Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21: 1:21 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./NaTaN2.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 45 38 11 885 661 107 Max 46 39 12 886 676 109 Sum 1651 1371 403 31873 24097 3889 bravais-lattice index = 14 lattice parameter (alat) = 11.2280 a.u. unit-cell volume = 324.8971 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 32.00 number of Kohn-Sham states= 40 kinetic-energy cutoff = 67.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.227972 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.860871 celldm(5)= 0.860871 celldm(6)= 0.860871 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.860871 0.508824 0.000000 ) a(3) = ( 0.860871 0.235391 0.451102 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.691884 -1.025527 ) b(2) = ( 0.000000 1.965317 -1.025527 ) b(3) = ( 0.000000 0.000000 2.216794 ) PseudoPot. # 1 for Ta read from file: /users/gautes/Pseudo/Ta.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: ce7a4fa75595c0f83f911fa846a48acf Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1273 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 Na read from file: /users/gautes/Pseudo/Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 13bcaa2858b974004ed12db349b14e76 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1121 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ta 13.00 180.94790 Ta( 1.00) Na 9.00 22.98980 Na( 1.00) N 5.00 14.00670 N( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 382 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 2) = ( 0.0084746 -0.0143380 -0.0086909), wk = 0.0026178 k( 3) = ( 0.0169491 -0.0286760 -0.0173818), wk = 0.0026178 k( 4) = ( 0.0254237 -0.0430140 -0.0260727), wk = 0.0026178 k( 5) = ( 0.0338983 -0.0573520 -0.0347636), wk = 0.0026178 k( 6) = ( 0.0423729 -0.0716900 -0.0434545), wk = 0.0026178 k( 7) = ( 0.0508475 -0.0860280 -0.0521455), wk = 0.0026178 k( 8) = ( 0.0593220 -0.1003660 -0.0608364), wk = 0.0026178 k( 9) = ( 0.0677966 -0.1147040 -0.0695273), wk = 0.0026178 k( 10) = ( 0.0762712 -0.1290420 -0.0782182), wk = 0.0026178 k( 11) = ( 0.0847458 -0.1433800 -0.0869091), wk = 0.0026178 k( 12) = ( 0.0932203 -0.1577180 -0.0956000), wk = 0.0026178 k( 13) = ( 0.1016949 -0.1720560 -0.1042909), wk = 0.0026178 k( 14) = ( 0.1101695 -0.1863940 -0.1129818), wk = 0.0026178 k( 15) = ( 0.1186441 -0.2007320 -0.1216727), wk = 0.0026178 k( 16) = ( 0.1271186 -0.2150700 -0.1303636), wk = 0.0026178 k( 17) = ( 0.1355932 -0.2294080 -0.1390545), wk = 0.0026178 k( 18) = ( 0.1440678 -0.2437460 -0.1477454), wk = 0.0026178 k( 19) = ( 0.1525424 -0.2580840 -0.1564363), wk = 0.0026178 k( 20) = ( 0.1610169 -0.2724220 -0.1651273), wk = 0.0026178 k( 21) = ( 0.1694915 -0.2867600 -0.1738182), wk = 0.0026178 k( 22) = ( 0.1779661 -0.3010980 -0.1825091), wk = 0.0026178 k( 23) = ( 0.1864407 -0.3154360 -0.1912000), wk = 0.0026178 k( 24) = ( 0.1949153 -0.3297740 -0.1998909), wk = 0.0026178 k( 25) = ( 0.2033898 -0.3441120 -0.2085818), wk = 0.0026178 k( 26) = ( 0.2118644 -0.3584500 -0.2172727), wk = 0.0026178 k( 27) = ( 0.2203390 -0.3727880 -0.2259636), wk = 0.0026178 k( 28) = ( 0.2288136 -0.3871260 -0.2346545), wk = 0.0026178 k( 29) = ( 0.2372881 -0.4014640 -0.2433454), wk = 0.0026178 k( 30) = ( 0.2457627 -0.4158020 -0.2520363), wk = 0.0026178 k( 31) = ( 0.2542373 -0.4301400 -0.2607272), wk = 0.0026178 k( 32) = ( 0.2627119 -0.4444780 -0.2694181), wk = 0.0026178 k( 33) = ( 0.2711864 -0.4588160 -0.2781091), wk = 0.0026178 k( 34) = ( 0.2796610 -0.4731540 -0.2868000), wk = 0.0026178 k( 35) = ( 0.2881356 -0.4874920 -0.2954909), wk = 0.0026178 k( 36) = ( 0.2966102 -0.5018300 -0.3041818), wk = 0.0026178 k( 37) = ( 0.3050848 -0.5161680 -0.3128727), wk = 0.0026178 k( 38) = ( 0.3135593 -0.5305060 -0.3215636), wk = 0.0026178 k( 39) = ( 0.3220339 -0.5448440 -0.3302545), wk = 0.0026178 k( 40) = ( 0.3305085 -0.5591820 -0.3389454), wk = 0.0026178 k( 41) = ( 0.3389831 -0.5735200 -0.3476363), wk = 0.0026178 k( 42) = ( 0.3474576 -0.5878580 -0.3563272), wk = 0.0026178 k( 43) = ( 0.3559322 -0.6021960 -0.3650181), wk = 0.0026178 k( 44) = ( 0.3644068 -0.6165340 -0.3737090), wk = 0.0026178 k( 45) = ( 0.3728814 -0.6308720 -0.3824000), wk = 0.0026178 k( 46) = ( 0.3813559 -0.6452100 -0.3910909), wk = 0.0026178 k( 47) = ( 0.3898305 -0.6595480 -0.3997818), wk = 0.0026178 k( 48) = ( 0.3983051 -0.6738860 -0.4084727), wk = 0.0026178 k( 49) = ( 0.4067797 -0.6882240 -0.4171636), wk = 0.0026178 k( 50) = ( 0.4152542 -0.7025620 -0.4258545), wk = 0.0026178 k( 51) = ( 0.4237288 -0.7169000 -0.4345454), wk = 0.0026178 k( 52) = ( 0.4322034 -0.7312380 -0.4432363), wk = 0.0026178 k( 53) = ( 0.4406780 -0.7455760 -0.4519272), wk = 0.0026178 k( 54) = ( 0.4491525 -0.7599140 -0.4606181), wk = 0.0026178 k( 55) = ( 0.4576271 -0.7742520 -0.4693090), wk = 0.0026178 k( 56) = ( 0.4661017 -0.7885900 -0.4779999), wk = 0.0026178 k( 57) = ( 0.4745763 -0.8029280 -0.4866909), wk = 0.0026178 k( 58) = ( 0.4830508 -0.8172660 -0.4953818), wk = 0.0026178 k( 59) = ( 0.4915254 -0.8316040 -0.5040727), wk = 0.0026178 k( 60) = ( 0.5000000 -0.8459420 -0.5127636), wk = 0.0026178 k( 61) = ( 0.5000000 -0.8459420 -0.5127636), wk = 0.0026178 k( 62) = ( 0.5000000 -0.8361842 -0.5288618), wk = 0.0026178 k( 63) = ( 0.5000000 -0.8264263 -0.5449600), wk = 0.0026178 k( 64) = ( 0.5000000 -0.8166685 -0.5610582), wk = 0.0026178 k( 65) = ( 0.5000000 -0.8069106 -0.5771564), wk = 0.0026178 k( 66) = ( 0.5000000 -0.7971528 -0.5932546), wk = 0.0026178 k( 67) = ( 0.5000000 -0.7873949 -0.6093528), wk = 0.0026178 k( 68) = ( 0.5000000 -0.7776371 -0.6254510), wk = 0.0026178 k( 69) = ( 0.5000000 -0.7678792 -0.6415492), wk = 0.0026178 k( 70) = ( 0.5000000 -0.7581214 -0.6576474), wk = 0.0026178 k( 71) = ( 0.5000000 -0.7483635 -0.6737457), wk = 0.0026178 k( 72) = ( 0.5000000 -0.7386057 -0.6898438), wk = 0.0026178 k( 73) = ( 0.5000000 -0.7288478 -0.7059421), wk = 0.0026178 k( 74) = ( 0.5000000 -0.7190900 -0.7220403), wk = 0.0026178 k( 75) = ( 0.5000000 -0.7093321 -0.7381385), wk = 0.0026178 k( 76) = ( 0.5000000 -0.6995743 -0.7542367), wk = 0.0026178 k( 77) = ( 0.5000000 -0.6898165 -0.7703349), wk = 0.0026178 k( 78) = ( 0.5000000 -0.6800586 -0.7864331), wk = 0.0026178 k( 79) = ( 0.5000000 -0.6703008 -0.8025313), wk = 0.0026178 k( 80) = ( 0.5000000 -0.6605429 -0.8186295), wk = 0.0026178 k( 81) = ( 0.5000000 -0.6507851 -0.8347277), wk = 0.0026178 k( 82) = ( 0.5000000 -0.6410272 -0.8508259), wk = 0.0026178 k( 83) = ( 0.5000000 -0.6312694 -0.8669241), wk = 0.0026178 k( 84) = ( 0.5000000 -0.6215115 -0.8830223), wk = 0.0026178 k( 85) = ( 0.5000000 -0.6117537 -0.8991205), wk = 0.0026178 k( 86) = ( 0.5000000 -0.6019958 -0.9152188), wk = 0.0026178 k( 87) = ( 0.5000000 -0.5922380 -0.9313169), wk = 0.0026178 k( 88) = ( 0.5000000 -0.5824801 -0.9474152), wk = 0.0026178 k( 89) = ( 0.5000000 -0.5727223 -0.9635134), wk = 0.0026178 k( 90) = ( 0.5000000 -0.5629644 -0.9796116), wk = 0.0026178 k( 91) = ( 0.5000000 -0.5532066 -0.9957098), wk = 0.0026178 k( 92) = ( 0.5000000 -0.5434487 -1.0118080), wk = 0.0026178 k( 93) = ( 0.5000000 -0.5336909 -1.0279062), wk = 0.0026178 k( 94) = ( 0.5000000 -0.5239330 -1.0440044), wk = 0.0026178 k( 95) = ( 0.5000000 -0.5141752 -1.0601026), wk = 0.0026178 k( 96) = ( 0.5000000 -0.5044173 -1.0762008), wk = 0.0026178 k( 97) = ( 0.5000000 -0.4946595 -1.0922990), wk = 0.0026178 k( 98) = ( 0.5000000 -0.4849016 -1.1083972), wk = 0.0026178 k( 99) = ( 0.8162941 -0.3984164 -0.9426571), wk = 0.0026178 k( 100) = ( 0.8113520 -0.3900549 -0.9266332), wk = 0.0026178 k( 101) = ( 0.8064099 -0.3816935 -0.9106094), wk = 0.0026178 k( 102) = ( 0.8014678 -0.3733320 -0.8945855), wk = 0.0026178 k( 103) = ( 0.7965257 -0.3649706 -0.8785616), wk = 0.0026178 k( 104) = ( 0.7915836 -0.3566091 -0.8625378), wk = 0.0026178 k( 105) = ( 0.7866415 -0.3482477 -0.8465139), wk = 0.0026178 k( 106) = ( 0.7816994 -0.3398862 -0.8304900), wk = 0.0026178 k( 107) = ( 0.7767573 -0.3315247 -0.8144662), wk = 0.0026178 k( 108) = ( 0.7718152 -0.3231633 -0.7984423), wk = 0.0026178 k( 109) = ( 0.7668731 -0.3148018 -0.7824185), wk = 0.0026178 k( 110) = ( 0.7619310 -0.3064404 -0.7663946), wk = 0.0026178 k( 111) = ( 0.7569889 -0.2980789 -0.7503708), wk = 0.0026178 k( 112) = ( 0.7520469 -0.2897175 -0.7343469), wk = 0.0026178 k( 113) = ( 0.7471048 -0.2813560 -0.7183230), wk = 0.0026178 k( 114) = ( 0.7421627 -0.2729946 -0.7022992), wk = 0.0026178 k( 115) = ( 0.7372206 -0.2646331 -0.6862753), wk = 0.0026178 k( 116) = ( 0.7322785 -0.2562717 -0.6702514), wk = 0.0026178 k( 117) = ( 0.7273364 -0.2479102 -0.6542276), wk = 0.0026178 k( 118) = ( 0.7223943 -0.2395488 -0.6382037), wk = 0.0026178 k( 119) = ( 0.7174522 -0.2311873 -0.6221799), wk = 0.0026178 k( 120) = ( 0.7125101 -0.2228259 -0.6061560), wk = 0.0026178 k( 121) = ( 0.7075680 -0.2144644 -0.5901321), wk = 0.0026178 k( 122) = ( 0.7026259 -0.2061030 -0.5741083), wk = 0.0026178 k( 123) = ( 0.6976838 -0.1977415 -0.5580844), wk = 0.0026178 k( 124) = ( 0.6927417 -0.1893801 -0.5420605), wk = 0.0026178 k( 125) = ( 0.6877996 -0.1810186 -0.5260367), wk = 0.0026178 k( 126) = ( 0.6828575 -0.1726572 -0.5100128), wk = 0.0026178 k( 127) = ( 0.6779154 -0.1642957 -0.4939889), wk = 0.0026178 k( 128) = ( 0.6729733 -0.1559343 -0.4779651), wk = 0.0026178 k( 129) = ( 0.6680312 -0.1475728 -0.4619412), wk = 0.0026178 k( 130) = ( 0.6630891 -0.1392114 -0.4459174), wk = 0.0026178 k( 131) = ( 0.6581470 -0.1308499 -0.4298935), wk = 0.0026178 k( 132) = ( 0.6532050 -0.1224884 -0.4138696), wk = 0.0026178 k( 133) = ( 0.6482628 -0.1141270 -0.3978458), wk = 0.0026178 k( 134) = ( 0.6433208 -0.1057655 -0.3818219), wk = 0.0026178 k( 135) = ( 0.6383787 -0.0974041 -0.3657980), wk = 0.0026178 k( 136) = ( 0.6334366 -0.0890426 -0.3497742), wk = 0.0026178 k( 137) = ( 0.6284945 -0.0806812 -0.3337503), wk = 0.0026178 k( 138) = ( 0.6235524 -0.0723197 -0.3177265), wk = 0.0026178 k( 139) = ( 0.6186103 -0.0639583 -0.3017026), wk = 0.0026178 k( 140) = ( 0.6136682 -0.0555968 -0.2856788), wk = 0.0026178 k( 141) = ( 0.6087261 -0.0472354 -0.2696549), wk = 0.0026178 k( 142) = ( 0.6037840 -0.0388739 -0.2536310), wk = 0.0026178 k( 143) = ( 0.5988419 -0.0305125 -0.2376072), wk = 0.0026178 k( 144) = ( 0.5938998 -0.0221510 -0.2215833), wk = 0.0026178 k( 145) = ( 0.5889577 -0.0137896 -0.2055594), wk = 0.0026178 k( 146) = ( 0.5840156 -0.0054281 -0.1895356), wk = 0.0026178 k( 147) = ( 0.5790735 0.0029333 -0.1735117), wk = 0.0026178 k( 148) = ( 0.5741314 0.0112948 -0.1574879), wk = 0.0026178 k( 149) = ( 0.5691893 0.0196562 -0.1414640), wk = 0.0026178 k( 150) = ( 0.5642472 0.0280177 -0.1254401), wk = 0.0026178 k( 151) = ( 0.5593051 0.0363791 -0.1094163), wk = 0.0026178 k( 152) = ( 0.5543630 0.0447406 -0.0933924), wk = 0.0026178 k( 153) = ( 0.5494210 0.0531020 -0.0773685), wk = 0.0026178 k( 154) = ( 0.5444789 0.0614635 -0.0613447), wk = 0.0026178 k( 155) = ( 0.5395368 0.0698250 -0.0453208), wk = 0.0026178 k( 156) = ( 0.5345947 0.0781864 -0.0292970), wk = 0.0026178 k( 157) = ( 0.5296526 0.0865479 -0.0132731), wk = 0.0026178 k( 158) = ( 0.5247105 0.0949093 0.0027507), wk = 0.0026178 k( 159) = ( 0.5197684 0.1032708 0.0187746), wk = 0.0026178 k( 160) = ( 0.5148263 0.1116322 0.0347985), wk = 0.0026178 k( 161) = ( 0.5098842 0.1199937 0.0508223), wk = 0.0026178 k( 162) = ( 0.5049421 0.1283551 0.0668462), wk = 0.0026178 k( 163) = ( 0.5000000 0.1367166 0.0828701), wk = 0.0026178 k( 164) = ( 0.5000000 0.1367166 0.0828701), wk = 0.0026178 k( 165) = ( 0.4821429 0.1318338 0.0799104), wk = 0.0026178 k( 166) = ( 0.4642857 0.1269511 0.0769508), wk = 0.0026178 k( 167) = ( 0.4464286 0.1220684 0.0739911), wk = 0.0026178 k( 168) = ( 0.4285714 0.1171856 0.0710315), wk = 0.0026178 k( 169) = ( 0.4107143 0.1123029 0.0680718), wk = 0.0026178 k( 170) = ( 0.3928571 0.1074202 0.0651122), wk = 0.0026178 k( 171) = ( 0.3750000 0.1025374 0.0621526), wk = 0.0026178 k( 172) = ( 0.3571429 0.0976547 0.0591929), wk = 0.0026178 k( 173) = ( 0.3392857 0.0927720 0.0562333), wk = 0.0026178 k( 174) = ( 0.3214286 0.0878892 0.0532736), wk = 0.0026178 k( 175) = ( 0.3035714 0.0830065 0.0503140), wk = 0.0026178 k( 176) = ( 0.2857143 0.0781238 0.0473543), wk = 0.0026178 k( 177) = ( 0.2678571 0.0732410 0.0443947), wk = 0.0026178 k( 178) = ( 0.2500000 0.0683583 0.0414350), wk = 0.0026178 k( 179) = ( 0.2321429 0.0634755 0.0384754), wk = 0.0026178 k( 180) = ( 0.2142857 0.0585928 0.0355157), wk = 0.0026178 k( 181) = ( 0.1964286 0.0537101 0.0325561), wk = 0.0026178 k( 182) = ( 0.1785714 0.0488273 0.0295965), wk = 0.0026178 k( 183) = ( 0.1607143 0.0439446 0.0266368), wk = 0.0026178 k( 184) = ( 0.1428571 0.0390619 0.0236772), wk = 0.0026178 k( 185) = ( 0.1250000 0.0341791 0.0207175), wk = 0.0026178 k( 186) = ( 0.1071429 0.0292964 0.0177579), wk = 0.0026178 k( 187) = ( 0.0892857 0.0244137 0.0147982), wk = 0.0026178 k( 188) = ( 0.0714286 0.0195309 0.0118386), wk = 0.0026178 k( 189) = ( 0.0535714 0.0146482 0.0088789), wk = 0.0026178 k( 190) = ( 0.0357143 0.0097655 0.0059193), wk = 0.0026178 k( 191) = ( 0.0178571 0.0048827 0.0029596), wk = 0.0026178 k( 192) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 193) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 194) = ( 0.0049544 -0.0083823 -0.0160637), wk = 0.0026178 k( 195) = ( 0.0099088 -0.0167645 -0.0321275), wk = 0.0026178 k( 196) = ( 0.0148632 -0.0251468 -0.0481912), wk = 0.0026178 k( 197) = ( 0.0198176 -0.0335290 -0.0642549), wk = 0.0026178 k( 198) = ( 0.0247720 -0.0419113 -0.0803186), wk = 0.0026178 k( 199) = ( 0.0297263 -0.0502935 -0.0963824), wk = 0.0026178 k( 200) = ( 0.0346807 -0.0586758 -0.1124461), wk = 0.0026178 k( 201) = ( 0.0396351 -0.0670580 -0.1285098), wk = 0.0026178 k( 202) = ( 0.0445895 -0.0754403 -0.1445736), wk = 0.0026178 k( 203) = ( 0.0495439 -0.0838226 -0.1606373), wk = 0.0026178 k( 204) = ( 0.0544983 -0.0922048 -0.1767010), wk = 0.0026178 k( 205) = ( 0.0594527 -0.1005871 -0.1927647), wk = 0.0026178 k( 206) = ( 0.0644071 -0.1089693 -0.2088285), wk = 0.0026178 k( 207) = ( 0.0693615 -0.1173516 -0.2248922), wk = 0.0026178 k( 208) = ( 0.0743159 -0.1257338 -0.2409559), wk = 0.0026178 k( 209) = ( 0.0792703 -0.1341161 -0.2570196), wk = 0.0026178 k( 210) = ( 0.0842246 -0.1424983 -0.2730834), wk = 0.0026178 k( 211) = ( 0.0891790 -0.1508806 -0.2891471), wk = 0.0026178 k( 212) = ( 0.0941334 -0.1592628 -0.3052108), wk = 0.0026178 k( 213) = ( 0.0990878 -0.1676451 -0.3212745), wk = 0.0026178 k( 214) = ( 0.1040422 -0.1760273 -0.3373383), wk = 0.0026178 k( 215) = ( 0.1089966 -0.1844096 -0.3534020), wk = 0.0026178 k( 216) = ( 0.1139510 -0.1927919 -0.3694658), wk = 0.0026178 k( 217) = ( 0.1189054 -0.2011741 -0.3855295), wk = 0.0026178 k( 218) = ( 0.1238598 -0.2095564 -0.4015932), wk = 0.0026178 k( 219) = ( 0.1288142 -0.2179386 -0.4176569), wk = 0.0026178 k( 220) = ( 0.1337686 -0.2263209 -0.4337207), wk = 0.0026178 k( 221) = ( 0.1387229 -0.2347031 -0.4497844), wk = 0.0026178 k( 222) = ( 0.1436773 -0.2430854 -0.4658481), wk = 0.0026178 k( 223) = ( 0.1486317 -0.2514676 -0.4819118), wk = 0.0026178 k( 224) = ( 0.1535861 -0.2598499 -0.4979756), wk = 0.0026178 k( 225) = ( 0.1585405 -0.2682321 -0.5140393), wk = 0.0026178 k( 226) = ( 0.1634949 -0.2766144 -0.5301030), wk = 0.0026178 k( 227) = ( 0.1684493 -0.2849967 -0.5461667), wk = 0.0026178 k( 228) = ( 0.1734037 -0.2933789 -0.5622305), wk = 0.0026178 k( 229) = ( 0.1783581 -0.3017612 -0.5782942), wk = 0.0026178 k( 230) = ( 0.1833124 -0.3101434 -0.5943579), wk = 0.0026178 k( 231) = ( 0.1882669 -0.3185257 -0.6104217), wk = 0.0026178 k( 232) = ( 0.1932212 -0.3269079 -0.6264854), wk = 0.0026178 k( 233) = ( 0.1981756 -0.3352902 -0.6425491), wk = 0.0026178 k( 234) = ( 0.2031300 -0.3436724 -0.6586129), wk = 0.0026178 k( 235) = ( 0.2080844 -0.3520547 -0.6746766), wk = 0.0026178 k( 236) = ( 0.2130388 -0.3604370 -0.6907403), wk = 0.0026178 k( 237) = ( 0.2179932 -0.3688192 -0.7068040), wk = 0.0026178 k( 238) = ( 0.2229476 -0.3772015 -0.7228678), wk = 0.0026178 k( 239) = ( 0.2279020 -0.3855837 -0.7389315), wk = 0.0026178 k( 240) = ( 0.2328564 -0.3939660 -0.7549952), wk = 0.0026178 k( 241) = ( 0.2378107 -0.4023482 -0.7710589), wk = 0.0026178 k( 242) = ( 0.2427651 -0.4107305 -0.7871227), wk = 0.0026178 k( 243) = ( 0.2477195 -0.4191127 -0.8031864), wk = 0.0026178 k( 244) = ( 0.2526739 -0.4274950 -0.8192501), wk = 0.0026178 k( 245) = ( 0.2576283 -0.4358772 -0.8353138), wk = 0.0026178 k( 246) = ( 0.2625827 -0.4442595 -0.8513776), wk = 0.0026178 k( 247) = ( 0.2675371 -0.4526418 -0.8674413), wk = 0.0026178 k( 248) = ( 0.2724915 -0.4610240 -0.8835050), wk = 0.0026178 k( 249) = ( 0.2774459 -0.4694063 -0.8995688), wk = 0.0026178 k( 250) = ( 0.2824003 -0.4777885 -0.9156325), wk = 0.0026178 k( 251) = ( 0.2873547 -0.4861708 -0.9316962), wk = 0.0026178 k( 252) = ( 0.2923091 -0.4945530 -0.9477599), wk = 0.0026178 k( 253) = ( 0.2972634 -0.5029353 -0.9638237), wk = 0.0026178 k( 254) = ( 0.3022178 -0.5113175 -0.9798874), wk = 0.0026178 k( 255) = ( 0.3071722 -0.5196998 -0.9959511), wk = 0.0026178 k( 256) = ( 0.3121266 -0.5280820 -1.0120149), wk = 0.0026178 k( 257) = ( 0.3170810 -0.5364643 -1.0280786), wk = 0.0026178 k( 258) = ( 0.3220354 -0.5448465 -1.0441423), wk = 0.0026178 k( 259) = ( 0.3269898 -0.5532288 -1.0602060), wk = 0.0026178 k( 260) = ( 0.3319442 -0.5616111 -1.0762698), wk = 0.0026178 k( 261) = ( 0.3368986 -0.5699933 -1.0923335), wk = 0.0026178 k( 262) = ( 0.3418530 -0.5783756 -1.1083972), wk = 0.0026178 k( 263) = ( 0.6581470 -0.4416590 -1.0255272), wk = 0.0026178 k( 264) = ( 0.6532050 -0.4235848 -1.0255272), wk = 0.0026178 k( 265) = ( 0.6482628 -0.4055105 -1.0255272), wk = 0.0026178 k( 266) = ( 0.6433208 -0.3874363 -1.0255272), wk = 0.0026178 k( 267) = ( 0.6383787 -0.3693620 -1.0255272), wk = 0.0026178 k( 268) = ( 0.6334366 -0.3512878 -1.0255272), wk = 0.0026178 k( 269) = ( 0.6284945 -0.3332136 -1.0255272), wk = 0.0026178 k( 270) = ( 0.6235524 -0.3151394 -1.0255272), wk = 0.0026178 k( 271) = ( 0.6186103 -0.2970651 -1.0255272), wk = 0.0026178 k( 272) = ( 0.6136682 -0.2789909 -1.0255272), wk = 0.0026178 k( 273) = ( 0.6087261 -0.2609166 -1.0255272), wk = 0.0026178 k( 274) = ( 0.6037840 -0.2428424 -1.0255272), wk = 0.0026178 k( 275) = ( 0.5988419 -0.2247682 -1.0255272), wk = 0.0026178 k( 276) = ( 0.5938998 -0.2066939 -1.0255272), wk = 0.0026178 k( 277) = ( 0.5889577 -0.1886197 -1.0255272), wk = 0.0026178 k( 278) = ( 0.5840156 -0.1705455 -1.0255272), wk = 0.0026178 k( 279) = ( 0.5790735 -0.1524712 -1.0255272), wk = 0.0026178 k( 280) = ( 0.5741314 -0.1343970 -1.0255272), wk = 0.0026178 k( 281) = ( 0.5691893 -0.1163227 -1.0255272), wk = 0.0026178 k( 282) = ( 0.5642472 -0.0982485 -1.0255272), wk = 0.0026178 k( 283) = ( 0.5593051 -0.0801743 -1.0255272), wk = 0.0026178 k( 284) = ( 0.5543630 -0.0621000 -1.0255272), wk = 0.0026178 k( 285) = ( 0.5494210 -0.0440258 -1.0255272), wk = 0.0026178 k( 286) = ( 