.4572 -6.4572 -6.2796 -6.2796 -5.3890 -5.3890 -4.8878 -4.8878 -4.8277 -4.8277 -4.2315 -4.2315 -2.2579 -2.2579 -1.1778 -1.1778 -1.1578 -1.1578 0.0711 0.0711 0.8959 0.8959 3.0886 3.0886 3.3417 3.3417 3.5682 3.5682 3.6973 3.6973 3.8718 3.8718 4.1333 4.1333 4.2346 4.2346 4.4814 4.4814 4.8910 4.8910 4.9037 4.9037 5.0553 5.0553 5.1988 5.1988 5.6650 5.6650 5.7074 5.7074 5.9836 5.9836 6.2877 6.2877 6.5177 6.5177 6.5823 6.5823 7.2174 7.2174 7.4060 7.4060 7.4650 7.4650 7.5693 7.5693 8.0989 8.0989 8.4346 8.4346 k = 0.0870-0.4300-0.7548 ( 6947 PWs) bands (ev): -6.4275 -6.4275 -6.2512 -6.2512 -5.3561 -5.3561 -4.8562 -4.8562 -4.8045 -4.8045 -4.2066 -4.2066 -2.2503 -2.2503 -1.1939 -1.1939 -1.1638 -1.1638 0.0174 0.0174 0.8250 0.8250 2.9849 2.9849 3.2584 3.2584 3.4782 3.4782 3.5996 3.5996 3.7671 3.7671 4.0691 4.0691 4.1641 4.1641 4.4344 4.4344 4.7740 4.7740 4.8075 4.8075 5.0069 5.0069 5.1630 5.1630 5.7025 5.7025 5.7593 5.7593 5.9560 5.9560 6.2025 6.2025 6.4771 6.4771 6.5023 6.5023 7.2411 7.2411 7.4703 7.4703 7.5275 7.5275 7.6641 7.6641 8.0538 8.0538 8.4178 8.4178 k = 0.0936-0.4631-0.8129 ( 6943 PWs) bands (ev): -6.3956 -6.3956 -6.2206 -6.2206 -5.3207 -5.3207 -4.8223 -4.8223 -4.7798 -4.7798 -4.1799 -4.1799 -2.2432 -2.2432 -1.2132 -1.2132 -1.1711 -1.1711 -0.0391 -0.0391 0.7494 0.7494 2.8817 2.8817 3.1678 3.1678 3.3864 3.3864 3.4967 3.4967 3.6806 3.6806 4.0115 4.0115 4.0909 4.0909 4.3847 4.3847 4.6524 4.6524 4.7192 4.7192 4.9559 4.9559 5.1205 5.1205 5.7323 5.7323 5.8117 5.8117 5.9281 5.9281 6.1128 6.1128 6.4164 6.4164 6.4464 6.4464 7.2644 7.2644 7.5043 7.5043 7.6238 7.6238 7.7493 7.7493 8.0223 8.0223 8.3658 8.3658 k = 0.1003-0.4961-0.8709 ( 6939 PWs) bands (ev): -6.3614 -6.3614 -6.1879 -6.1879 -5.2828 -5.2828 -4.7860 -4.7860 -4.7537 -4.7537 -4.1513 -4.1513 -2.2369 -2.2369 -1.2359 -1.2359 -1.1798 -1.1798 -0.0980 -0.0980 0.6692 0.6692 2.7798 2.7798 3.0725 3.0725 3.2922 3.2922 3.3898 3.3898 3.6109 3.6109 3.9555 3.9555 4.0183 4.0183 4.3301 4.3301 4.5331 4.5331 4.6385 4.6385 4.9023 4.9023 5.0715 5.0715 5.7494 5.7494 5.8494 5.8494 5.9059 5.9059 6.0327 6.0327 6.3375 6.3375 6.4181 6.4181 7.2881 7.2881 7.5330 7.5330 7.6988 7.6988 7.8161 7.8161 8.0341 8.0341 8.2986 8.2986 k = 0.1070-0.5292-0.9290 ( 6937 PWs) bands (ev): -6.3251 -6.3251 -6.1533 -6.1533 -5.2424 -5.2424 -4.7473 -4.7473 -4.7263 -4.7263 -4.1208 -4.1208 -2.2316 -2.2316 -1.2624 -1.2624 -1.1902 -1.1902 -0.1589 -0.1589 0.5850 0.5850 2.6799 2.6799 2.9749 2.9749 3.1973 3.1973 3.2828 3.2828 3.5514 3.5514 3.8907 3.8907 3.9556 3.9556 4.2666 4.2666 4.4222 4.4222 4.5666 4.5666 4.8465 4.8465 5.0159 5.0159 5.7436 5.7436 5.8244 5.8244 5.9091 5.9091 5.9992 5.9992 6.2673 6.2673 6.3935 6.3935 7.3126 7.3126 7.5597 7.5597 7.7015 7.7015 7.8939 7.8939 8.0945 8.0945 8.2367 8.2367 k = 0.1137-0.5623-0.9870 ( 6943 PWs) bands (ev): -6.2867 -6.2867 -6.1166 -6.1166 -5.1995 -5.1995 -4.7064 -4.7064 -4.6977 -4.6977 -4.0885 -4.0885 -2.2278 -2.2278 -1.2929 -1.2929 -1.2022 -1.2022 -0.2215 -0.2215 0.4971 0.4971 2.5824 2.5824 2.8766 2.8766 3.1037 3.1037 3.1793 3.1793 3.4946 3.4946 3.8139 3.8139 3.9057 3.9057 4.1876 4.1876 4.3277 4.3277 4.5042 4.5042 4.7898 4.7898 4.9539 4.9539 5.7050 5.7050 5.7571 5.7571 5.9100 5.9100 6.0274 6.0274 6.2096 6.2096 6.3708 6.3708 7.3381 7.3381 7.5801 7.5801 7.6642 7.6642 7.9589 7.9589 8.1532 8.1532 8.2312 8.2312 k = 0.1204-0.5954-1.0451 ( 6931 PWs) bands (ev): -6.2461 -6.2461 -6.0780 -6.0780 -5.1543 -5.1543 -4.6682 -4.6682 -4.6630 -4.6630 -4.0545 -4.0545 -2.2257 -2.2257 -1.3277 -1.3277 -1.2161 -1.2161 -0.2856 -0.2856 0.4059 0.4059 2.4877 2.4877 2.7787 2.7787 3.0135 3.0135 3.0818 3.0818 3.4338 3.4338 3.7341 3.7341 3.8594 3.8594 4.0932 4.0932 4.2523 4.2523 4.4515 4.4515 4.7336 4.7336 4.8858 4.8858 5.6318 5.6318 5.6890 5.6890 5.9131 5.9131 6.0690 6.0690 6.1679 6.1679 6.3489 6.3489 7.3645 7.3645 7.5669 7.5669 7.6473 7.6473 7.9537 7.9537 8.2094 8.2094 8.3098 8.3098 k = 0.1271-0.6284-1.1032 ( 6935 PWs) bands (ev): -6.2035 -6.2035 -6.0376 -6.0376 -5.1066 -5.1066 -4.6375 -4.6375 -4.6176 -4.6176 -4.0186 -4.0186 -2.2257 -2.2257 -1.3669 -1.3669 -1.2318 -1.2318 -0.3510 -0.3510 0.3119 0.3119 2.3961 2.3961 2.6818 2.6818 2.9281 2.9281 2.9918 2.9918 3.3642 3.3642 3.6579 3.6579 3.8075 3.8075 3.9952 3.9952 4.1882 4.1882 4.4083 4.4083 4.6801 4.6801 4.8123 4.8123 5.5418 5.5418 5.6226 5.6226 5.9150 5.9150 6.0893 6.0893 6.1578 6.1578 6.3272 6.3272 7.3915 7.3915 7.5166 7.5166 7.6655 7.6655 7.9038 7.9038 8.2971 8.2971 8.4045 8.4045 k = 0.1338-0.6615-1.1612 ( 6943 PWs) bands (ev): -6.1589 -6.1589 -5.9954 -5.9954 -5.0566 -5.0566 -4.6060 -4.6060 -4.5699 -4.5699 -3.9810 -3.9810 -2.2282 -2.2282 -1.4105 -1.4105 -1.2494 -1.2494 -0.4176 -0.4176 0.2155 0.2155 2.3079 2.3079 2.5865 2.5865 2.8486 2.8486 2.9103 2.9103 3.2835 3.2835 3.5878 3.5878 3.7412 3.7412 3.9066 3.9066 4.1277 4.1277 4.3742 4.3742 4.6313 4.6313 4.7349 4.7349 5.4490 5.4490 5.5532 5.5532 5.9110 5.9110 6.0745 6.0745 6.1857 6.1857 6.3053 6.3053 7.4166 7.4166 7.4644 7.4644 7.6894 7.6894 7.8501 7.8501 8.3900 8.3900 8.4993 8.4993 k = 0.1405-0.6946-1.2193 ( 6933 PWs) bands (ev): -6.1124 -6.1124 -5.9515 -5.9515 -5.0044 -5.0044 -4.5738 -4.5738 -4.5201 -4.5201 -3.9417 -3.9417 -2.2334 -2.2334 -1.4585 -1.4585 -1.2690 -1.2690 -0.4852 -0.4852 0.1169 0.1169 2.2233 2.2233 2.4933 2.4933 2.7756 2.7756 2.8378 2.8378 3.1932 3.1932 3.5228 3.5228 3.6567 3.6567 3.8332 3.8332 4.0663 4.0663 4.3487 4.3487 4.5885 4.5885 4.6567 4.6567 5.3573 5.3573 5.4814 5.4814 5.8983 5.8983 6.0536 6.0536 6.2164 6.2164 6.2835 6.2835 7.4032 7.4032 7.4566 7.4566 7.7071 7.7071 7.8114 7.8114 8.4773 8.4773 8.5903 8.5903 k = 0.1472-0.7277-1.2773 ( 6929 PWs) bands (ev): -6.0640 -6.0640 -5.9059 -5.9059 -4.9500 -4.9500 -4.5411 -4.5411 -4.4682 -4.4682 -3.9007 -3.9007 -2.2417 -2.2417 -1.5108 -1.5108 -1.2906 -1.2906 -0.5538 -0.5538 0.0166 0.0166 2.1428 2.1428 2.4026 2.4026 2.7091 2.7091 2.7745 2.7745 3.0963 3.0963 3.4602 3.4602 3.5602 3.5602 3.7696 3.7696 4.0012 4.0012 4.3292 4.3292 4.5463 4.5463 4.5885 4.5885 5.2681 5.2681 5.4082 5.4082 5.8753 5.8753 6.0340 6.0340 6.2330 6.2330 6.2657 6.2657 7.3649 7.3649 7.4841 7.4841 7.7059 7.7059 7.8038 7.8038 8.5546 8.5546 8.6745 8.6745 k = 0.1538-0.7607-1.3354 ( 6939 PWs) bands (ev): -6.0139 -6.0139 -5.8589 -5.8589 -4.8936 -4.8936 -4.5078 -4.5078 -4.4143 -4.4143 -3.8581 -3.8581 -2.2534 -2.2534 -1.5671 -1.5671 -1.3141 -1.3141 -0.6235 -0.6235 -0.0850 -0.0850 2.0669 2.0669 2.3149 2.3149 2.6490 2.6490 2.7199 2.7199 2.9967 2.9967 3.3974 3.3974 3.4604 3.4604 3.7087 3.7087 3.9308 3.9308 4.3084 4.3084 4.4904 4.4904 4.5535 4.5535 5.1821 5.1821 5.3345 5.3345 5.8414 5.8414 6.0162 6.0162 6.2210 6.2210 6.2615 6.2615 7.3375 7.3375 7.5143 7.5143 7.6930 7.6930 7.8226 7.8226 8.6193 8.6193 8.7473 8.7473 k = 0.1605-0.7938-1.3935 ( 6943 PWs) bands (ev): -5.9620 -5.9620 -5.8104 -5.8104 -4.8353 -4.8353 -4.4741 -4.4741 -4.3584 -4.3584 -3.8139 -3.8139 -2.2686 -2.2686 -1.6271 -1.6271 -1.3397 -1.3397 -0.6942 -0.6942 -0.1878 -0.1878 1.9961 1.9961 2.2308 2.2308 2.5945 2.5945 2.6724 2.6724 2.8982 2.8982 3.3321 3.3321 3.3633 3.3633 3.6468 3.6468 3.8548 3.8548 4.2696 4.2696 4.4486 4.4486 4.5401 4.5401 5.1000 5.1000 5.2606 5.2606 5.7965 5.7965 5.9997 5.9997 6.1951 6.1951 6.2532 6.2532 7.3256 7.3256 7.5453 7.5453 7.6856 7.6856 7.8508 7.8508 8.6683 8.6683 8.8008 8.8008 k = 0.1672-0.8269-1.4515 ( 6945 PWs) bands (ev): -5.9086 -5.9086 -5.7606 -5.7606 -4.7752 -4.7752 -4.4400 -4.4400 -4.3007 -4.3007 -3.7682 -3.7682 -2.2874 -2.2874 -1.6904 -1.6904 -1.3673 -1.3673 -0.7662 -0.7662 -0.2913 -0.2913 1.9309 1.9309 2.1506 2.1506 2.5443 2.5443 2.6280 2.6280 2.8065 2.8065 3.2582 3.2582 3.2775 3.2775 3.5826 3.5826 3.7738 3.7738 4.2029 4.2029 4.4402 4.4402 4.5369 4.5369 5.0229 5.0229 5.1866 5.1866 5.7414 5.7414 5.9838 5.9838 6.1644 6.1644 6.2302 6.2302 7.3310 7.3310 7.5767 7.5767 7.6899 7.6899 7.8821 7.8821 8.6967 8.6967 8.8237 8.8237 k = 0.1739-0.8600-1.5096 ( 6937 PWs) bands (ev): -5.8537 -5.8537 -5.7097 -5.7097 -4.7137 -4.7137 -4.4054 -4.4054 -4.2411 -4.2411 -3.7210 -3.7210 -2.3099 -2.3099 -1.7565 -1.7565 -1.3971 -1.3971 -0.8393 -0.8393 -0.3953 -0.3953 1.8719 1.8719 2.0750 2.0750 2.4967 2.4967 2.5777 2.5777 2.7319 2.7319 3.1760 3.1760 3.2051 3.2051 3.5162 3.5162 3.6888 3.6888 4.1192 4.1192 4.4552 4.4552 4.5392 4.5392 4.9528 4.9528 5.1128 5.1128 5.6773 5.6773 5.9681 5.9681 6.1296 6.1296 6.1927 6.1927 7.3535 7.3535 7.6086 7.6086 7.7062 7.7062 7.9143 7.9143 8.6983 8.6983 8.8095 8.8095 k = 0.1806-0.8930-1.5676 ( 6925 PWs) bands (ev): -5.7974 -5.7974 -5.6577 -5.6577 -4.6511 -4.6511 -4.3701 -4.3701 -4.1799 -4.1799 -3.6724 -3.6724 -2.3360 -2.3360 -1.8249 -1.8249 -1.4291 -1.4291 -0.9137 -0.9137 -0.4996 -0.4996 1.8195 1.8195 2.0043 2.0043 2.4483 2.4483 2.5124 2.5124 2.6854 2.6854 3.0995 3.0995 3.1346 3.1346 3.4478 3.4478 3.6012 3.6012 4.0287 4.0287 4.4821 4.4821 4.5425 4.5425 4.8933 4.8933 5.0393 5.0393 5.6055 5.6055 5.9520 5.9520 6.0887 6.0887 6.1453 6.1453 7.3913 7.3913 7.6409 7.6409 7.7337 7.7337 7.9466 7.9466 8.6715 8.6715 8.7635 8.7635 k = 0.1873-0.9261-1.6257 ( 6937 PWs) bands (ev): -5.7399 -5.7399 -5.6049 -5.6049 -4.5882 -4.5882 -4.3339 -4.3339 -4.1170 -4.1170 -3.6225 -3.6225 -2.3655 -2.3655 -1.8952 -1.8952 -1.4634 -1.4634 -0.9893 -0.9893 -0.6038 -0.6038 1.7739 1.7739 1.9391 1.9391 2.3914 2.3914 2.4406 2.4406 2.6640 2.6640 3.0333 3.0333 3.0638 3.0638 3.3779 3.3779 3.5122 3.5122 3.9357 3.9357 4.5068 4.5068 4.5480 4.5480 4.8504 4.8504 4.9666 4.9666 5.5275 5.5275 5.9352 5.9352 6.0374 6.0374 6.0955 6.0955 7.4419 7.4419 7.6739 7.6739 7.7708 7.7708 7.9784 7.9784 8.6215 8.6215 8.6965 8.6965 k = 0.1940-0.9592-1.6838 ( 6923 PWs) bands (ev): -5.6813 -5.6813 -5.5514 -5.5514 -4.5257 -4.5257 -4.2958 -4.2958 -4.0526 -4.0526 -3.5714 -3.5714 -2.3982 -2.3982 -1.9669 -1.9669 -1.5002 -1.5002 -1.0660 -1.0660 -0.7079 -0.7079 1.7350 1.7350 1.8800 1.8800 2.3164 2.3164 2.3796 2.3796 2.6579 2.6579 2.9770 2.9770 2.9957 2.9957 3.3072 3.3072 3.4230 3.4230 3.8426 3.8426 4.4971 4.4971 4.5770 4.5770 4.8298 4.8298 4.8961 4.8961 5.4447 5.4447 5.9171 5.9171 5.9736 5.9736 6.0490 6.0490 7.5028 7.5028 7.7070 7.7070 7.8162 7.8162 8.0093 8.0093 8.5563 8.5563 8.6175 8.6175 k = 0.2007-0.9923-1.7418 ( 6931 PWs) bands (ev): -5.6218 -5.6218 -5.4974 -5.4974 -4.4652 -4.4652 -4.2548 -4.2548 -3.9868 -3.9868 -3.5192 -3.5192 -2.4336 -2.4336 -2.0395 -2.0395 -1.5395 -1.5395 -1.1438 -1.1438 -0.8115 -0.8115 1.7022 1.7022 1.8278 1.8278 2.2319 2.2319 2.3248 2.3248 2.6603 2.6603 2.9160 2.9160 2.9468 2.9468 3.2362 3.2362 3.3353 3.3353 3.7505 3.7505 4.4587 4.4587 4.6174 4.6174 4.8197 4.8197 4.8430 4.8430 5.3584 5.3584 5.8913 5.8913 5.9078 5.9078 6.0049 6.0049 7.5713 7.5713 7.7401 7.7401 7.8686 7.8686 8.0389 8.0389 8.4821 8.4821 8.5324 8.5324 k = 0.2074-1.0253-1.7999 ( 6923 PWs) bands (ev): -5.5616 -5.5616 -5.4432 -5.4432 -4.4085 -4.4085 -4.2091 -4.2091 -3.9196 -3.9196 -3.4661 -3.4661 -2.4715 -2.4715 -2.1125 -2.1125 -1.5814 -1.5814 -1.2226 -1.2226 -0.9144 -0.9144 1.6744 1.6744 1.7838 1.7838 2.1474 2.1474 2.2695 2.2695 2.6648 2.6648 2.8514 2.8514 2.9181 2.9181 3.1657 3.1657 3.2513 3.2513 3.6606 3.6606 4.4055 4.4055 4.6443 4.6443 4.7790 4.7790 4.8567 4.8567 5.2699 5.2699 5.8219 5.8219 5.8806 5.8806 5.9611 5.9611 7.6448 7.6448 7.7729 7.7729 7.9261 7.9261 8.0669 8.0669 8.4038 8.4038 8.4452 8.4452 k = 0.2140-1.0584-1.8579 ( 6919 PWs) bands (ev): -5.5010 -5.5010 -5.3889 -5.3889 -4.3575 -4.3575 -4.1570 -4.1570 -3.8513 -3.8513 -3.4122 -3.4122 -2.5112 -2.5112 -2.1855 -2.1855 -1.6259 -1.6259 -1.3021 -1.3021 -1.0165 -1.0165 1.6496 1.6496 1.7493 1.7493 2.0668 2.0668 2.2125 2.2125 2.6596 2.6596 2.7991 2.7991 2.8998 2.8998 3.0956 3.0956 3.1752 3.1752 3.5739 3.5739 4.3444 4.3444 4.6207 4.6207 4.7854 4.7854 4.8861 4.8861 5.1807 5.1807 5.7466 5.7466 5.8581 5.8581 5.9169 5.9169 7.7193 7.7193 7.8067 7.8067 7.9847 7.9847 8.0938 8.0938 8.3257 8.3257 8.3600 8.3600 k = 0.2207-1.0915-1.9160 ( 6923 PWs) bands (ev): -5.4402 -5.4402 -5.3348 -5.3348 -4.3135 -4.3135 -4.0974 -4.0974 -3.7820 -3.7820 -3.3577 -3.3577 -2.5523 -2.5523 -2.2581 -2.2581 -1.6730 -1.6730 -1.3822 -1.3822 -1.1177 -1.1177 1.6257 1.6257 1.7246 1.7246 1.9929 1.9929 2.1547 2.1547 2.6270 2.6270 2.7731 2.7731 2.8857 2.8857 3.0253 3.0253 3.1152 3.1152 3.4919 3.4919 4.2797 4.2797 4.5609 4.5609 4.8256 4.8256 4.9208 4.9208 5.0937 5.0937 5.6752 5.6752 5.8333 5.8333 5.8730 5.8730 7.7838 7.7838 7.8476 7.8476 8.0319 8.0319 8.1250 8.1250 8.2517 8.2517 8.2858 8.2858 k = 0.2274-1.1246-1.9741 ( 6933 PWs) bands (ev): -5.3795 -5.3795 -5.2813 -5.2813 -4.2760 -4.2760 -4.0308 -4.0308 -3.7118 -3.7118 -3.3027 -3.3027 -2.5942 -2.5942 -2.3299 -2.3299 -1.7225 -1.7225 -1.4627 -1.4627 -1.2176 -1.2176 1.6021 1.6021 1.7069 1.7069 1.9299 1.9299 2.0976 2.0976 2.5700 2.5700 2.7609 2.7609 2.8703 2.8703 2.9567 2.9567 3.0813 3.0813 3.4169 3.4169 4.2138 4.2138 4.4918 4.4918 4.8603 4.8603 4.9564 4.9564 5.0197 5.0197 5.6123 5.6123 5.8030 5.8030 5.8323 5.8323 7.8223 7.8223 7.8985 7.8985 8.0477 8.0477 8.1537 8.1537 8.2023 8.2023 8.2427 8.2427 k = 0.2341-1.1577-2.0321 ( 6935 PWs) bands (ev): -5.3192 -5.3192 -5.2287 -5.2287 -4.2441 -4.2441 -3.9583 -3.9583 -3.6409 -3.6409 -3.2475 -3.2475 -2.6364 -2.6364 -2.4004 -2.4004 -1.7745 -1.7745 -1.5434 -1.5434 -1.3163 -1.3163 1.5796 1.5796 1.6885 1.6885 1.8845 1.8845 2.0428 2.0428 2.5038 2.5038 2.7346 2.7346 2.8398 2.8398 2.9087 2.9087 3.0755 3.0755 3.3528 3.3528 4.1482 4.1482 4.4203 4.4203 4.8453 4.8453 4.9608 4.9608 5.0219 5.0219 5.5634 5.5634 5.7631 5.7631 5.7990 5.7990 7.8370 7.8370 7.9157 7.9157 8.0479 8.0479 8.1256 8.1256 8.2188 8.2188 8.2700 8.2700 k = 0.2408-1.1907-2.0902 ( 6947 PWs) bands (ev): -5.2598 -5.2598 -5.1772 -5.1772 -4.2164 -4.2164 -3.8813 -3.8813 -3.5694 -3.5694 -3.1924 -3.1924 -2.6784 -2.6784 -2.4692 -2.4692 -1.8285 -1.8285 -1.6240 -1.6240 -1.4136 -1.4136 1.5588 1.5588 1.6613 1.6613 1.8632 1.8632 1.9924 1.9924 2.4356 2.4356 2.6883 2.6883 2.7779 2.7779 2.8963 2.8963 3.0911 3.0911 3.3061 3.3061 4.0843 4.0843 4.3484 4.3484 4.7753 4.7753 4.9518 4.9518 5.0794 5.0794 5.5339 5.5339 5.7173 5.7173 5.7700 5.7700 7.8242 7.8242 7.8758 7.8758 8.0247 8.0247 8.1695 8.1695 8.2274 8.2274 8.3481 8.3481 k = 0.2475-1.2238-2.1482 ( 6945 PWs) bands (ev): -5.2017 -5.2017 -5.1273 -5.1273 -4.1920 -4.1920 -3.8007 -3.8007 -3.4976 -3.4976 -3.1375 -3.1375 -2.7195 -2.7195 -2.5360 -2.5360 -1.8845 -1.8845 -1.7044 -1.7044 -1.5093 -1.5093 1.5385 1.5385 1.6264 1.6264 1.8625 1.8625 1.9505 1.9505 2.3681 2.3681 2.6304 2.6304 2.7067 2.7067 2.8846 2.8846 3.1203 3.1203 3.2844 3.2844 4.0232 4.0232 4.2769 4.2769 4.6903 4.6903 4.9306 4.9306 5.1459 5.1459 5.5260 5.5260 5.6704 5.6704 5.7417 5.7417 7.7769 7.7769 7.8164 7.8164 8.0091 8.0091 8.2288 8.2288 8.2650 8.2650 8.4355 8.4355 k = 0.2542-1.2569-2.2063 ( 6949 PWs) bands (ev): -5.1453 -5.1453 -5.0794 -5.0794 -4.1700 -4.1700 -3.7175 -3.7175 -3.4256 -3.4256 -3.0832 -3.0832 -2.7592 -2.7592 -2.6003 -2.6003 -1.9421 -1.9421 -1.7844 -1.7844 -1.6033 -1.6033 1.5148 1.5148 1.5938 1.5938 1.8621 1.8621 1.9309 1.9309 2.3034 2.3034 2.5679 2.5679 2.6355 2.6355 2.8562 2.8562 3.1582 3.1582 3.2913 3.2913 3.9665 3.9665 4.2066 4.2066 4.6028 4.6028 4.8916 4.8916 5.2152 5.2152 5.5335 5.5335 5.6282 5.6282 5.7134 5.7134 7.7102 7.7102 7.7506 7.7506 8.0113 8.0113 8.2430 8.2430 8.3593 8.3593 8.5278 8.5278 k = 0.2609-1.2900-2.2644 ( 6937 PWs) bands (ev): -5.0912 -5.0912 -5.0338 -5.0338 -4.1499 -4.1499 -3.6320 -3.6320 -3.3537 -3.3537 -3.0297 -3.0297 -2.7970 -2.7970 -2.6616 -2.6616 -2.0010 -2.0010 -1.8637 -1.8637 -1.6955 -1.6955 1.4837 1.4837 1.5726 1.5726 1.8422 1.8422 1.9469 1.9469 2.2441 2.2441 2.5043 2.5043 2.5662 2.5662 2.8116 2.8116 3.1999 3.1999 3.3221 3.3221 3.9163 3.9163 4.1382 4.1382 4.5156 4.5156 4.8386 4.8386 5.2845 5.2845 5.5294 5.5294 5.6123 5.6123 5.6854 5.6854 7.6395 7.6395 7.6830 7.6830 8.0212 8.0212 8.2524 8.2524 8.4622 8.4622 8.6239 8.6239 k = 0.2676-1.3230-2.3224 ( 6945 PWs) bands (ev): -5.0400 -5.0400 -4.9910 -4.9910 -4.1312 -4.1312 -3.5448 -3.5448 -3.2822 -3.2822 -2.9774 -2.9774 -2.8323 -2.8323 -2.7194 -2.7194 -2.0610 -2.0610 -1.9422 -1.9422 -1.7859 -1.7859 1.4478 1.4478 1.5626 1.5626 1.8180 1.8180 1.9751 1.9751 2.1965 2.1965 2.4414 2.4414 2.5000 2.5000 2.7571 2.7571 3.2400 3.2400 3.3692 3.3692 3.8755 3.8755 4.0730 4.0730 4.4303 4.4303 4.7767 4.7767 5.3510 5.3510 5.4928 5.4928 5.6336 5.6336 5.6625 5.6625 7.5708 7.5708 7.6182 7.6182 8.0331 8.0331 8.2592 8.2592 8.5688 8.5688 8.7231 8.7231 k = 0.2742-1.3561-2.3805 ( 6961 PWs) bands (ev): -4.9923 -4.9923 -4.9513 -4.9513 -4.1137 -4.1137 -3.4562 -3.4562 -3.2115 -3.2115 -2.9270 -2.9270 -2.8645 -2.8645 -2.7728 -2.7728 -2.1217 -2.1217 -2.0196 -2.0196 -1.8743 -1.8743 1.4120 1.4120 1.5594 1.5594 1.7991 1.7991 1.9899 1.9899 2.1754 2.1754 2.3803 2.3803 2.4380 2.4380 2.6981 2.6981 3.2718 3.2718 3.4256 3.4256 3.8476 3.8476 4.0129 4.0129 4.3480 4.3480 4.7102 4.7102 5.4068 5.4068 5.4503 5.4503 5.6254 5.6254 5.6864 5.6864 7.5072 7.5072 7.5591 7.5591 8.0448 8.0448 8.2633 8.2633 8.6777 8.6777 8.8249 8.8249 k = 0.2809-1.3892-2.4386 ( 6957 PWs) bands (ev): -4.9488 -4.9488 -4.9152 -4.9152 -4.0971 -4.0971 -3.3666 -3.3666 -3.1422 -3.1422 -2.8933 -2.8933 -2.8805 -2.8805 -2.8187 -2.8187 -2.1827 -2.1827 -2.0958 -2.0958 -1.9607 -1.9607 1.3794 1.3794 1.5600 1.5600 1.7880 1.7880 1.9732 1.9732 2.1949 2.1949 2.3219 2.3219 2.3817 2.3817 2.6384 2.6384 3.2896 3.2896 3.4849 3.4849 3.8346 3.8346 3.9626 3.9626 4.2703 4.2703 4.6422 4.6422 5.3868 5.3868 5.4693 5.4693 5.6067 5.6067 5.7299 5.7299 7.4509 7.4509 7.5083 7.5083 8.0550 8.0550 8.2647 8.2647 8.7884 8.7884 8.9288 8.9288 k = 0.2876-1.4223-2.4966 ( 6947 PWs) bands (ev): -4.9100 -4.9100 -4.8830 -4.8830 -4.0812 -4.0812 -3.2762 -3.2762 -3.0764 -3.0764 -2.9162 -2.9162 -2.8755 -2.8755 -2.8200 -2.8200 -2.2438 -2.2438 -2.1707 -2.1707 -2.0449 -2.0449 1.3514 1.3514 1.5631 1.5631 1.7849 1.7849 1.9356 1.9356 2.2310 2.2310 2.2763 2.2763 2.3338 2.3338 2.5814 2.5814 3.2897 3.2897 3.5376 3.5376 3.8330 3.8330 3.9324 3.9324 4.2003 4.2003 4.5753 4.5753 5.3363 5.3363 5.4921 5.4921 5.6060 5.6060 5.7718 5.7718 7.4042 7.4042 7.4680 7.4680 8.0632 8.0632 8.2632 8.2632 8.8998 8.8998 9.0343 9.0343 k = 0.2943-1.4553-2.5547 ( 6947 PWs) bands (ev): -4.8764 -4.8764 -4.8550 -4.8550 -4.0661 -4.0661 -3.1858 -3.1858 -3.0210 -3.0210 -2.9297 -2.9297 -2.9059 -2.9059 -2.7783 -2.7783 -2.3046 -2.3046 -2.2440 -2.2440 -2.1269 -2.1269 1.3288 1.3288 1.5683 1.5683 1.7878 1.7878 1.8928 1.8928 2.1979 2.1979 2.2834 2.2834 2.3223 2.3223 2.5329 2.5329 3.2731 3.2731 3.5694 3.5694 3.8346 3.8346 3.9336 3.9336 4.1453 4.1453 4.5122 4.5122 5.2842 5.2842 5.4836 5.4836 5.6292 5.6292 5.8077 5.8077 7.3691 7.3691 7.4404 7.4404 8.0692 8.0692 8.2590 8.2590 9.0111 9.0111 9.1401 9.1401 k = 0.3010-1.4884-2.6127 ( 6957 PWs) bands (ev): -4.8485 -4.8485 -4.8313 -4.8313 -4.0521 -4.0521 -3.0966 -3.0966 -2.9979 -2.9979 -2.9447 -2.9447 -2.8959 -2.8959 -2.7356 -2.7356 -2.3647 -2.3647 -2.3156 -2.3156 -2.2066 -2.2066 1.3117 1.3117 1.5760 1.5760 1.7913 1.7913 1.8544 1.8544 2.1451 2.1451 2.2589 2.2589 2.3590 2.3590 2.5123 2.5123 3.2437 3.2437 3.5679 3.5679 3.8365 3.8365 3.9581 3.9581 4.1208 4.1208 4.4570 4.4570 5.2321 5.2321 5.4593 5.4593 5.6579 5.6579 5.8343 5.8343 7.3476 7.3476 7.4275 7.4275 8.0728 8.0728 8.2520 8.2520 9.1196 9.1196 9.2432 9.2432 k = 0.3077-1.5215-2.6708 ( 6955 PWs) bands (ev): -4.8264 -4.8264 -4.8121 -4.8121 -4.0395 -4.0395 -3.0217 -3.0217 -2.9986 -2.9986 -2.9560 -2.9560 -2.8437 -2.8437 -2.6947 -2.6947 -2.4237 -2.4237 -2.3851 -2.3851 -2.2840 -2.2840 1.3002 1.3002 1.5870 1.5870 1.7799 1.7799 1.8349 1.8349 2.0937 2.0937 2.2438 2.2438 2.3509 2.3509 2.5515 2.5515 3.2058 3.2058 3.5384 3.5384 3.8202 3.8202 3.9935 3.9935 4.1407 4.1407 4.4171 4.4171 5.1804 5.1804 5.4299 5.4299 5.6799 5.6799 5.8496 5.8496 7.3415 7.3415 7.4308 7.4308 8.0738 8.0738 8.2424 8.2424 9.2158 9.2158 9.3288 9.3288 k = 0.3144-1.5546-2.7289 ( 6959 PWs) bands (ev): -4.8100 -4.8100 -4.7973 -4.7973 -4.0290 -4.0290 -3.0195 -3.0195 -2.9946 -2.9946 -2.8994 -2.8994 -2.7840 -2.7840 -2.6563 -2.6563 -2.4805 -2.4805 -2.4523 -2.4523 -2.3589 -2.3589 1.2939 1.2939 1.6016 1.6016 1.7505 1.7505 1.8353 1.8353 2.0458 2.0458 2.2440 2.2440 2.3140 2.3140 2.6290 2.6290 3.1630 3.1630 3.4941 3.4941 3.7788 3.7788 4.0266 4.0266 4.1951 4.1951 4.4057 4.4057 5.1293 5.1293 5.3985 5.3985 5.6910 5.6910 5.8520 5.8520 7.3519 7.3519 7.4511 7.4511 8.0723 8.0723 8.2301 8.2301 9.2473 9.2473 9.3319 9.3319 k = 0.3211-1.5876-2.7869 ( 6953 PWs) bands (ev): -4.7992 -4.7992 -4.7872 -4.7872 -4.0210 -4.0210 -3.0287 -3.0287 -3.0018 -3.0018 -2.8139 -2.8139 -2.7264 -2.7264 -2.6209 -2.6209 -2.5330 -2.5330 -2.5158 -2.5158 -2.4311 -2.4311 1.2922 1.2922 1.6198 1.6198 1.7198 1.7198 1.8371 1.8371 2.0037 2.0037 2.2611 2.2611 2.2719 2.2719 2.7194 2.7194 3.1182 3.1182 3.4437 3.4437 3.7251 3.7251 4.0344 4.0344 4.2711 4.2711 4.4350 4.4350 5.0793 5.0793 5.3666 5.3666 5.6895 5.6895 5.8414 5.8414 7.3791 7.3791 7.4883 7.4883 8.0682 8.0682 8.2153 8.2153 9.1755 9.1755 9.2405 9.2405 k = 0.3278-1.6207-2.8450 ( 6947 PWs) bands (ev): -4.7933 -4.7933 -4.7815 -4.7815 -4.0162 -4.0162 -3.0341 -3.0341 -3.0067 -3.0067 -2.7302 -2.7302 -2.6821 -2.6821 -2.5978 -2.5978 -2.5683 -2.5683 -2.5667 -2.5667 -2.5002 -2.5002 1.2940 1.2940 1.6405 1.6405 1.6939 1.6939 1.8339 1.8339 1.9704 1.9704 2.2308 2.2308 2.2958 2.2958 2.8136 2.8136 3.0739 3.0739 3.3916 3.3916 3.6681 3.6681 4.0127 4.0127 4.3626 4.3626 4.5010 4.5010 5.0305 5.0305 5.3347 5.3347 5.6757 5.6757 5.8183 5.8183 7.4225 7.4225 7.5413 7.5413 8.0614 8.0614 8.1979 8.1979 9.0716 9.0716 9.1298 9.1298 k = 0.3345-1.6538-2.9030 ( 6945 PWs) bands (ev): -4.7919 -4.7919 -4.7801 -4.7801 -4.0150 -4.0150 -3.0352 -3.0352 -3.0081 -3.0081 -2.6872 -2.6872 -2.6758 -2.6758 -2.6128 -2.6128 -2.5733 -2.5733 -2.5557 -2.5557 -2.5414 -2.5414 1.2977 1.2977 1.6595 1.6595 1.6769 1.6769 1.8256 1.8256 1.9495 1.9495 2.1939 2.1939 2.3452 2.3452 2.9013 2.9013 3.0375 3.0375 3.3406 3.3406 3.6127 3.6127 3.9740 3.9740 4.4636 4.4636 4.5894 4.5894 4.9834 4.9834 5.3034 5.3034 5.6505 5.6505 5.7841 5.7841 7.4805 7.4805 7.6084 7.6084 8.0519 8.0519 8.1778 8.1778 8.9591 8.9591 9.0149 9.0149 k = 0.6655-1.6037-2.8739 ( 6945 PWs) bands (ev): -4.7919 -4.7919 -4.7801 -4.7801 -4.0150 -4.0150 -3.0352 -3.0352 -3.0081 -3.0081 -2.6872 -2.6872 -2.6758 -2.6758 -2.6128 -2.6128 -2.5733 -2.5733 -2.5557 -2.5557 -2.5414 -2.5414 1.2977 1.2977 1.6595 1.6595 1.6769 1.6769 1.8256 1.8256 1.9495 1.9495 2.1939 2.1939 2.3452 2.3452 2.9013 2.9013 3.0375 3.0375 3.3406 3.3406 3.6127 3.6127 3.9740 3.9740 4.4636 4.4636 4.5894 4.5894 4.9834 4.9834 5.3034 5.3034 5.6505 5.6505 5.7841 5.7841 7.4805 7.4805 7.6084 7.6084 8.0519 8.0519 8.1778 8.1778 8.9591 8.9591 9.0149 9.0149 k = 0.6589-1.5376-2.8739 ( 6945 PWs) bands (ev): -4.7944 -4.7944 -4.7826 -4.7826 -4.0174 -4.0174 -3.0341 -3.0341 -3.0051 -3.0051 -2.7248 -2.7248 -2.7132 -2.7132 -2.6358 -2.6358 -2.5598 -2.5598 -2.5129 -2.5129 -2.4975 -2.4975 1.3013 1.3013 1.6615 1.6615 1.6803 1.6803 1.8173 1.8173 1.9438 1.9438 2.1625 2.1625 2.4065 2.4065 2.9384 2.9384 3.0471 3.0471 3.2949 3.2949 3.5634 3.5634 3.9286 3.9286 4.5684 4.5684 4.6888 4.6888 4.9396 4.9396 5.2732 5.2732 5.6162 5.6162 5.7410 5.7410 7.5505 7.5505 7.6865 7.6865 8.0399 8.0399 8.1552 8.1552 8.8444 8.8444 8.9000 8.9000 k = 0.6523-1.4714-2.8739 ( 6937 PWs) bands (ev): -4.8003 -4.8003 -4.7886 -4.7886 -4.0234 -4.0234 -3.0335 -3.0335 -2.9973 -2.9973 -2.7698 -2.7698 -2.7630 -2.7630 -2.6953 -2.6953 -2.5210 -2.5210 -2.4602 -2.4602 -2.4281 -2.4281 1.3028 1.3028 1.6615 1.6615 1.6830 1.6830 1.8173 1.8173 1.9542 1.9542 2.1376 2.1376 2.4777 2.4777 2.9110 2.9110 3.1019 3.1019 3.2638 3.2638 3.5261 3.5261 3.8815 3.8815 4.6727 4.6727 4.7926 4.7926 4.9030 4.9030 5.2445 5.2445 5.5748 5.5748 5.6907 5.6907 7.6308 7.6308 7.7731 7.7731 8.0255 8.0255 8.1297 8.1297 8.7285 8.7285 8.7857 8.7857 k = 0.6457-1.4053-2.8739 ( 6933 PWs) bands (ev): -4.8091 -4.8091 -4.7974 -4.7974 -4.0326 -4.0326 -3.0355 -3.0355 -2.9875 -2.9875 -2.8143 -2.8143 -2.8084 -2.8084 -2.7521 -2.7521 -2.4940 -2.4940 -2.4066 -2.4066 -2.3479 -2.3479 1.3006 1.3006 1.6594 1.6594 1.6842 1.6842 1.8280 1.8280 1.9808 1.9808 2.1204 2.1204 2.5568 2.5568 2.8715 2.8715 3.1178 3.1178 3.2641 3.2641 3.5157 3.5157 3.8360 3.8360 4.7601 4.7601 4.8605 4.8605 4.9237 4.9237 5.2177 5.2177 5.5292 5.5292 5.6350 5.6350 7.7187 7.7187 7.8619 7.8619 8.0117 8.0117 8.1013 8.1013 8.6133 8.6133 8.6742 8.6742 k = 0.6391-1.3391-2.8739 ( 6935 PWs) bands (ev): -4.8203 -4.8203 -4.8088 -4.8088 -4.0445 -4.0445 -3.0413 -3.0413 -2.9828 -2.9828 -2.8569 -2.8569 -2.8420 -2.8420 -2.8039 -2.8039 -2.4719 -2.4719 -2.3540 -2.3540 -2.2658 -2.2658 1.2941 1.2941 1.6405 1.6405 1.7042 1.7042 1.8451 1.8451 2.0221 2.0221 2.1128 2.1128 2.6416 2.6416 2.8317 2.8317 3.0913 3.0913 3.2681 3.2681 3.5510 3.5510 3.7956 3.7956 4.7741 4.7741 4.9146 4.9146 5.0279 5.0279 5.1940 5.1940 5.4843 5.4843 5.5768 5.5768 7.8095 7.8095 7.9234 7.9234 8.0195 8.0195 8.0756 8.0756 8.5017 8.5017 8.5681 8.5681 k = 0.6324-1.2730-2.8739 ( 6940 PWs) bands (ev): -4.8335 -4.8335 -4.8220 -4.8220 -4.0587 -4.0587 -3.0525 -3.0525 -2.9945 -2.9945 -2.8985 -2.8985 -2.8552 -2.8552 -2.8461 -2.8461 -2.4527 -2.4527 -2.3030 -2.3030 -2.1845 -2.1845 1.2837 1.2837 1.6160 1.6160 1.7358 1.7358 1.8658 1.8658 2.0723 2.0723 2.1197 2.1197 2.7281 2.7281 2.7958 2.7958 3.0529 3.0529 3.2491 3.2491 3.6172 3.6172 3.7713 3.7713 4.7445 4.7445 4.9903 4.9903 5.1336 5.1336 5.1761 5.1761 5.4493 5.4493 5.5210 5.5210 7.8824 7.8824 7.9215 7.9215 8.0294 8.0294 8.1190 8.1190 8.3982 8.3982 8.4717 8.4717 k = 0.6258-1.2068-2.8739 ( 6948 PWs) bands (ev): -4.8482 -4.8482 -4.8369 -4.8369 -4.0746 -4.0746 -3.0704 -3.0704 -3.0235 -3.0235 -2.9415 -2.9415 -2.8800 -2.8800 -2.8432 -2.8432 -2.4355 -2.4355 -2.2541 -2.2541 -2.1048 -2.1048 1.2701 1.2701 1.5907 1.5907 1.7743 1.7743 1.8899 1.8899 2.1123 2.1123 2.1586 2.1586 2.7513 2.7513 2.8264 2.8264 3.0144 3.0144 3.2183 3.2183 3.6526 3.6526 3.8040 3.8040 4.7094 4.7094 5.0379 