0.5444789 -0.0259516 -1.0255272), wk = 0.0026178 k( 287) = ( 0.5395368 -0.0078773 -1.0255272), wk = 0.0026178 k( 288) = ( 0.5345947 0.0101969 -1.0255272), wk = 0.0026178 k( 289) = ( 0.5296526 0.0282712 -1.0255272), wk = 0.0026178 k( 290) = ( 0.5247105 0.0463454 -1.0255272), wk = 0.0026178 k( 291) = ( 0.5197684 0.0644196 -1.0255272), wk = 0.0026178 k( 292) = ( 0.5148263 0.0824938 -1.0255272), wk = 0.0026178 k( 293) = ( 0.5098842 0.1005681 -1.0255272), wk = 0.0026178 k( 294) = ( 0.5049421 0.1186423 -1.0255272), wk = 0.0026178 k( 295) = ( 0.5000000 0.1367166 -1.0255272), wk = 0.0026178 k( 296) = ( 0.5000000 0.1367166 -1.0255272), wk = 0.0026178 k( 297) = ( 0.5158147 0.1410408 -1.0172401), wk = 0.0026178 k( 298) = ( 0.5316294 0.1453651 -1.0089531), wk = 0.0026178 k( 299) = ( 0.5474441 0.1496894 -1.0006661), wk = 0.0026178 k( 300) = ( 0.5632588 0.1540136 -0.9923791), wk = 0.0026178 k( 301) = ( 0.5790735 0.1583379 -0.9840921), wk = 0.0026178 k( 302) = ( 0.5948882 0.1626622 -0.9758051), wk = 0.0026178 k( 303) = ( 0.6107029 0.1669864 -0.9675181), wk = 0.0026178 k( 304) = ( 0.6265176 0.1713107 -0.9592311), wk = 0.0026178 k( 305) = ( 0.6423323 0.1756349 -0.9509441), wk = 0.0026178 k( 306) = ( 0.6581470 0.1799592 -0.9426571), wk = 0.0026178 k( 307) = ( 0.6581470 0.1799592 -0.9426571), wk = 0.0026178 k( 308) = ( 0.6552716 0.1791730 -0.9240111), wk = 0.0026178 k( 309) = ( 0.6523962 0.1783867 -0.9053652), wk = 0.0026178 k( 310) = ( 0.6495208 0.1776005 -0.8867192), wk = 0.0026178 k( 311) = ( 0.6466454 0.1768143 -0.8680733), wk = 0.0026178 k( 312) = ( 0.6437700 0.1760281 -0.8494273), wk = 0.0026178 k( 313) = ( 0.6408946 0.1752418 -0.8307814), wk = 0.0026178 k( 314) = ( 0.6380192 0.1744556 -0.8121355), wk = 0.0026178 k( 315) = ( 0.6351438 0.1736694 -0.7934895), wk = 0.0026178 k( 316) = ( 0.6322684 0.1728831 -0.7748435), wk = 0.0026178 k( 317) = ( 0.6293930 0.1720969 -0.7561976), wk = 0.0026178 k( 318) = ( 0.6265176 0.1713107 -0.7375517), wk = 0.0026178 k( 319) = ( 0.6236422 0.1705244 -0.7189057), wk = 0.0026178 k( 320) = ( 0.6207668 0.1697382 -0.7002598), wk = 0.0026178 k( 321) = ( 0.6178914 0.1689520 -0.6816138), wk = 0.0026178 k( 322) = ( 0.6150160 0.1681658 -0.6629678), wk = 0.0026178 k( 323) = ( 0.6121406 0.1673795 -0.6443219), wk = 0.0026178 k( 324) = ( 0.6092652 0.1665933 -0.6256760), wk = 0.0026178 k( 325) = ( 0.6063898 0.1658071 -0.6070300), wk = 0.0026178 k( 326) = ( 0.6035144 0.1650208 -0.5883841), wk = 0.0026178 k( 327) = ( 0.6006390 0.1642346 -0.5697381), wk = 0.0026178 k( 328) = ( 0.5977636 0.1634484 -0.5510922), wk = 0.0026178 k( 329) = ( 0.5948882 0.1626622 -0.5324462), wk = 0.0026178 k( 330) = ( 0.5920128 0.1618759 -0.5138003), wk = 0.0026178 k( 331) = ( 0.5891374 0.1610897 -0.4951543), wk = 0.0026178 k( 332) = ( 0.5862620 0.1603035 -0.4765084), wk = 0.0026178 k( 333) = ( 0.5833866 0.1595172 -0.4578624), wk = 0.0026178 k( 334) = ( 0.5805112 0.1587310 -0.4392165), wk = 0.0026178 k( 335) = ( 0.5776358 0.1579448 -0.4205705), wk = 0.0026178 k( 336) = ( 0.5747604 0.1571585 -0.4019246), wk = 0.0026178 k( 337) = ( 0.5718850 0.1563723 -0.3832786), wk = 0.0026178 k( 338) = ( 0.5690096 0.1555861 -0.3646327), wk = 0.0026178 k( 339) = ( 0.5661342 0.1547999 -0.3459868), wk = 0.0026178 k( 340) = ( 0.5632588 0.1540136 -0.3273408), wk = 0.0026178 k( 341) = ( 0.5603834 0.1532274 -0.3086948), wk = 0.0026178 k( 342) = ( 0.5575080 0.1524412 -0.2900489), wk = 0.0026178 k( 343) = ( 0.5546326 0.1516549 -0.2714030), wk = 0.0026178 k( 344) = ( 0.5517572 0.1508687 -0.2527570), wk = 0.0026178 k( 345) = ( 0.5488818 0.1500825 -0.2341110), wk = 0.0026178 k( 346) = ( 0.5460064 0.1492962 -0.2154651), wk = 0.0026178 k( 347) = ( 0.5431310 0.1485100 -0.1968191), wk = 0.0026178 k( 348) = ( 0.5402556 0.1477238 -0.1781732), wk = 0.0026178 k( 349) = ( 0.5373802 0.1469376 -0.1595273), wk = 0.0026178 k( 350) = ( 0.5345048 0.1461513 -0.1408813), wk = 0.0026178 k( 351) = ( 0.5316294 0.1453651 -0.1222354), wk = 0.0026178 k( 352) = ( 0.5287540 0.1445789 -0.1035894), wk = 0.0026178 k( 353) = ( 0.5258786 0.1437926 -0.0849435), wk = 0.0026178 k( 354) = ( 0.5230032 0.1430064 -0.0662975), wk = 0.0026178 k( 355) = ( 0.5201278 0.1422202 -0.0476516), wk = 0.0026178 k( 356) = ( 0.5172524 0.1414339 -0.0290056), wk = 0.0026178 k( 357) = ( 0.5143770 0.1406477 -0.0103597), wk = 0.0026178 k( 358) = ( 0.5115016 0.1398615 0.0082863), wk = 0.0026178 k( 359) = ( 0.5086262 0.1390753 0.0269322), wk = 0.0026178 k( 360) = ( 0.5057508 0.1382890 0.0455782), wk = 0.0026178 k( 361) = ( 0.5028754 0.1375028 0.0642241), wk = 0.0026178 k( 362) = ( 0.5000000 0.1367166 0.0828701), wk = 0.0026178 k( 363) = ( 0.5000000 -0.8459420 -0.5127636), wk = 0.0026178 k( 364) = ( 0.5166471 -0.8387464 -0.5084020), wk = 0.0026178 k( 365) = ( 0.5332941 -0.8315508 -0.5040404), wk = 0.0026178 k( 366) = ( 0.5499412 -0.8243552 -0.4996788), wk = 0.0026178 k( 367) = ( 0.5665882 -0.8171596 -0.4953173), wk = 0.0026178 k( 368) = ( 0.5832353 -0.8099640 -0.4909557), wk = 0.0026178 k( 369) = ( 0.5998823 -0.8027684 -0.4865941), wk = 0.0026178 k( 370) = ( 0.6165294 -0.7955728 -0.4822325), wk = 0.0026178 k( 371) = ( 0.6331765 -0.7883772 -0.4778709), wk = 0.0026178 k( 372) = ( 0.6498235 -0.7811816 -0.4735093), wk = 0.0026178 k( 373) = ( 0.6664706 -0.7739859 -0.4691477), wk = 0.0026178 k( 374) = ( 0.6831176 -0.7667903 -0.4647862), wk = 0.0026178 k( 375) = ( 0.6997647 -0.7595947 -0.4604246), wk = 0.0026178 k( 376) = ( 0.7164117 -0.7523991 -0.4560630), wk = 0.0026178 k( 377) = ( 0.7330588 -0.7452035 -0.4517014), wk = 0.0026178 k( 378) = ( 0.7497059 -0.7380079 -0.4473398), wk = 0.0026178 k( 379) = ( 0.7663529 -0.7308123 -0.4429783), wk = 0.0026178 k( 380) = ( 0.7830000 -0.7236167 -0.4386167), wk = 0.0026178 k( 381) = ( 0.7996470 -0.7164211 -0.4342551), wk = 0.0026178 k( 382) = ( 0.8162941 -0.7092255 -0.4298935), wk = 0.0026178 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 2) = ( 0.0084746 0.0000000 -0.0000000), wk = 0.0026178 k( 3) = ( 0.0169491 0.0000000 0.0000000), wk = 0.0026178 k( 4) = ( 0.0254237 0.0000000 -0.0000000), wk = 0.0026178 k( 5) = ( 0.0338983 0.0000000 0.0000000), wk = 0.0026178 k( 6) = ( 0.0423729 0.0000000 -0.0000000), wk = 0.0026178 k( 7) = ( 0.0508475 0.0000000 -0.0000000), wk = 0.0026178 k( 8) = ( 0.0593220 -0.0000000 0.0000000), wk = 0.0026178 k( 9) = ( 0.0677966 0.0000000 -0.0000000), wk = 0.0026178 k( 10) = ( 0.0762712 -0.0000000 0.0000000), wk = 0.0026178 k( 11) = ( 0.0847458 0.0000000 -0.0000000), wk = 0.0026178 k( 12) = ( 0.0932203 0.0000000 0.0000000), wk = 0.0026178 k( 13) = ( 0.1016949 0.0000000 -0.0000000), wk = 0.0026178 k( 14) = ( 0.1101695 0.0000000 -0.0000000), wk = 0.0026178 k( 15) = ( 0.1186441 0.0000000 -0.0000000), wk = 0.0026178 k( 16) = ( 0.1271186 -0.0000000 -0.0000000), wk = 0.0026178 k( 17) = ( 0.1355932 0.0000000 -0.0000000), wk = 0.0026178 k( 18) = ( 0.1440678 0.0000000 0.0000000), wk = 0.0026178 k( 19) = ( 0.1525424 0.0000000 -0.0000000), wk = 0.0026178 k( 20) = ( 0.1610169 0.0000000 -0.0000000), wk = 0.0026178 k( 21) = ( 0.1694915 0.0000000 0.0000000), wk = 0.0026178 k( 22) = ( 0.1779661 0.0000000 -0.0000000), wk = 0.0026178 k( 23) = ( 0.1864407 0.0000000 0.0000000), wk = 0.0026178 k( 24) = ( 0.1949153 -0.0000000 -0.0000000), wk = 0.0026178 k( 25) = ( 0.2033898 0.0000000 0.0000000), wk = 0.0026178 k( 26) = ( 0.2118644 -0.0000000 0.0000000), wk = 0.0026178 k( 27) = ( 0.2203390 0.0000000 -0.0000000), wk = 0.0026178 k( 28) = ( 0.2288136 0.0000000 0.0000000), wk = 0.0026178 k( 29) = ( 0.2372881 0.0000000 -0.0000000), wk = 0.0026178 k( 30) = ( 0.2457627 -0.0000000 -0.0000000), wk = 0.0026178 k( 31) = ( 0.2542373 0.0000000 0.0000000), wk = 0.0026178 k( 32) = ( 0.2627119 0.0000000 -0.0000000), wk = 0.0026178 k( 33) = ( 0.2711864 0.0000000 -0.0000000), wk = 0.0026178 k( 34) = ( 0.2796610 0.0000000 -0.0000000), wk = 0.0026178 k( 35) = ( 0.2881356 0.0000000 0.0000000), wk = 0.0026178 k( 36) = ( 0.2966102 0.0000000 -0.0000000), wk = 0.0026178 k( 37) = ( 0.3050848 0.0000000 0.0000000), wk = 0.0026178 k( 38) = ( 0.3135593 -0.0000000 -0.0000000), wk = 0.0026178 k( 39) = ( 0.3220339 0.0000000 -0.0000000), wk = 0.0026178 k( 40) = ( 0.3305085 0.0000000 0.0000000), wk = 0.0026178 k( 41) = ( 0.3389831 -0.0000000 -0.0000000), wk = 0.0026178 k( 42) = ( 0.3474576 -0.0000000 0.0000000), wk = 0.0026178 k( 43) = ( 0.3559322 0.0000000 -0.0000000), wk = 0.0026178 k( 44) = ( 0.3644068 0.0000000 -0.0000000), wk = 0.0026178 k( 45) = ( 0.3728814 0.0000000 0.0000000), wk = 0.0026178 k( 46) = ( 0.3813559 0.0000000 0.0000000), wk = 0.0026178 k( 47) = ( 0.3898305 -0.0000000 -0.0000000), wk = 0.0026178 k( 48) = ( 0.3983051 0.0000000 0.0000000), wk = 0.0026178 k( 49) = ( 0.4067797 0.0000000 0.0000000), wk = 0.0026178 k( 50) = ( 0.4152542 -0.0000000 -0.0000000), wk = 0.0026178 k( 51) = ( 0.4237288 0.0000000 -0.0000000), wk = 0.0026178 k( 52) = ( 0.4322034 0.0000000 0.0000000), wk = 0.0026178 k( 53) = ( 0.4406780 -0.0000000 -0.0000000), wk = 0.0026178 k( 54) = ( 0.4491525 0.0000000 0.0000000), wk = 0.0026178 k( 55) = ( 0.4576271 0.0000000 0.0000000), wk = 0.0026178 k( 56) = ( 0.4661017 -0.0000000 -0.0000000), wk = 0.0026178 k( 57) = ( 0.4745763 0.0000000 -0.0000000), wk = 0.0026178 k( 58) = ( 0.4830508 0.0000000 -0.0000000), wk = 0.0026178 k( 59) = ( 0.4915254 -0.0000000 -0.0000000), wk = 0.0026178 k( 60) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0026178 k( 61) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0026178 k( 62) = ( 0.5000000 0.0049650 -0.0049650), wk = 0.0026178 k( 63) = ( 0.5000000 0.0099301 -0.0099300), wk = 0.0026178 k( 64) = ( 0.5000000 0.0148951 -0.0148951), wk = 0.0026178 k( 65) = ( 0.5000000 0.0198601 -0.0198601), wk = 0.0026178 k( 66) = ( 0.5000000 0.0248251 -0.0248251), wk = 0.0026178 k( 67) = ( 0.5000000 0.0297902 -0.0297902), wk = 0.0026178 k( 68) = ( 0.5000000 0.0347552 -0.0347552), wk = 0.0026178 k( 69) = ( 0.5000000 0.0397202 -0.0397202), wk = 0.0026178 k( 70) = ( 0.5000000 0.0446852 -0.0446852), wk = 0.0026178 k( 71) = ( 0.5000000 0.0496503 -0.0496502), wk = 0.0026178 k( 72) = ( 0.5000000 0.0546153 -0.0546153), wk = 0.0026178 k( 73) = ( 0.5000000 0.0595803 -0.0595803), wk = 0.0026178 k( 74) = ( 0.5000000 0.0645453 -0.0645453), wk = 0.0026178 k( 75) = ( 0.5000000 0.0695103 -0.0695103), wk = 0.0026178 k( 76) = ( 0.5000000 0.0744754 -0.0744754), wk = 0.0026178 k( 77) = ( 0.5000000 0.0794404 -0.0794404), wk = 0.0026178 k( 78) = ( 0.5000000 0.0844054 -0.0844054), wk = 0.0026178 k( 79) = ( 0.5000000 0.0893704 -0.0893704), wk = 0.0026178 k( 80) = ( 0.5000000 0.0943355 -0.0943355), wk = 0.0026178 k( 81) = ( 0.5000000 0.0993005 -0.0993005), wk = 0.0026178 k( 82) = ( 0.5000000 0.1042655 -0.1042655), wk = 0.0026178 k( 83) = ( 0.5000000 0.1092305 -0.1092305), wk = 0.0026178 k( 84) = ( 0.5000000 0.1141956 -0.1141956), wk = 0.0026178 k( 85) = ( 0.5000000 0.1191606 -0.1191606), wk = 0.0026178 k( 86) = ( 0.5000000 0.1241256 -0.1241256), wk = 0.0026178 k( 87) = ( 0.5000000 0.1290906 -0.1290906), wk = 0.0026178 k( 88) = ( 0.5000000 0.1340557 -0.1340557), wk = 0.0026178 k( 89) = ( 0.5000000 0.1390207 -0.1390207), wk = 0.0026178 k( 90) = ( 0.5000000 0.1439857 -0.1439857), wk = 0.0026178 k( 91) = ( 0.5000000 0.1489507 -0.1489507), wk = 0.0026178 k( 92) = ( 0.5000000 0.1539158 -0.1539158), wk = 0.0026178 k( 93) = ( 0.5000000 0.1588808 -0.1588808), wk = 0.0026178 k( 94) = ( 0.5000000 0.1638458 -0.1638458), wk = 0.0026178 k( 95) = ( 0.5000000 0.1688108 -0.1688108), wk = 0.0026178 k( 96) = ( 0.5000000 0.1737759 -0.1737759), wk = 0.0026178 k( 97) = ( 0.5000000 0.1787409 -0.1787409), wk = 0.0026178 k( 98) = ( 0.5000000 0.1837059 -0.1837059), wk = 0.0026178 k( 99) = ( 0.8162941 0.5000000 0.1837059), wk = 0.0026178 k( 100) = ( 0.8113520 0.5000000 0.1886480), wk = 0.0026178 k( 101) = ( 0.8064099 0.5000000 0.1935901), wk = 0.0026178 k( 102) = ( 0.8014678 0.5000000 0.1985322), wk = 0.0026178 k( 103) = ( 0.7965257 0.5000000 0.2034743), wk = 0.0026178 k( 104) = ( 0.7915836 0.5000000 0.2084164), wk = 0.0026178 k( 105) = ( 0.7866415 0.5000000 0.2133585), wk = 0.0026178 k( 106) = ( 0.7816994 0.5000000 0.2183006), wk = 0.0026178 k( 107) = ( 0.7767573 0.5000000 0.2232427), wk = 0.0026178 k( 108) = ( 0.7718152 0.5000000 0.2281848), wk = 0.0026178 k( 109) = ( 0.7668731 0.5000000 0.2331269), wk = 0.0026178 k( 110) = ( 0.7619310 0.5000000 0.2380690), wk = 0.0026178 k( 111) = ( 0.7569889 0.5000000 0.2430110), wk = 0.0026178 k( 112) = ( 0.7520469 0.5000000 0.2479531), wk = 0.0026178 k( 113) = ( 0.7471048 0.5000000 0.2528952), wk = 0.0026178 k( 114) = ( 0.7421627 0.5000000 0.2578373), wk = 0.0026178 k( 115) = ( 0.7372206 0.5000000 0.2627794), wk = 0.0026178 k( 116) = ( 0.7322785 0.5000000 0.2677215), wk = 0.0026178 k( 117) = ( 0.7273364 0.5000000 0.2726636), wk = 0.0026178 k( 118) = ( 0.7223943 0.5000000 0.2776057), wk = 0.0026178 k( 119) = ( 0.7174522 0.5000000 0.2825478), wk = 0.0026178 k( 120) = ( 0.7125101 0.5000000 0.2874899), wk = 0.0026178 k( 121) = ( 0.7075680 0.5000000 0.2924320), wk = 0.0026178 k( 122) = ( 0.7026259 0.5000000 0.2973741), wk = 0.0026178 k( 123) = ( 0.6976838 0.5000000 0.3023162), wk = 0.0026178 k( 124) = ( 0.6927417 0.5000000 0.3072583), wk = 0.0026178 k( 125) = ( 0.6877996 0.5000000 0.3122004), wk = 0.0026178 k( 126) = ( 0.6828575 0.5000000 0.3171425), wk = 0.0026178 k( 127) = ( 0.6779154 0.5000000 0.3220846), wk = 0.0026178 k( 128) = ( 0.6729733 0.5000000 0.3270267), wk = 0.0026178 k( 129) = ( 0.6680312 0.5000000 0.3319688), wk = 0.0026178 k( 130) = ( 0.6630891 0.5000000 0.3369109), wk = 0.0026178 k( 131) = ( 0.6581470 0.5000000 0.3418530), wk = 0.0026178 k( 132) = ( 0.6532050 0.5000000 0.3467951), wk = 0.0026178 k( 133) = ( 0.6482628 0.5000000 0.3517371), wk = 0.0026178 k( 134) = ( 0.6433208 0.5000000 0.3566792), wk = 0.0026178 k( 135) = ( 0.6383787 0.5000000 0.3616213), wk = 0.0026178 k( 136) = ( 0.6334366 0.5000000 0.3665634), wk = 0.0026178 k( 137) = ( 0.6284945 0.5000000 0.3715055), wk = 0.0026178 k( 138) = ( 0.6235524 0.5000000 0.3764476), wk = 0.0026178 k( 139) = ( 0.6186103 0.5000000 0.3813897), wk = 0.0026178 k( 140) = ( 0.6136682 0.5000000 