5.0379 5.1573 5.1573 5.2255 5.2255 5.4421 5.4421 5.4835 5.4835 7.8579 7.8579 7.9155 7.9155 8.0618 8.0618 8.2124 8.2124 8.3118 8.3118 8.3935 8.3935 k = 0.6192-1.1407-2.8739 ( 6960 PWs) bands (ev): -4.8642 -4.8642 -4.8528 -4.8528 -4.0916 -4.0916 -3.0947 -3.0947 -3.0607 -3.0607 -2.9859 -2.9859 -2.8995 -2.8995 -2.8221 -2.8221 -2.4197 -2.4197 -2.2075 -2.2075 -2.0273 -2.0273 1.2542 1.2542 1.5664 1.5664 1.8167 1.8167 1.9179 1.9179 2.1449 2.1449 2.2251 2.2251 2.7220 2.7220 2.9004 2.9004 2.9890 2.9890 3.1863 3.1863 3.6405 3.6405 3.8997 3.8997 4.6745 4.6745 5.0441 5.0441 5.1372 5.1372 5.2531 5.2531 5.4809 5.4809 5.5040 5.5040 7.7933 7.7933 7.8592 7.8592 8.1330 8.1330 8.2334 8.2334 8.2880 8.2880 8.3827 8.3827 k = 0.6126-1.0745-2.8739 ( 6962 PWs) bands (ev): -4.8809 -4.8809 -4.8695 -4.8695 -4.1094 -4.1094 -3.1236 -3.1236 -3.1001 -3.1001 -3.0301 -3.0301 -2.9108 -2.9108 -2.7965 -2.7965 -2.4049 -2.4049 -2.1632 -2.1632 -1.9524 -1.9524 1.2367 1.2367 1.5440 1.5440 1.8610 1.8610 1.9500 1.9500 2.1883 2.1883 2.2979 2.2979 2.6976 2.6976 2.9089 2.9089 3.0228 3.0228 3.1633 3.1633 3.6220 3.6220 4.0138 4.0138 4.6414 4.6414 5.0174 5.0174 5.1111 5.1111 5.2145 5.2145 5.5605 5.5605 5.5841 5.5841 7.7108 7.7108 7.7800 7.7800 8.1355 8.1355 8.2141 8.2141 8.3142 8.3142 8.4769 8.4769 k = 0.6060-1.0084-2.8739 ( 6956 PWs) bands (ev): -4.8981 -4.8981 -4.8866 -4.8866 -4.1275 -4.1275 -3.1549 -3.1549 -3.1392 -3.1392 -3.0727 -3.0727 -2.9170 -2.9170 -2.7700 -2.7700 -2.3907 -2.3907 -2.1215 -2.1215 -1.8804 -1.8804 1.2183 1.2183 1.5238 1.5238 1.9061 1.9061 1.9865 1.9865 2.2451 2.2451 2.3675 2.3675 2.6847 2.6847 2.8803 2.8803 3.0577 3.0577 3.1753 3.1753 3.6130 3.6130 4.1309 4.1309 4.6111 4.6111 4.9643 4.9643 5.0914 5.0914 5.1517 5.1517 5.6546 5.6546 5.6861 5.6861 7.6178 7.6178 7.6898 7.6898 8.0993 8.0993 8.1785 8.1785 8.4063 8.4063 8.5875 8.5875 k = 0.5993-0.9422-2.8739 ( 6950 PWs) bands (ev): -4.9155 -4.9155 -4.9038 -4.9038 -4.1456 -4.1456 -3.1870 -3.1870 -3.1770 -3.1770 -3.1133 -3.1133 -2.9204 -2.9204 -2.7443 -2.7443 -2.3767 -2.3767 -2.0825 -2.0825 -1.8117 -1.8117 1.1993 1.1993 1.5062 1.5062 1.9521 1.9521 2.0277 2.0277 2.3138 2.3138 2.4219 2.4219 2.6926 2.6926 2.8510 2.8510 3.0498 3.0498 3.2246 3.2246 3.6240 3.6240 4.2432 4.2432 4.5854 4.5854 4.8943 4.8943 5.0615 5.0615 5.1031 5.1031 5.7494 5.7494 5.7899 5.7899 7.5226 7.5226 7.5962 7.5962 8.0658 8.0658 8.1436 8.1436 8.5088 8.5088 8.6945 8.6945 k = 0.5927-0.8761-2.8739 ( 6946 PWs) bands (ev): -4.9328 -4.9328 -4.9209 -4.9209 -4.1635 -4.1635 -3.2187 -3.2187 -3.2129 -3.2129 -3.1515 -3.1515 -2.9224 -2.9224 -2.7203 -2.7203 -2.3627 -2.3627 -2.0462 -2.0462 -1.7464 -1.7464 1.1803 1.1803 1.4910 1.4910 1.9994 1.9994 2.0736 2.0736 2.3913 2.3913 2.4499 2.4499 2.7258 2.7258 2.8312 2.8312 3.0318 3.0318 3.2676 3.2676 3.6641 3.6641 4.3411 4.3411 4.5686 4.5686 4.8153 4.8153 4.9910 4.9910 5.1058 5.1058 5.8355 5.8355 5.8863 5.8863 7.4339 7.4339 7.5068 7.5068 8.0367 8.0367 8.1132 8.1132 8.6060 8.6060 8.7826 8.7826 k = 0.5861-0.8099-2.8739 ( 6944 PWs) bands (ev): -4.9498 -4.9498 -4.9376 -4.9376 -4.1808 -4.1808 -3.2494 -3.2494 -3.2467 -3.2467 -3.1873 -3.1873 -2.9236 -2.9236 -2.6989 -2.6989 -2.3486 -2.3486 -2.0126 -2.0126 -1.6847 -1.6847 1.1614 1.1614 1.4785 1.4785 2.0487 2.0487 2.1241 2.1241 2.4522 2.4522 2.4757 2.4757 2.7526 2.7526 2.8489 2.8489 3.0188 3.0188 3.2911 3.2911 3.7342 3.7342 4.4069 4.4069 4.5706 4.5706 4.7317 4.7317 4.9148 4.9148 5.1325 5.1325 5.9042 5.9042 5.9677 5.9677 7.3610 7.3610 7.4293 7.4293 8.0101 8.0101 8.0867 8.0867 8.6701 8.6701 8.7918 8.7918 k = 0.5795-0.7438-2.8739 ( 6946 PWs) bands (ev): -4.9662 -4.9662 -4.9537 -4.9537 -4.1974 -4.1974 -3.2790 -3.2790 -3.2778 -3.2778 -3.2205 -3.2205 -2.9246 -2.9246 -2.6802 -2.6802 -2.3343 -2.3343 -1.9819 -1.9819 -1.6270 -1.6270 1.1430 1.1430 1.4684 1.4684 2.0999 2.0999 2.1783 2.1783 2.4456 2.4456 2.5558 2.5558 2.7470 2.7470 2.9136 2.9136 3.0210 3.0210 3.3025 3.3025 3.8251 3.8251 4.4276 4.4276 4.5879 4.5879 4.6522 4.6522 4.8430 4.8430 5.1838 5.1838 5.9461 5.9461 6.0261 6.0261 7.3134 7.3134 7.3730 7.3730 7.9838 7.9838 8.0633 8.0633 8.5777 8.5777 8.8110 8.8110 k = 0.5728-0.6776-2.8739 ( 6938 PWs) bands (ev): -4.9819 -4.9819 -4.9691 -4.9691 -4.2131 -4.2131 -3.3079 -3.3079 -3.3055 -3.3055 -3.2511 -3.2511 -2.9254 -2.9254 -2.6644 -2.6644 -2.3198 -2.3198 -1.9540 -1.9540 -1.5734 -1.5734 1.1254 1.1254 1.4606 1.4606 2.1525 2.1525 2.2342 2.2342 2.4351 2.4351 2.6262 2.6262 2.7372 2.7372 2.9762 2.9762 3.0561 3.0561 3.3149 3.3149 3.9258 3.9258 4.4213 4.4213 4.5381 4.5381 4.6282 4.6282 4.7889 4.7889 5.2620 5.2620 5.9538 5.9538 6.0532 6.0532 7.2983 7.2983 7.3472 7.3472 7.9545 7.9545 8.0425 8.0425 8.4169 8.4169 8.8502 8.8502 k = 0.5662-0.6115-2.8739 ( 6934 PWs) bands (ev): -4.9968 -4.9968 -4.9837 -4.9837 -4.2278 -4.2278 -3.3347 -3.3347 -3.3309 -3.3309 -3.2791 -3.2791 -2.9263 -2.9263 -2.6513 -2.6513 -2.3054 -2.3054 -1.9288 -1.9288 -1.5239 -1.5239 1.1086 1.1086 1.4551 1.4551 2.2046 2.2046 2.2881 2.2881 2.4284 2.4284 2.6737 2.6737 2.7361 2.7361 3.0275 3.0275 3.1172 3.1172 3.3456 3.3456 4.0266 4.0266 4.4038 4.4038 4.4515 4.4515 4.6008 4.6008 4.7727 4.7727 5.3648 5.3648 5.9245 5.9245 6.0441 6.0441 7.3165 7.3165 7.3592 7.3592 7.9153 7.9153 8.0238 8.0238 8.2606 8.2606 8.8092 8.8092 k = 0.5596-0.5453-2.8739 ( 6944 PWs) bands (ev): -5.0106 -5.0106 -4.9971 -4.9971 -4.2413 -4.2413 -3.3590 -3.3590 -3.3541 -3.3541 -3.3045 -3.3045 -2.9272 -2.9272 -2.6408 -2.6408 -2.2914 -2.2914 -1.9064 -1.9064 -1.4789 -1.4789 1.0930 1.0930 1.4514 1.4514 2.2527 2.2527 2.3303 2.3303 2.4370 2.4370 2.6947 2.6947 2.7481 2.7481 3.0825 3.0825 3.1752 3.1752 3.4101 3.4101 4.1160 4.1160 4.3446 4.3446 4.4007 4.4007 4.5510 4.5510 4.7858 4.7858 5.4862 5.4862 5.8620 5.8620 5.9993 5.9993 7.3615 7.3615 7.4102 7.4102 7.8516 7.8516 8.0068 8.0068 8.1331 8.1331 8.6785 8.6785 k = 0.5530-0.4792-2.8739 ( 6934 PWs) bands (ev): -5.0232 -5.0232 -5.0095 -5.0095 -4.2537 -4.2537 -3.3809 -3.3809 -3.3750 -3.3750 -3.3272 -3.3272 -2.9282 -2.9282 -2.6325 -2.6325 -2.2780 -2.2780 -1.8866 -1.8866 -1.4384 -1.4384 1.0786 1.0786 1.4494 1.4494 2.2907 2.2907 2.3501 2.3501 2.4739 2.4739 2.7030 2.7030 2.7688 2.7688 3.1181 3.1181 3.2494 3.2494 3.5037 3.5037 4.1763 4.1763 4.2525 4.2525 4.3824 4.3824 4.5111 4.5111 4.8130 4.8130 5.6194 5.6194 5.7746 5.7746 5.9252 5.9252 7.4220 7.4220 7.4924 7.4924 7.7531 7.7531 7.9909 7.9909 8.0530 8.0530 8.5260 8.5260 k = 0.5464-0.4130-2.8739 ( 6942 PWs) bands (ev): -5.0346 -5.0346 -5.0206 -5.0206 -4.2648 -4.2648 -3.4003 -3.4003 -3.3936 -3.3936 -3.3472 -3.3472 -2.9292 -2.9292 -2.6260 -2.6260 -2.2656 -2.2656 -1.8694 -1.8694 -1.4024 -1.4024 1.0657 1.0657 1.4487 1.4487 2.3104 2.3104 2.3611 2.3611 2.5310 2.5310 2.7059 2.7059 2.8014 2.8014 3.1284 3.1284 3.3498 3.3498 3.6103 3.6103 4.1511 4.1511 4.1977 4.1977 4.3657 4.3657 4.5032 4.5032 4.8544 4.8544 5.6651 5.6651 5.7630 5.7630 5.8328 5.8328 7.4599 7.4599 7.5922 7.5922 7.6660 7.6660 7.9746 7.9746 8.0108 8.0108 8.3718 8.3718 k = 0.5397-0.3469-2.8739 ( 6946 PWs) bands (ev): -5.0446 -5.0446 -5.0304 -5.0304 -4.2745 -4.2745 -3.4171 -3.4171 -3.4099 -3.4099 -3.3646 -3.3646 -2.9302 -2.9302 -2.6212 -2.6212 -2.2543 -2.2543 -1.8547 -1.8547 -1.3712 -1.3712 1.0542 1.0542 1.4491 1.4491 2.3127 2.3127 2.3731 2.3731 2.5959 2.5959 2.7052 2.7052 2.8488 2.8488 3.1291 3.1291 3.4613 3.4613 3.7153 3.7153 4.0608 4.0608 4.1715 4.1715 4.3521 4.3521 4.5189 4.5189 4.9123 4.9123 5.5524 5.5524 5.7184 5.7184 5.9140 5.9140 7.3838 7.3838 7.6742 7.6742 7.7201 7.7201 7.9532 7.9532 7.9890 7.9890 8.2276 8.2276 k = 0.5331-0.2807-2.8739 ( 6940 PWs) bands (ev): -5.0532 -5.0532 -5.0388 -5.0388 -4.2827 -4.2827 -3.4314 -3.4314 -3.4237 -3.4237 -3.3793 -3.3793 -2.9311 -2.9311 -2.6175 -2.6175 -2.2444 -2.2444 -1.8424 -1.8424 -1.3447 -1.3447 1.0444 1.0444 1.4501 1.4501 2.3082 2.3082 2.3817 2.3817 2.6583 2.6583 2.7083 2.7083 2.9063 2.9063 3.1295 3.1295 3.5710 3.5710 3.7995 3.7995 3.9795 3.9795 4.1425 4.1425 4.3432 4.3432 4.5352 4.5352 4.9827 4.9827 5.4359 5.4359 5.6055 5.6055 6.0620 6.0620 7.2497 7.2497 7.7557 7.7557 7.8254 7.8254 7.9182 7.9182 7.9799 7.9799 8.1193 8.1193 k = 0.5265-0.2146-2.8739 ( 6940 PWs) bands (ev): -5.0604 -5.0604 -5.0457 -5.0457 -4.2896 -4.2896 -3.4431 -3.4431 -3.4350 -3.4350 -3.3913 -3.3913 -2.9319 -2.9319 -2.6149 -2.6149 -2.2362 -2.2362 -1.8325 -1.8325 -1.3229 -1.3229 1.0363 1.0363 1.4515 1.4515 2.3023 2.3023 2.3860 2.3860 2.6822 2.6822 2.7499 2.7499 2.9634 2.9634 3.1383 3.1383 3.6522 3.6522 3.8365 3.8365 3.9285 3.9285 4.1487 4.1487 4.3398 4.3398 4.5427 4.5427 5.0511 5.0511 5.3244 5.3244 5.4980 5.4980 6.2094 6.2094 7.1125 7.1125 7.7741 7.7741 7.8704 7.8704 7.9264 7.9264 7.9851 7.9851 8.1028 8.1028 k = 0.5199-0.1484-2.8739 ( 6948 PWs) bands (ev): -5.0660 -5.0660 -5.0512 -5.0512 -4.2949 -4.2949 -3.4522 -3.4522 -3.4439 -3.4439 -3.4007 -3.4007 -2.9326 -2.9326 -2.6131 -2.6131 -2.2296 -2.2296 -1.8249 -1.8249 -1.3060 -1.3060 1.0299 1.0299 1.4529 1.4529 2.2970 2.2970 2.3875 2.3875 2.6813 2.6813 2.8144 2.8144 3.0023 3.0023 3.1700 3.1700 3.6488 3.6488 3.8435 3.8435 3.9360 3.9360 4.1960 4.1960 4.3439 4.3439 4.5434 4.5434 5.0902 5.0902 5.2257 5.2257 5.4185 5.4185 6.3518 6.3518 6.9861 6.9861 7.6681 7.6681 7.9129 7.9129 7.9440 7.9440 8.0131 8.0131 8.1904 8.1904 k = 0.5132-0.0823-2.8739 ( 6956 PWs) bands (ev): -5.0700 -5.0700 -5.0551 -5.0551 -4.2988 -4.2988 -3.4587 -3.4587 -3.4502 -3.4502 -3.4074 -3.4074 -2.9332 -2.9332 -2.6119 -2.6119 -2.2249 -2.2249 -1.8195 -1.8195 -1.2939 -1.2939 1.0253 1.0253 1.4541 1.4541 2.2930 2.2930 2.3875 2.3875 2.6785 2.6785 2.8757 2.8757 3.0122 3.0122 3.2315 3.2315 3.5806 3.5806 3.8177 3.8177 4.0120 4.0120 4.2438 4.2438 4.3527 4.3527 4.5479 4.5479 5.0760 5.0760 5.1408 5.1408 5.3960 5.3960 6.4830 6.4830 6.8775 6.8775 7.5545 7.5545 7.9256 7.9256 7.9460 7.9460 8.0612 8.0612 8.3122 8.3122 k = 0.5066-0.0161-2.8739 ( 6952 PWs) bands (ev): -5.0724 -5.0724 -5.0574 -5.0574 -4.3011 -4.3011 -3.4626 -3.4626 -3.4540 -3.4540 -3.4114 -3.4114 -2.9335 -2.9335 -2.6112 -2.6112 -2.2220 -2.2220 -1.8162 -1.8162 -1.2866 -1.2866 1.0225 1.0225 1.4549 1.4549 2.2904 2.2904 2.3872 2.3872 2.6764 2.6764 2.9275 2.9275 3.0013 3.0013 3.3101 3.3101 3.4958 3.4958 3.7912 3.7912 4.0894 4.0894 4.2756 4.2756 4.3435 4.3435 4.5690 4.5690 5.0427 5.0427 5.0691 5.0691 5.4101 5.4101 6.5935 6.5935 6.7900 6.7900 7.4685 7.4685 7.9276 7.9276 7.9451 7.9451 8.0982 8.0982 8.4293 8.4293 k = 0.5000 0.0501-2.8739 ( 6946 PWs) bands (ev): -5.0732 -5.0732 -5.0582 -5.0582 -4.3018 -4.3018 -3.4639 -3.4639 -3.4553 -3.4553 -3.4127 -3.4127 -2.9336 -2.9336 -2.6110 -2.6110 -2.2210 -2.2210 -1.8152 -1.8152 -1.2842 -1.2842 1.0216 1.0216 1.4552 1.4552 2.2896 2.2896 2.3870 2.3870 2.6757 2.6757 2.9576 2.9576 2.9848 2.9848 3.3758 3.3758 3.4281 3.4281 3.7810 3.7810 4.1227 4.1227 4.3049 4.3049 4.3138 4.3138 4.5847 4.5847 5.0310 5.0310 5.0355 5.0355 5.4195 5.4195 6.6555 6.6555 6.7387 6.7387 7.4355 7.4355 7.9278 7.9278 7.9445 7.9445 8.1110 8.1110 8.4944 8.4944 k = 0.5000 0.0501-2.8739 ( 6946 PWs) bands (ev): -5.0732 -5.0732 -5.0582 -5.0582 -4.3018 -4.3018 -3.4639 -3.4639 -3.4553 -3.4553 -3.4127 -3.4127 -2.9336 -2.9336 -2.6110 -2.6110 -2.2210 -2.2210 -1.8152 -1.8152 -1.2842 -1.2842 1.0216 1.0216 1.4552 1.4552 2.2896 2.2896 2.3870 2.3870 2.6757 2.6757 2.9576 2.9576 2.9848 2.9848 3.3758 3.3758 3.4281 3.4281 3.7810 3.7810 4.1227 4.1227 4.3049 4.3049 4.3138 4.3138 4.5847 4.5847 5.0310 5.0310 5.0355 5.0355 5.4195 5.4195 6.6555 6.6555 6.7387 6.7387 7.4355 7.4355 7.9278 7.9278 7.9445 7.9445 8.1110 8.1110 8.4944 8.4944 k = 0.5552 0.0556-2.8643 ( 6950 PWs) bands (ev): -5.0733 -5.0733 -5.0583 -5.0583 -4.3018 -4.3018 -3.4678 -3.4678 -3.4516 -3.4516 -3.4122 -3.4122 -2.9353 -2.9353 -2.6074 -2.6074 -2.2246 -2.2246 -1.8130 -1.8130 -1.2846 -1.2846 1.0209 1.0209 1.4580 1.4580 2.2738 2.2738 2.3929 2.3929 2.6889 2.6889 2.9543 2.9543 2.9856 2.9856 3.3617 3.3617 3.4436 3.4436 3.7872 3.7872 4.1090 4.1090 4.2571 4.2571 4.3572 4.3572 4.5967 4.5967 4.9490 4.9490 5.1191 5.1191 5.4214 5.4214 6.5956 6.5956 6.7980 6.7980 7.4424 7.4424 7.8027 7.8027 8.0685 8.0685 8.1050 8.1050 8.4683 8.4683 k = 0.6104 0.0611-2.8546 ( 6954 PWs) bands (ev): -5.0734 -5.0734 -5.0584 -5.0584 -4.3018 -4.3018 -3.4743 -3.4743 -3.4461 -3.4461 -3.4108 -3.4108 -2.9402 -2.9402 -2.5972 -2.5972 -2.2350 -2.2350 -1.8071 -1.8071 -1.2858 -1.2858 1.0188 1.0188 1.4662 1.4662 2.2361 2.2361 2.4047 2.4047 2.7242 2.7242 2.9458 2.9458 2.9877 2.9877 3.3373 3.3373 3.4723 3.4723 3.8050 3.8050 4.0713 4.0713 4.2030 4.2030 4.4008 4.4008 4.6246 4.6246 4.8720 4.8720 5.2010 5.2010 5.4296 5.4296 6.5074 6.5074 6.8846 6.8846 7.4625 7.4625 7.6753 7.6753 8.0633 8.0633 8.2174 8.2174 8.4276 8.4276 k = 0.6655 0.0666-2.8449 ( 6948 PWs) bands (ev): -5.0736 -5.0736 -5.0585 -5.0585 -4.3018 -4.3018 -3.4808 -3.4808 -3.4410 -3.4410 -3.4086 -3.4086 -2.9470 -2.9470 -2.5817 -2.5817 -2.2508 -2.2508 -1.7985 -1.7985 -1.2876 -1.2876 1.0157 1.0157 1.4794 1.4794 2.1885 2.1885 2.4172 2.4172 2.7719 2.7719 2.9361 2.9361 2.9906 2.9906 3.3133 3.3133 3.5035 3.5035 3.8318 3.8318 4.0163 4.0163 4.1514 4.1514 4.4386 4.4386 4.6479 4.6479 4.8147 4.8147 5.2696 5.2696 5.4530 5.4530 6.4172 6.4172 6.9720 6.9720 7.4909 7.4909 7.5595 7.5595 8.0120 8.0120 8.3494 8.3494 8.3963 8.3963 k = 0.6655 0.0666-2.8449 ( 6948 PWs) bands (ev): -5.0736 -5.0736 -5.0585 -5.0585 -4.3018 -4.3018 -3.4808 -3.4808 -3.4410 -3.4410 -3.4086 -3.4086 -2.9470 -2.9470 -2.5817 -2.5817 -2.2508 -2.2508 -1.7985 -1.7985 -1.2876 -1.2876 1.0157 1.0157 1.4794 1.4794 2.1885 2.1885 2.4172 2.4172 2.7719 2.7719 2.9361 2.9361 2.9906 2.9906 3.3133 3.3133 3.5035 3.5035 3.8318 3.8318 4.0163 4.0163 4.1514 4.1514 4.4386 4.4386 4.6479 4.6479 4.8147 4.8147 5.2696 5.2696 5.4530 5.4530 6.4172 6.4172 6.9720 6.9720 7.4909 7.4909 7.5595 7.5595 8.0120 8.0120 8.3494 8.3494 8.3963 8.3963 k = 0.6617 0.0662-2.7780 ( 6950 PWs) bands (ev): -5.0819 -5.0819 -5.0639 -5.0639 -4.3005 -4.3005 -3.5249 -3.5249 -3.4446 -3.4446 -3.3780 -3.3780 -2.9551 -2.9551 -2.5466 -2.5466 -2.2707 -2.2707 -1.7787 -1.7787 -1.2819 -1.2819 1.0237 1.0237 1.4571 1.4571 2.2506 2.2506 2.4217 2.4217 2.7177 2.7177 2.9240 2.9240 2.9936 2.9936 3.3016 3.3016 3.5196 3.5196 3.8481 3.8481 4.0408 4.0408 4.2031 4.2031 4.4214 4.4214 4.6259 4.6259 4.7944 4.7944 5.2774 5.2774 5.4458 5.4458 6.4032 6.4032 6.9854 6.9854 7.5036 7.5036 7.6467 7.6467 8.0093 8.0093 8.2524 8.2524 8.3761 8.3761 k = 0.6578 0.0659-2.7112 ( 6948 PWs) bands (ev): -5.0999 -5.0999 -5.0761 -5.0761 -4.2981 -4.2981 -3.5828 -3.5828 -3.4562 -3.4562 -3.3530 -3.3530 -2.9509 -2.9509 -2.5084 -2.5084 -2.2782 -2.2782 -1.7503 -1.7503 -1.2659 -1.2659 1.0331 1.0331 1.4427 1.4427 2.2965 2.2965 2.4289 2.4289 2.6884 2.6884 2.9170 2.9170 2.9999 2.9999 3.2944 3.2944 3.5372 3.5372 3.8675 3.8675 4.0503 4.0503 4.2658 4.2658 4.3927 4.3927 4.6137 4.6137 4.7841 4.7841 5.2877 5.2877 5.4445 5.4445 6.3908 6.3908 6.9995 6.9995 7.5135 7.5135 7.7416 7.7416 8.0094 8.0094 8.1489 8.1489 8.3672 8.3672 k = 0.6540 0.0655-2.6444 ( 6943 PWs) bands (ev): -5.1267 -5.1267 -5.0950 -5.0950 -4.2953 -4.2953 -3.6465 -3.6465 -3.4790 -3.4790 -3.3376 -3.3376 -2.9319 -2.9319 -2.4794 -2.4794 -2.2622 -2.2622 -1.7161 -1.7161 -1.2397 -1.2397 1.0430 1.0430 1.4377 1.4377 2.3063 2.3063 2.4463 2.4463 2.6964 2.6964 2.9143 2.9143 3.0094 3.0094 3.2920 3.2920 3.5562 3.5562 3.8897 3.8897 4.0553 4.0553 4.3193 4.3193 4.3572 4.3572 4.6135 4.6135 4.7875 4.7875 5.3001 5.3001 5.4489 5.4489 6.3800 6.3800 7.0143 7.0143 7.5237 7.5237 7.8354 7.8354 8.0137 8.0137 8.0514 8.0514 8.3610 8.3610 k = 0.6501 0.0651-2.5775 ( 6937 PWs) bands (ev): -5.1610 -5.1610 -5.1201 -5.1201 -4.2932 -4.2932 -3.7141 -3.7141 -3.5133 -3.5133 -3.3294 -3.3294 -2.9017 -2.9017 -2.4624 -2.4624 -2.2190 -2.2190 -1.6775 -1.6775 -1.2040 -1.2040 1.0533 1.0533 1.4432 1.4432 2.2802 2.2802 2.4738 2.4738 2.7406 2.7406 2.9168 2.9168 3.0221 3.0221 3.2947 3.2947 3.5766 3.5766 3.9132 3.9132 4.0596 4.0596 4.2950 4.2950 4.3798 4.3798 4.6232 4.6232 4.8084 4.8084 5.3145 5.3145 5.4590 5.4590 6.3707 6.3707 7.0298 7.0298 7.5343 7.5343 7.9104 7.9104 7.9494 7.9494 8.0499 8.0499 8.3571 8.3571 k = 0.6463 0.0647-2.5107 ( 6944 PWs) bands (ev): -5.2015 -5.2015 -5.1507 -5.1507 -4.2928 -4.2928 -3.7844 -3.7844 -3.5562 -3.5562 -3.3276 -3.3276 -2.8655 -2.8655 -2.4479 -2.4479 -2.1570 -2.1570 -1.6354 -1.6354 -1.1599 -1.1599 1.0640 1.0640 1.4591 1.4591 2.2375 2.2375 2.5028 2.5028 2.8066 2.8066 2.9275 2.9275 3.0380 3.0380 3.3030 3.3030 3.5984 3.5984 3.9357 3.9357 4.0652 4.0652 4.2435 4.2435 4.4134 4.4134 4.6380 4.6380 4.8485 4.8485 5.3310 5.3310 5.4744 5.4744 6.3626 6.3626 7.0459 7.0459 7.5449 7.5449 7.8605 7.8605 7.9451 7.9451 8.1204 8.1204 8.3568 8.3568 k = 0.6424 0.0643-2.4438 ( 6943 PWs) bands (ev): -5.2471 -5.2471 -5.1862 -5.1862 -4.2950 -4.2950 -3.8568 -3.8568 -3.6046 -3.6046 -3.3331 -3.3331 -2.8269 -2.8269 -2.4266 -2.4266 -2.0854 -2.0854 -1.5901 -1.5901 -1.1086 -1.1086 1.0762 1.0762 1.4851 1.4851 2.1910 2.1910 2.5308 2.5308 2.8714 2.8714 2.9588 2.9588 3.0572 3.0572 3.3174 3.3174 3.6216 3.6216 3.9518 3.9518 4.0727 4.0727 4.1965 4.1965 4.4367 4.4367 4.6548 4.6548 4.9046 4.9046 5.3500 5.3500 5.4948 5.4948 6.3558 6.3558 7.0624 7.0624 7.5541 7.5541 7.7808 7.7808 7.9538 7.9538 8.2102 8.2102 8.3661 8.3661 k = 0.6386 0.0639-2.3770 ( 6926 PWs) bands (ev): -5.2967 -5.2967 -5.2258 -5.2258 -4.3007 -4.3007 -3.9305 -3.9305 -3.6559 -3.6559 -3.3469 -3.3469 -2.7872 -2.7872 -2.3941 -2.3941 -2.0097 -2.0097 -1.5412 -1.5412 -1.0512 -1.0512 1.0911 1.0911 1.5197 1.5197 2.1469 2.1469 2.5576 2.5576 2.9103 2.9103 3.0280 3.0280 3.0799 3.0799 3.3388 3.3388 3.6464 3.6464 3.9523 3.9523 4.0814 4.0814 4.1672 4.1672 4.4531 4.4531 4.6729 4.6729 4.9699 4.9699 5.3725 5.3725 5.5199 5.5199 6.3500 6.3500 7.0787 7.0787 7.5581 7.5581 7.7155 7.7155 7.9539 7.9539 8.2771 8.2771 8.4069 8.4069 k = 0.6347 0.0635-2.3102 ( 6923 PWs) bands (ev): -5.3494 -5.3494 -5.2688 -5.2688 -4.3105 -4.3105 -4.0048 -4.0048 -3.7083 -3.7083 -3.3694 -3.3694 -2.7462 -2.7462 -2.3503 -2.3503 -1.9336 -1.9336 -1.4886 -1.4886 -0.9890 -0.9890 1.1102 1.1102 1.5611 1.5611 2.1089 2.1089 2.5834 2.5834 2.9363 2.9363 3.1013 3.1013 3.1217 3.1217 3.3692 3.3692 3.6728 3.6728 3.9299 3.9299 4.0882 4.0882 4.1684 4.1684 4.4659 4.4659 4.6929 4.6929 5.0371 5.0371 5.3997 5.3997 5.5493 5.5493 6.3449 6.3449 7.0943 7.0943 7.5484 7.5484 7.6748 7.6748 7.9505 7.9505 8.2996 8.2996 8.4902 8.4902 k = 0.6309 0.0632-2.2433 ( 6923 PWs) bands (ev): -5.4042 -5.4042 -5.3145 -5.3145 -4.3247 -4.3247 -4.0793 -4.0793 -3.7607 -3.7607 -3.4002 -3.4002 -2.7032 -2.7032 -2.2969 -2.2969 -1.8595 -1.8595 -1.4317 -1.4317 -0.9228 -0.9228 1.1347 1.1347 1.6072 1.6072 2.0799 2.0799 2.6084 2.6084 2.9623 2.9623 3.1314 3.1314 3.2106 3.2106 3.4117 3.4117 3.7006 3.7006 3.8899 3.8899 4.0955 4.0955 4.1946 4.1946 4.4776 4.4776 4.7152 4.7152 5.1006 5.1006 5.4329 5.4329 5.5826 5.5826 6.3402 6.3402 7.1082 7.1082 7.5218 7.5218 7.6641 7.6641 7.9449 7.9449 8.3036 8.3036 8.5689 8.5689 k = 0.6270 0.0628-2.1765 ( 6923 PWs) bands (ev): -5.4606 -5.4606 -5.3624 -5.3624 -4.3436 -4.3436 -4.1532 -4.1532 -3.8122 -3.8122 -3.4379 -3.4379 -2.6580 -2.6580 -2.2364 -2.2364 -1.7895 -1.7895 -1.3700 -1.3700 -0.8533 -0.8533 1.1657 1.1657 1.6551 1.6551 2.0629 2.0629 2.6329 2.6329 2.9912 2.9912 3.1619 3.1619 3.2925 3.2925 3.4700 3.4700 3.7293 3.7293 3.8448 3.8448 4.1062 4.1062 4.2337 4.2337 4.4899 4.4899 4.7400 4.7400 5.1563 5.1563 5.4725 5.4725 5.6197 5.6197 6.3356 6.3356 7.1198 7.1198 7.4927 7.4927 7.6712 7.6712 7.9380 7.9380 8.3021 8.3021 8.6058 8.6058 k = 0.6232 0.0624-2.1097 ( 6922 PWs) bands (ev): -5.5179 -5.5179 -5.4119 -5.4119 -4.3675 -4.3675 -4.2260 -4.2260 -3.8623 -3.8623 -3.4811 -3.4811 -2.6108 -2.6108 -2.1709 -2.1709 -1.7250 -1.7250 -1.3032 -1.3032 -0.7812 -0.7812 1.2039 1.2039 1.7015 1.7015 2.0616 2.0616 2.6576 2.6576 3.0233 3.0233 3.1944 3.1944 3.3613 3.3613 3.5414 3.5414 3.7566 3.7566 3.8082 3.8082 4.1213 4.1213 4.2799 4.2799 4.5042 4.5042 4.7674 4.7674 5.2028 5.2028 5.5170 5.5170 5.6601 5.6601 6.3307 6.3307 7.1290 7.1290 7.4732 7.4732 7.6853 7.6853 7.9301 7.9301 8.2981 8.2981 8.6245 8.6245 k = 0.6193 0.0620-2.0428 ( 6932 PWs) bands (ev): -5.5757 -5.5757 -5.4625 -5.4625 -4.3967 -4.3967 -4.2968 -4.2968 -3.9106 -3.9106 -3.5283 -3.5283 -2.5624 -2.5624 -2.1023 -2.1023 -1.6668 -1.6668 -1.2315 -1.2315 -0.7069 -0.7069 1.2498 1.2498 1.7431 1.7431 2.0793 2.0793 2.6831 2.6831 3.0584 3.0584 3.2285 3.2285 3.4190 3.4190 3.6059 3.6059 3.7723 3.7723 3.8086 3.8086 4.1419 4.1419 4.3306 4.3306 4.5217 4.5217 4.7971 4.7971 5.2406 5.2406 5.5634 5.5634 5.7035 5.7035 6.3250 6.3250 7.1372 7.1372 7.4679 7.4679 7.7021 7.7021 7.9219 7.9219 8.2923 8.2923 8.6401 8.6401 k = 0.6155 0.0616-1.9760 ( 6935 PWs) bands (ev): -5.6336 -5.6336 -5.5138 -5.5138 -4.4324 -4.4324 -4.3639 -4.3639 -3.9569 -3.9569 -3.5784 -3.5784 -2.5137 -2.5137 -2.0321 -2.0321 -1.6149 -1.6149 -1.1557 -1.1557 -0.6305 -0.6305 1.3036 1.3036 1.7785 1.7785 2.1173 2.1173 2.7102 2.7102 3.0959 3.0959 3.2638 3.2638 3.4657 3.4657 3.6336 3.6336 3.8087 3.8087 3.8414 3.8414 4.1706 4.1706 4.3848 4.3848 4.5438 4.5438 4.8292 4.8292 5.2717 5.2717 5.6078 5.6078 5.7491 5.7491 6.3185 6.3185 7.1472 7.1472 7.4767 7.4767 7.7192 7.7192 7.9145 7.9145 8.2848 8.2848 8.6555 8.6555 k = 0.6116 0.0612-1.9092 ( 6932 PWs) bands (ev): -5.6912 -5.6912 -5.5655 -5.5655 -4.4773 -4.4773 -4.4238 -4.4238 -4.0011 -4.0011 -3.6302 -3.6302 -2.4657 -2.4657 -1.9621 -1.9621 -1.5683 -1.5683 -1.0768 -1.0768 -0.5522 -0.5522 1.3651 1.3651 1.8100 1.8100 2.1738 2.1738 2.7395 2.7395 3.1351 3.1351 3.3003 3.3003 3.4903 3.4903 3.6501 3.6501 3.8581 3.8581 3.8952 3.8952 4.2111 4.2111 4.4423 4.4423 4.5720 4.5720 4.8635 4.8635 5.2982 5.2982 5.6471 5.6471 5.7960 5.7960 6.3110 6.3110 7.1623 7.1623 7.4981 7.4981 7.7346 7.7346 7.9095 7.9095 8.2755 8.2755 8.6712 8.6712 k = 0.6078 0.0608-1.8423 ( 6924 PWs) bands (ev): -5.7482 -5.7482 -5.6171 -5.6171 -4.5331 -4.5331 -4.4745 -4.4745 -4.0433 -4.0433 -3.6831 -3.6831 -2.4191 -2.4191 -1.8940 -1.8940 -1.5254 -1.5254 -0.9964 -0.9964 -0.4721 -0.4721 1.4339 1.4339 1.8417 1.8417 2.2447 2.2447 2.7715 2.7715 3.1756 3.1756 3.3377 3.3377 3.4856 3.4856 3.6925 3.6925 3.8956 3.8956 3.9607 3.9607 4.2661 4.2661 4.5037 4.5037 4.6078 4.6078 4.8999 4.8999 5.3214 5.3214 5.6785 5.6785 5.8434 5.8434 6.3030 6.3030 7.1849 7.1849 7.5295 7.5295 7.7464 7.7464 7.9092 7.9092 8.2642 8.2642 8.6867 8.6867 k = 0.6039 0.0605-1.7755 ( 6920 PWs) bands (ev): -5.8044 -5.8044 -5.6684 -5.6684 -4.5947 -4.5947 -4.5199 -4.5199 -4.0835 -4.0835 -3.7363 -3.7363 -2.3748 -2.3748 -1.8298 -1.8298 -1.4841 -1.4841 -0.9159 -0.9159 -0.3900 -0.3900 1.5094 1.5094 1.8777 1.8777 2.3259 2.3259 2.8067 2.8067 3.2160 3.2160 3.3756 3.3756 3.4676 3.4676 3.7560 3.7560 3.9291 3.9291 4.0183 4.0183 4.3327 4.3327 4.5719 4.5719 4.6526 4.6526 4.9383 4.9383 5.3424 5.3424 5.7002 5.7002 5.8912 5.8912 6.2954 6.2954 7.2154 7.2154 7.5683 7.5683 7.7542 7.7542 7.9156 7.9156 8.2508 8.2508 8.7009 8.7009 k = 0.6001 0.0601-1.7086 ( 6913 PWs) bands (ev): -5.8596 -5.8596 -5.7191 -5.7191 -4.6574 -4.6574 -4.5641 -4.5641 -4.1220 -4.1220 -3.7894 -3.7894 -2.3333 -2.3333 -1.7719 -1.7719 -1.4418 -1.4418 -0.8366 -0.8366 -0.3059 -0.3059 1.5907 1.5907 1.9214 1.9214 2.4145 2.4145 2.8453 2.8453 3.2543 3.2543 3.4121 3.4121 3.4540 3.4540 3.8303 3.8303 3.9600 3.9600 4.0682 4.0682 4.4013 4.4013 4.6510 4.6510 4.7075 4.7075 4.9786 4.9786 5.3619 5.3619 5.7112 5.7112 5.9395 5.9395 6.2892 6.2892 7.2524 7.2524 7.6094 7.6094 7.7618 7.7618 7.9294 7.9294 8.2352 8.2352 8.7112 8.7112 k = 0.5962 0.0597-1.6418 ( 6909 PWs) bands (ev): -5.9136 -5.9136 -5.7691 -5.7691 -4.7194 -4.7194 -4.6084 -4.6084 -4.1589 -4.1589 -3.8420 -3.8420 -2.2952 -2.2952 -1.7226 -1.7226 -1.3960 -1.3960 -0.7597 -0.7597 -0.2198 -0.2198 1.6765 1.6765 1.9751 1.9751 2.5083 2.5083 2.8872 2.8872 3.2860 3.2860 3.4346 3.4346 3.4674 3.4674 3.9086 3.9086 3.9902 3.9902 4.1155 4.1155 4.4631 4.4631 4.7391 4.7391 4.7760 4.7760 5.0207 5.0207 5.3803 5.3803 5.7120 5.7120 5.9880 5.9880 6.2855 6.2855 7.2930 7.2930 7.6414 7.6414 7.7816 7.7816 7.9490 7.9490 8.2179 8.2179 8.7116 8.7116 k = 0.5924 0.0593-1.5750 ( 6909 PWs) bands (ev): -5.9663 -5.9663 -5.8181 -5.8181 -4.7799 -4.7799 -4.6528 -4.6528 -4.1943 -4.1943 -3.8937 -3.8937 -2.2608 -2.2608 -1.6833 -1.6833 -1.3451 -1.3451 -0.6860 -0.6860 -0.1318 -0.1318 1.7656 1.7656 2.0404 2.0404 2.6055 2.6055 2.9323 2.9323 3.3062 3.3062 3.4537 3.4537 3.5054 3.5054 3.9747 3.9747 4.0338 4.0338 4.1641 4.1641 4.5163 4.5163 4.8191 4.8191 4.8713 4.8713 5.0652 5.0652 5.3977 5.3977 5.7047 5.7047 6.0357 6.0357 6.2858 6.2858 7.3339 7.3339 7.6527 7.6527 7.8263 7.8263 7.9726 7.9726 8.2003 8.2003 8.6894 8.6894 k = 0.5885 0.0589-1.5081 ( 6903 PWs) bands (ev): -6.0175 -6.0175 -5.8659 -5.8659 -4.8386 -4.8386 -4.6971 -4.6971 -4.2284 -4.2284 -3.9443 -3.9443 -2.2304 -2.2304 -1.6541 -1.6541 -1.2889 -1.2889 -0.6161 -0.6161 -0.0419 -0.0419 1.8570 1.8570 2.1182 2.1182 2.7050 2.7050 2.9799 2.9799 3.3174 3.3174 3.4892 3.4892 3.5481 3.5481 4.0074 4.0074 4.1107 4.1107 4.2169 4.2169 4.5637 4.5637 4.8926 4.8926 4.9822 4.9822 5.1138 5.1138 5.4143 5.4143 5.6925 5.6925 6.0799 6.0799 6.2921 6.2921 7.3711 7.3711 7.6494 7.6494 7.8874 7.8874 7.9992 7.9992 8.1858 8.1858 8.6299 8.6299 k = 0.5847 0.0585-1.4413 ( 6905 PWs) bands (ev): -6.0670 -6.0670 -5.9124 -5.9124 -4.8953 -4.8953 -4.7410 -4.7410 -4.2612 -4.2612 -3.9936 -3.9936 -2.2039 -2.2039 -1.6339 -1.6339 -1.2286 -1.2286 -0.5503 -0.5503 0.0496 0.0496 1.9500 1.9500 2.2084 2.2084 2.8055 2.8055 3.0288 3.0288 3.3287 3.3287 3.5371 3.5371 3.5929 3.5929 4.0265 4.0265 4.1979 4.1979 4.2777 4.2777 4.6082 4.6082 4.9670 4.9670 5.0854 5.0854 5.1748 5.1748 5.4300 5.4300 5.6807 5.6807 6.1164 6.1164 6.3084 6.3084 7.3995 7.3995 7.6439 7.6439 7.9388 7.9388 8.0361 8.0361 8.1818 8.1818 8.5385 8.5385 k = 0.5808 0.0581-1.3745 ( 6922 PWs) bands (ev): -6.1149 -6.1149 -5.9576 -5.9576 -4.9498 -4.9498 -4.7843 -4.7843 -4.2928 -4.2928 -4.0415 -4.0415 -2.1814 -2.1814 -1.6209 -1.6209 -1.1658 -1.1658 -0.4888 -0.4888 0.1422 0.1422 2.0451 2.0451 2.3097 2.3097 2.9063 2.9063 3.0773 3.0773 3.3479 3.3479 3.5923 3.5923 3.6396 3.6396 4.0420 4.0420 4.2782 4.2782 4.3539 4.3539 4.6520 4.6520 5.0428 5.0428 5.1579 5.1579 5.2602 5.2602 5.4452 5.4452 5.6771 5.6771 6.1404 6.1404 6.3383 6.3383 7.4140 7.4140 7.6453 7.6453 7.9515 7.9515 8.0897 8.0897 8.2005 8.2005 8.4355 8.4355 k = 0.5770 0.0578-1.3076 ( 6912 PWs) bands (ev): -6.1609 -6.1609 -6.0011 -6.0011 -5.0021 -5.0021 -4.8267 -4.8267 -4.3232 -4.3232 -4.0877 -4.0877 -2.1627 -2.1627 -1.6136 -1.6136 -1.1023 -1.1023 -0.4315 -0.4315 0.2355 0.2355 2.1430 2.1430 2.4199 2.4199 3.0066 3.0066 3.1240 3.1240 3.3792 3.3792 3.6519 3.6519 3.6892 3.6892 4.0565 4.0565 4.3464 4.3464 4.4477 4.4477 4.6972 4.6972 5.1191 5.1191 5.2088 5.2088 5.3441 5.3441 5.4632 5.4632 5.6950 5.6950 6.1513 6.1513 6.3822 6.3822 7.4115 7.4115 7.6581 7.6581 7.9306 7.9306 8.1324 8.1324 8.2358 8.2358 8.3554 8.3554 k = 0.5731 0.0574-1.2408 ( 6932 PWs) bands (ev): -6.2051 -6.2051 -6.0431 -6.0431 -5.0521 -5.0521 -4.8679 -4.8679 -4.3525 -4.3525 -4.1321 -4.1321 -2.1475 -2.1475 -1.6105 -1.6105 -1.0395 -1.0395 -0.3782 -0.3782 0.3289 0.3289 2.2443 2.2443 2.5368 2.5368 3.1062 3.1062 3.1688 3.1688 3.4241 3.4241 3.7120 3.7120 3.7446 3.7446 4.0710 4.0710 4.4091 4.4091 4.5495 4.5495 4.7461 4.7461 5.1917 5.1917 5.2542 5.2542 5.3893 5.3893 5.4933 5.4933 5.7492 5.7492 6.1519 6.1519 6.4363 6.4363 7.3943 7.3943 7.6807 7.6807 7.8896 7.8896 8.1259 8.1259 8.2234 8.2234 8.3884 8.3884 k = 0.5693 0.0570-1.1740 ( 6954 PWs) bands (ev): -6.2473 -6.2473 -6.0833 -6.0833 -5.0997 -5.0997 -4.9078 -4.9078 -4.3806 -4.3806 -4.1748 -4.1748 -2.1356 -2.1356 -1.6108 -1.6108 -0.9784 -0.9784 -0.3289 -0.3289 0.4218 0.4218 2.3495 2.3495 2.6577 2.6577 3.2009 3.2009 3.2177 3.2177 3.4806 3.4806 3.7684 3.7684 3.8100 3.8100 4.0867 4.0867 4.4704 4.4704 4.6498 4.6498 4.8036 4.8036 5.2478 5.2478 5.3064 5.3064 5.3992 5.3992 5.5320 5.5320 5.8391 5.8391 6.1456 6.1456 6.4969 6.4969 7.3674 7.3674 7.7062 7.7062 7.8361 7.8361 8.0446 8.0446 8.2410 8.2410 8.4109 8.4109 k = 0.5654 0.0566-1.1071 ( 6960 PWs) bands (ev): -6.2876 -6.2876 -6.1216 -6.1216 -5.1449 -5.1449 -4.9461 -4.9461 -4.4075 -4.4075 -4.2154 -4.2154 -2.1267 -2.1267 -1.6135 -1.6135 -0.9199 -0.9199 -0.2832 -0.2832 0.5137 0.5137 2.4586 2.4586 2.7800 2.7800 3.2558 3.2558 3.3097 3.3097 3.5449 3.5449 3.8219 3.8219 3.8846 3.8846 4.1044 4.1044 4.5316 4.5316 4.7372 4.7372 4.8784 4.8784 5.2776 5.2776 5.3595 5.3595 5.4114 5.4114 5.5728 5.5728 5.9471 5.9471 6.1351 6.1351 6.5614 6.5614 7.3351 7.3351 7.7144 7.7144 7.7869 7.7869 7.9535 7.9535 8.2667 8.2667 8.3328 8.3328 k = 0.5616 0.0562-1.0403 ( 6959 PWs) bands (ev): -6.3257 -6.3257 -6.1581 -6.1581 -5.1877 -5.1877 -4.9828 -4.9828 -4.4331 -4.4331 -4.2541 -4.2541 -2.1203 -2.1203 -1.6182 -1.6182 -0.8646 -0.8646 -0.2410 -0.2410 0.6040 0.6040 2.5713 2.5713 2.9009 2.9009 3.3072 3.3072 3.4128 3.4128 3.6130 3.6130 3.8755 3.8755 3.9655 3.9655 4.1253 4.1253 4.5928 4.5928 4.8057 4.8057 4.9745 4.9745 5.2886 5.2886 5.3752 5.3752 5.4661 5.4661 5.6198 5.6198 6.0514 6.0514 6.1282 6.1282 6.6276 6.6276 7.3004 7.3004 7.6611 7.6611 7.7756 7.7756 7.8838 7.8838 8.2202 8.2202 8.3240 8.3240 k = 0.5577 0.0558-0.9735 ( 6959 PWs) bands (ev): -6.3618 -6.3618 -6.1927 -6.1927 -5.2280 -5.2280 -5.0178 -5.0178 -4.4574 -4.4574 -4.2907 -4.2907 -2.1162 -2.1162 -1.6243 -1.6243 -0.8128 -0.8128 -0.2021 -0.2021 0.6923 0.6923 2.6868 2.6868 3.0177 3.0177 3.3647 3.3647 3.5207 3.5207 3.6817 3.6817 3.9311 3.9311 4.0499 4.0499 4.1511 4.1511 4.6536 4.6536 4.8615 4.8615 5.0810 5.0810 5.2900 5.2900 5.3821 5.3821 5.5300 5.5300 5.6783 5.6783 6.0831 6.0831 6.1845 6.1845 6.6935 6.6935 7.2657 7.2657 7.5825 7.5825 7.7383 7.7383 7.8705 7.8705 8.1314 8.1314 8.3555 8.3555 k = 0.5539 0.0554-0.9066 ( 6960 PWs) bands (ev): -6.3957 -6.3957 -6.2252 -6.2252 -5.2658 -5.2658 -5.0508 -5.0508 -4.4805 -4.4805 -4.3251 -4.3251 -2.1140 -2.1140 -1.6313 -1.6313 -0.7649 -0.7649 -0.1663 -0.1663 0.7780 0.7780 2.8042 2.8042 3.1281 3.1281 3.4291 3.4291 3.6342 3.6342 3.7491 3.7491 3.9900 3.9900 4.1307 4.1307 4.1886 4.1886 4.7137 4.7137 4.9114 4.9114 5.1757 5.1757 5.3006 5.3006 5.3933 5.3933 5.5860 5.5860 5.7497 5.7497 6.0666 6.0666 6.2725 6.2725 6.7560 6.7560 7.2330 7.2330 7.5068 7.5068 7.6751 7.6751 7.8905 7.8905 8.0435 8.0435 8.3807 8.3807 k = 0.5500 0.0551-0.8398 ( 6961 PWs) bands (ev): -6.4273 -6.4273 -6.2556 -6.2556 -5.3011 -5.3011 -5.0818 -5.0818 -4.5021 -4.5021 -4.3573 -4.3573 -2.1133 -2.1133 -1.6391 -1.6391 -0.7209 -0.7209 -0.1337 -0.1337 0.8605 0.8605 2.9224 2.9224 3.2305 3.2305 3.4997 3.4997 3.7520 3.7520 3.8163 3.8163 4.0537 4.0537 4.1878 4.1878 4.2570 4.2570 4.7719 4.7719 4.9579 4.9579 5.2212 5.2212 5.3398 5.3398 5.4270 5.4270 5.6341 5.6341 5.8283 5.8283 6.0481 6.0481 6.3408 6.3408 6.8106 6.8106 7.2051 7.2051 7.4452 7.4452 7.6147 7.6147 7.8925 7.8925 7.9819 7.9819 8.3633 8.3633 k = 0.5462 0.0547-0.7729 ( 6962 PWs) bands (ev): -6.4568 -6.4568 -6.2840 -6.2840 -5.3338 -5.3338 -5.1108 -5.1108 -4.5224 -4.5224 -4.3873 -4.3873 -2.1138 -2.1138 -1.6473 -1.6473 -0.6811 -0.6811 -0.1041 -0.1041 0.9396 0.9396 3.0400 3.0400 3.3240 3.3240 3.5758 3.5758 3.8556 3.8556 3.9011 3.9011 4.1229 4.1229 4.2305 4.2305 4.3463 4.3463 4.8271 4.8271 5.0014 5.0014 5.2360 5.2360 5.3608 5.3608 5.5104 5.5104 5.6781 5.6781 5.8963 5.8963 6.0462 6.0462 6.3773 6.3773 6.8519 6.8519 7.1849 7.1849 7.4008 7.4008 7.5711 7.5711 7.8282 7.8282 7.9889 7.9889 8.2594 8.2594 k = 0.5423 0.0543-0.7061 ( 6964 PWs) bands (ev): -6.4840 -6.4840 -6.3102 -6.3102 -5.3640 -5.3640 -5.1377 -5.1377 -4.5411 -4.5411 -4.4150 -4.4150 -2.1152 -2.1152 -1.6557 -1.6557 -0.6452 -0.6452 -0.0774 -0.0774 1.0147 1.0147 3.1555 3.1555 3.4075 3.4075 3.6570 3.6570 3.9249 3.9249 4.0214 4.0214 4.1970 4.1970 4.2775 4.2775 4.4392 4.4392 4.8774 4.8774 5.0425 5.0425 5.2519 5.2519 5.3649 5.3649 5.6011 5.6011 5.7261 5.7261 5.9200 5.9200 6.0949 6.0949 6.3777 6.3777 6.8750 6.8750 7.1739 7.1739 7.3672 7.3672 7.5583 7.5583 7.7453 7.7453 8.0088 8.0088 8.1117 8.1117 k = 0.5385 0.0539-0.6393 ( 6960 PWs) bands (ev): -6.5089 -6.5089 -6.3343 -6.3343 -5.3916 -5.3916 -5.1624 -5.1624 -4.5584 -4.5584 -4.4405 -4.4405 -2.1173 -2.1173 -1.6640 -1.6640 -0.6132 -0.6132 -0.0536 -0.0536 1.0855 1.0855 3.2675 3.2675 3.4795 3.4795 3.7442 3.7442 3.9875 3.9875 4.1436 4.1436 4.2710 4.2710 4.3418 4.3418 4.5304 4.5304 4.9206 4.9206 5.0838 5.0838 5.2746 5.2746 5.3675 5.3675 5.6602 5.6602 5.7810 5.7810 5.9221 5.9221 6.1777 6.1777 6.3520 6.3520 6.8772 6.8772 7.1666 7.1666 7.3433 7.3433 7.5715 7.5715 7.6691 7.6691 7.9339 7.9339 8.0154 8.0154 k = 0.5346 0.0535-0.5724 ( 6958 PWs) bands (ev): -6.5315 -6.5315 -6.3561 -6.3561 -5.4166 -5.4166 -5.1849 -5.1849 -4.5742 -4.5742 -4.4635 -4.4635 -2.1198 -2.1198 -1.6720 -1.6720 -0.5849 -0.5849 -0.0326 -0.0326 1.1514 1.1514 3.3736 3.3736 3.5398 3.5398 3.8378 3.8378 4.0502 4.0502 4.2493 4.2493 4.3405 4.3405 4.4376 4.4376 4.6166 4.6166 4.9564 4.9564 5.1298 5.1298 5.2944 5.2944 5.3814 5.3814 5.6860 5.6860 5.7985 5.7985 5.9634 5.9634 6.2223 6.2223 6.3589 6.3589 6.8576 6.8576 7.1535 7.1535 7.3359 7.3359 7.5558 7.5558 7.6200 7.6200 7.8201 7.8201 7.9132 7.9132 k = 0.5308 0.0531-0.5056 ( 6961 PWs) bands (ev): -6.5518 -6.5518 -6.3757 -6.3757 -5.4390 -5.4390 -5.2051 -5.2051 -4.5884 -4.5884 -4.4842 -4.4842 -2.1226 -2.1226 -1.6796 -1.6796 -0.5603 -0.5603 -0.0142 -0.0142 1.2120 1.2120 3.4691 3.4691 3.5929 3.5929 3.9362 3.9362 4.1129 4.1129 4.3277 4.3277 4.4195 4.4195 4.5569 4.5569 4.6953 4.6953 4.9887 4.9887 5.1822 5.1822 5.2986 5.2986 5.4181 5.4181 5.6896 5.6896 5.7777 5.7777 6.0168 6.0168 6.1980 6.1980 6.4500 6.4500 6.8173 6.8173 7.1355 7.1355 7.3295 7.3295 7.4839 7.4839 7.5653 7.5653 7.7728 7.7728 7.8362 7.8362 k = 0.5269 0.0527-0.4388 ( 6957 PWs) bands (ev): -6.5698 -6.5698 -6.3931 -6.3931 -5.4588 -5.4588 -5.2230 -5.2230 -4.6010 -4.6010 -4.5026 -4.5026 -2.1254 -2.1254 -1.6867 -1.6867 -0.5390 -0.5390 0.0016 0.0016 1.2669 1.2669 3.5429 3.5429 3.6511 3.6511 4.0360 4.0360 4.1743 4.1743 4.3879 4.3879 4.5106 4.5106 4.6792 4.6792 4.7674 4.7674 5.0251 5.0251 5.2340 5.2340 5.2980 5.2980 5.4705 5.4705 5.6731 5.6731 5.7537 5.7537 5.9937 5.9937 6.2232 6.2232 6.5569 6.5569 6.7634 6.7634 7.1169 7.1169 7.2886 7.2886 7.3810 7.3810 7.5426 7.5426 7.6812 7.6812 7.8787 7.8787 k = 0.5231 0.0524-0.3719 ( 6955 PWs) bands (ev): -6.5853 -6.5853 -6.4082 -6.4082 -5.4759 -5.4759 -5.2385 -5.2385 -4.6120 -4.6120 -4.5185 -4.5185 -2.1282 -2.1282 -1.6931 -1.6931 -0.5209 -0.5209 0.0149 0.0149 1.3157 1.3157 3.5865 3.5865 3.7241 3.7241 4.1319 4.1319 4.2333 4.2333 4.4443 4.4443 4.6052 4.6052 4.7717 4.7717 4.8512 4.8512 5.0727 5.0727 5.2480 5.2480 5.3350 5.3350 5.5248 5.5248 5.6450 5.6450 5.7366 5.7366 5.9149 5.9149 6.2816 6.2816 6.6278 6.6278 6.7274 6.7274 7.0871 7.0871 7.2154 7.2154 7.3111 7.3111 7.4942 7.4942 7.6603 7.6603 7.9347 7.9347 k = 0.5192 0.0520-0.3051 ( 6972 PWs) bands (ev): -6.5985 -6.5985 -6.4210 -6.4210 -5.4905 -5.4905 -5.2518 -5.2518 -4.6213 -4.6213 -4.5320 -4.5320 -2.1307 -2.1307 -1.6986 -1.6986 -0.5060 -0.5060 0.0259 0.0259 1.3578 1.3578 3.6103 3.6103 3.8022 3.8022 4.2133 4.2133 4.2958 4.2958 4.5018 4.5018 4.6944 4.6944 4.8251 4.8251 4.9493 4.9493 5.1334 5.1334 5.2331 5.2331 5.4035 5.4035 5.5448 5.5448 5.6469 5.6469 5.7248 5.7248 5.8271 5.8271 6.3151 6.3151 6.6050 6.6050 6.7439 6.7439 7.0449 7.0449 7.1794 7.1794 7.2659 7.2659 7.4179 7.4179 7.7101 7.7101 7.9772 7.9772 k = 0.5154 0.0516-0.2383 ( 6976 PWs) bands (ev): -6.6094 -6.6094 -6.4314 -6.4314 -5.5024 -5.5024 -5.2626 -5.2626 -4.6289 -4.6289 -4.5430 -4.5430 -2.1329 -2.1329 -1.7033 -1.7033 -0.4939 -0.4939 0.0347 0.0347 1.3930 1.3930 3.6242 3.6242 3.8748 3.8748 4.2659 4.2659 4.3744 4.3744 4.5593 4.5593 4.7613 4.7613 4.8756 4.8756 5.0304 5.0304 5.1821 5.1821 5.2372 5.2372 5.4739 5.4739 5.5174 5.5174 5.6866 5.6866 5.7241 5.7241 5.7567 5.7567 6.2916 6.2916 6.5750 6.5750 6.7005 6.7005 7.0381 7.0381 7.1798 7.1798 7.2371 7.2371 7.3777 7.3777 7.7787 7.7787 7.9943 7.9943 k = 0.5115 0.0512-0.1714 ( 6985 PWs) bands (ev): -6.6178 -6.6178 -6.4396 -6.4396 -5.5117 -5.5117 -5.2710 -5.2710 -4.6349 -4.6349 -4.5517 -4.5517 -2.1347 -2.1347 -1.7070 -1.7070 -0.4846 -0.4846 0.0414 0.0414 1.4208 1.4208 3.6326 3.6326 3.9362 3.9362 4.2952 4.2952 4.4644 4.4644 4.6120 4.6120 4.7933 4.7933 4.9329 4.9329 5.0830 5.0830 5.1826 5.1826 5.2971 5.2971 5.4662 5.4662 5.5591 5.5591 5.6596 5.6596 5.7116 5.7116 5.8050 5.8050 6.2167 6.2167 6.5504 6.5504 6.6113 6.6113 7.0341 7.0341 7.1647 7.1647 7.2814 7.2814 7.3790 7.3790 7.8510 7.8510 7.9604 7.9604 k = 0.5077 0.0508-0.1046 ( 6972 PWs) bands (ev): -6.6238 -6.6238 -6.4454 -6.4454 -5.5183 -5.5183 -5.2771 -5.2771 -4.6392 -4.6392 -4.5578 -4.5578 -2.1360 -2.1360 -1.7097 -1.7097 -0.4781 -0.4781 0.0461 0.0461 1.4409 1.4409 3.6376 3.6376 3.9830 3.9830 4.3115 4.3115 4.5561 4.5561 4.6540 4.6540 4.7981 4.7981 4.9687 4.9687 5.1097 5.1097 5.1978 5.1978 5.3438 5.3438 5.4415 5.4415 5.6095 5.6095 5.6247 5.6247 5.7250 5.7250 5.8863 5.8863 6.1212 6.1212 6.5083 6.5083 6.5254 6.5254 7.0076 7.0076 7.1775 7.1775 7.3487 7.3487 7.3991 7.3991 7.8681 7.8681 7.9264 7.9264 k = 0.5038 0.0504-0.0377 ( 6984 PWs) bands (ev): -6.6274 -6.6274 -6.4489 -6.4489 -5.5222 -5.5222 -5.2807 -5.2807 -4.6418 -4.6418 -4.5615 -4.5615 -2.1368 -2.1368 -1.7114 -1.7114 -0.4742 -0.4742 0.0489 0.0489 1.4530 1.4530 3.6402 3.6402 4.0123 4.0123 4.3198 4.3198 4.6436 4.6436 4.6803 4.6803 4.7753 4.7753 4.9730 4.9730 5.1319 5.1319 5.2194 5.2194 5.3510 5.3510 5.4451 5.4451 5.5786 5.5786 5.6763 5.6763 5.7472 5.7472 5.9589 5.9589 6.0344 6.0344 6.4437 6.4437 6.4782 6.4782 6.9819 6.9819 7.2096 7.2096 7.3948 7.3948 7.4182 7.4182 7.8046 7.8046 7.9734 7.9734 k = 0.5000 0.0501 0.0291 ( 6972 PWs) bands (ev): -6.6286 -6.6286 -6.4501 -6.4501 -5.5236 -5.5236 -5.2819 -5.2819 -4.6426 -4.6426 -4.5627 -4.5627 -2.1371 -2.1371 -1.7119 -1.7119 -0.4729 -0.4729 0.0498 0.0498 1.4571 1.4571 3.6411 3.6411 4.0223 4.0223 4.3223 4.3223 4.6891 4.6891 4.7107 4.7107 4.7307 4.7307 4.9710 4.9710 5.1421 5.1421 5.2282 5.2282 5.3467 5.3467 5.4522 5.4522 5.5681 5.5681 5.7008 5.7008 5.7579 5.7579 5.9907 5.9907 5.9953 5.9953 6.4139 6.4139 6.4605 6.4605 6.9723 6.9723 7.2262 7.2262 7.4125 7.4125 7.4221 7.4221 7.7808 7.7808 7.9831 7.9831 k = 0.5000-2.4724-1.4370 ( 6948 PWs) bands (ev): -5.0732 -5.0732 -5.0583 -5.0583 -4.3018 -4.3018 -3.4880 -3.4880 -3.4250 -3.4250 -3.4120 -3.4120 -2.9696 -2.9696 -2.5110 -2.5110 -2.3274 -2.3274 -1.7669 -1.7669 -1.2971 -1.2971 0.9932 0.9932 1.6230 1.6230 1.9107 1.9107 2.4665 2.4665 2.8204 2.8204 3.0001 3.0001 3.2175 3.2175 3.2643 3.2643 3.5508 3.5508 3.6440 3.6440 3.9003 3.9003 4.1642 4.1642 4.2727 4.2727 4.6861 4.6861 4.8683 4.8683 5.3833 5.3833 5.8910 5.8910 5.9443 5.9443 7.0434 7.0434 7.4417 7.4417 7.5928 7.5928 7.8390 7.8390 8.0298 8.0298 8.5583 8.5583 k = 0.5662-2.4624-1.4312 ( 6952 PWs) bands (ev): -5.0732 -5.0732 -5.0583 -5.0583 -4.3018 -4.3018 -3.4877 -3.4877 -3.4257 -3.4257 -3.4118 -3.4118 -2.9685 -2.9685 -2.5159 -2.5159 -2.3222 -2.3222 -1.7686 -1.7686 -1.2966 -1.2966 0.9944 0.9944 1.6098 1.6098 1.9295 1.9295 2.4636 2.4636 2.8245 2.8245 2.9992 2.9992 3.1885 3.1885 3.2549 3.2549 3.5879 3.5879 3.6417 3.6417 3.9073 3.9073 4.1296 4.1296 4.3140 4.3140 4.6774 4.6774 4.8659 4.8659 5.3776 5.3776 5.8155 5.8155 6.0173 6.0173 7.0653 7.0653 7.3940 7.3940 7.6374 7.6374 7.8025 7.8025 8.0743 8.0743 8.5497 8.5497 k = 0.6324-2.4524-1.4253 ( 6947 PWs) bands (ev): -5.0732 -5.0732 -5.0583 -5.0583 -4.3018 -4.3018 -3.4868 -3.4868 -3.4278 -3.4278 -3.4114 -3.4114 -2.9652 -2.9652 -2.5288 -2.5288 -2.3084 -2.3084 -1.7733 -1.7733 -1.2950 -1.2950 0.9980 0.9980 1.5784 1.5784 1.9776 1.9776 2.4557 2.4557 2.8350 2.8350 2.9967 2.9967 3.1073 3.1073 3.2582 3.2582 3.6005 3.6005 3.6997 3.6997 3.9201 3.9201 4.0826 4.0826 4.3839 4.3839 4.6561 4.6561 4.8555 4.8555 5.3633 5.3633 5.7149 5.7149 6.1119 6.1119 7.1214 7.1214 7.3164 7.3164 7.6747 7.6747 7.7768 7.7768 8.1594 8.1594 8.5417 8.5417 k = 0.6987-2.4424-1.4195 ( 6953 PWs) bands (ev): -5.0733 -5.0733 -5.0584 -5.0584 -4.3018 -4.3018 -3.4853 -3.4853 -3.4312 -3.4312 -3.4107 -3.4107 -2.9601 -2.9601 -2.5461 -2.5461 -2.2898 -2.2898 -1.7806 -1.7806 -1.2928 -1.2928 1.0033 1.0033 1.5416 1.5416 2.0423 2.0423 2.4444 2.4444 2.8455 2.8455 2.9887 2.9887 3.0202 3.0202 3.2713 3.2713 3.5725 3.5725 3.8012 3.8012 3.9175 3.9175 4.0681 4.0681 4.4454 4.4454 4.6370 4.6370 4.8330 4.8330 5.3447 5.3447 5.6123 5.6123 6.2104 6.2104 7.1446 7.1446 7.2993 7.2993 7.6200 7.6200 7.8477 7.8477 8.2473 8.2473 8.5455 8.5455 k = 0.7649-2.4324-1.4137 ( 6958 PWs) bands (ev): -5.0735 -5.0735 -5.0584 -5.0584 -4.3018 -4.3018 -3.4833 -3.4833 -3.4357 -3.4357 -3.4098 -3.4098 -2.9538 -2.9538 -2.5645 -2.5645 -2.2697 -2.2697 -1.7894 -1.7894 -1.2902 -1.2902 1.0096 1.0096 1.5071 1.5071 2.1148 2.1148 2.4313 2.4313 2.8325 2.8325 2.9448 2.9448 2.9951 2.9951 3.2901 3.2901 3.5386 3.5386 3.8596 3.8596 3.9331 3.9331 4.0964 4.0964 4.4659 4.4659 4.6434 4.6434 4.8059 4.8059 5.3192 5.3192 5.5182 5.5182 6.3124 6.3124 7.0700 7.0700 7.4025 7.4025 7.5565 7.5565 7.9338 7.9338 8.3226 8.3226 8.5456 8.5456 k = 0.8311-2.4223-1.4079 ( 6948 PWs) bands (ev): -5.0736 -5.0736 -5.0585 -5.0585 -4.3018 -4.3018 -3.4808 -3.4808 -3.4410 -3.4410 -3.4086 -3.4086 -2.9470 -2.9470 -2.5817 -2.5817 -2.2508 -2.2508 -1.7985 -1.7985 -1.2876 -1.2876 1.0157 1.0157 1.4794 1.4794 2.1885 2.1885 2.4172 2.4172 2.7719 2.7719 2.9361 2.9361 2.9906 2.9906 3.3133 3.3133 3.5035 3.5035 3.8318 3.8318 4.0163 4.0163 4.1514 4.1514 4.4386 4.4386 4.6479 4.6479 4.8147 4.8147 5.2696 5.2696 5.4530 5.4530 6.4172 6.4172 6.9720 6.9720 7.4909 7.4909 7.5595 7.5595 8.0120 8.0120 8.3494 8.3494 8.3963 8.3963 Writing output data file Sb8Te3.save init_run : 7.63s CPU 15.29s WALL ( 1 calls) electrons : 14945.20s CPU 15030.56s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 1.78s CPU 2.88s WALL ( 1 calls) Called by electrons: c_bands : 14945.15s CPU 15030.29s WALL ( 1 calls) v_of_rho : 0.74s CPU 1.46s WALL ( 1 calls) v_h : 0.16s CPU 0.23s WALL ( 1 calls) v_xc : 0.58s CPU 1.01s WALL ( 1 calls) newd : 1.24s CPU 1.45s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.28s WALL ( 260 calls) cegterg : 14207.67s CPU 14287.43s WALL ( 941 calls) Called by sum_band: Called by *egterg: h_psi : 13896.62s CPU 13982.13s WALL ( 17873 calls) s_psi : 152.69s CPU 152.90s WALL ( 17873 calls) g_psi : 1.58s CPU 1.58s WALL ( 16672 calls) cdiaghg : 594.71s CPU 591.06s WALL ( 16932 calls) cegterg:over : 131.60s CPU 127.95s WALL ( 16672 calls) cegterg:upda : 38.78s CPU 43.58s WALL ( 16672 calls) cegterg:last : 28.03s CPU 28.78s WALL ( 2178 calls) Called by h_psi: h_psi:vloc : 13603.60s CPU 13658.49s WALL ( 17873 calls) h_psi:vnl : 292.23s CPU 322.03s WALL ( 17873 calls) add_vuspsi : 117.21s CPU 124.14s WALL ( 17873 calls) General routines calbec : 174.89s CPU 197.65s WALL ( 17873 calls) fft : 0.72s CPU 1.64s WALL ( 19 calls) ffts : 0.05s CPU 0.09s WALL ( 4 calls) fftw : 9484.58s CPU 9519.01s WALL ( 1811260 calls) interpolate : 0.18s CPU 0.22s WALL ( 4 calls) davcio : 0.02s CPU 1.47s WALL ( 520 calls) Parallel routines fft_scatter : 3540.30s CPU 3540.69s WALL ( 1811283 calls) PWSCF : 4h10m CPU 4h13m WALL This run was terminated on: 23:35: 1 19Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=