0.3863318), wk = 0.0026178 k( 141) = ( 0.6087261 0.5000000 0.3912739), wk = 0.0026178 k( 142) = ( 0.6037840 0.5000000 0.3962160), wk = 0.0026178 k( 143) = ( 0.5988419 0.5000000 0.4011581), wk = 0.0026178 k( 144) = ( 0.5938998 0.5000000 0.4061002), wk = 0.0026178 k( 145) = ( 0.5889577 0.5000000 0.4110423), wk = 0.0026178 k( 146) = ( 0.5840156 0.5000000 0.4159844), wk = 0.0026178 k( 147) = ( 0.5790735 0.5000000 0.4209265), wk = 0.0026178 k( 148) = ( 0.5741314 0.5000000 0.4258686), wk = 0.0026178 k( 149) = ( 0.5691893 0.5000000 0.4308107), wk = 0.0026178 k( 150) = ( 0.5642472 0.5000000 0.4357528), wk = 0.0026178 k( 151) = ( 0.5593051 0.5000000 0.4406949), wk = 0.0026178 k( 152) = ( 0.5543630 0.5000000 0.4456370), wk = 0.0026178 k( 153) = ( 0.5494210 0.5000000 0.4505790), wk = 0.0026178 k( 154) = ( 0.5444789 0.5000000 0.4555211), wk = 0.0026178 k( 155) = ( 0.5395368 0.5000000 0.4604632), wk = 0.0026178 k( 156) = ( 0.5345947 0.5000000 0.4654053), wk = 0.0026178 k( 157) = ( 0.5296526 0.5000000 0.4703474), wk = 0.0026178 k( 158) = ( 0.5247105 0.5000000 0.4752895), wk = 0.0026178 k( 159) = ( 0.5197684 0.5000000 0.4802316), wk = 0.0026178 k( 160) = ( 0.5148263 0.5000000 0.4851737), wk = 0.0026178 k( 161) = ( 0.5098842 0.5000000 0.4901158), wk = 0.0026178 k( 162) = ( 0.5049421 0.5000000 0.4950579), wk = 0.0026178 k( 163) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026178 k( 164) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026178 k( 165) = ( 0.4821429 0.4821429 0.4821429), wk = 0.0026178 k( 166) = ( 0.4642857 0.4642857 0.4642857), wk = 0.0026178 k( 167) = ( 0.4464286 0.4464286 0.4464286), wk = 0.0026178 k( 168) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0026178 k( 169) = ( 0.4107143 0.4107143 0.4107143), wk = 0.0026178 k( 170) = ( 0.3928571 0.3928571 0.3928571), wk = 0.0026178 k( 171) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0026178 k( 172) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0026178 k( 173) = ( 0.3392857 0.3392857 0.3392857), wk = 0.0026178 k( 174) = ( 0.3214286 0.3214286 0.3214286), wk = 0.0026178 k( 175) = ( 0.3035714 0.3035714 0.3035714), wk = 0.0026178 k( 176) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0026178 k( 177) = ( 0.2678571 0.2678571 0.2678571), wk = 0.0026178 k( 178) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026178 k( 179) = ( 0.2321429 0.2321429 0.2321429), wk = 0.0026178 k( 180) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0026178 k( 181) = ( 0.1964286 0.1964286 0.1964286), wk = 0.0026178 k( 182) = ( 0.1785714 0.1785714 0.1785714), wk = 0.0026178 k( 183) = ( 0.1607143 0.1607143 0.1607143), wk = 0.0026178 k( 184) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0026178 k( 185) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0026178 k( 186) = ( 0.1071429 0.1071429 0.1071429), wk = 0.0026178 k( 187) = ( 0.0892857 0.0892857 0.0892857), wk = 0.0026178 k( 188) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0026178 k( 189) = ( 0.0535714 0.0535714 0.0535714), wk = 0.0026178 k( 190) = ( 0.0357143 0.0357143 0.0357143), wk = 0.0026178 k( 191) = ( 0.0178571 0.0178571 0.0178571), wk = 0.0026178 k( 192) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 193) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 194) = ( 0.0049544 0.0000000 -0.0049544), wk = 0.0026178 k( 195) = ( 0.0099088 0.0000000 -0.0099088), wk = 0.0026178 k( 196) = ( 0.0148632 0.0000000 -0.0148632), wk = 0.0026178 k( 197) = ( 0.0198176 0.0000000 -0.0198176), wk = 0.0026178 k( 198) = ( 0.0247720 0.0000000 -0.0247720), wk = 0.0026178 k( 199) = ( 0.0297263 0.0000000 -0.0297263), wk = 0.0026178 k( 200) = ( 0.0346807 0.0000000 -0.0346807), wk = 0.0026178 k( 201) = ( 0.0396351 0.0000000 -0.0396351), wk = 0.0026178 k( 202) = ( 0.0445895 0.0000000 -0.0445895), wk = 0.0026178 k( 203) = ( 0.0495439 0.0000000 -0.0495439), wk = 0.0026178 k( 204) = ( 0.0544983 0.0000000 -0.0544983), wk = 0.0026178 k( 205) = ( 0.0594527 0.0000000 -0.0594527), wk = 0.0026178 k( 206) = ( 0.0644071 0.0000000 -0.0644071), wk = 0.0026178 k( 207) = ( 0.0693615 0.0000000 -0.0693615), wk = 0.0026178 k( 208) = ( 0.0743159 0.0000000 -0.0743159), wk = 0.0026178 k( 209) = ( 0.0792703 -0.0000000 -0.0792703), wk = 0.0026178 k( 210) = ( 0.0842246 0.0000000 -0.0842246), wk = 0.0026178 k( 211) = ( 0.0891790 0.0000000 -0.0891790), wk = 0.0026178 k( 212) = ( 0.0941334 0.0000000 -0.0941334), wk = 0.0026178 k( 213) = ( 0.0990878 -0.0000000 -0.0990878), wk = 0.0026178 k( 214) = ( 0.1040422 0.0000000 -0.1040422), wk = 0.0026178 k( 215) = ( 0.1089966 0.0000000 -0.1089966), wk = 0.0026178 k( 216) = ( 0.1139510 -0.0000000 -0.1139510), wk = 0.0026178 k( 217) = ( 0.1189054 0.0000000 -0.1189054), wk = 0.0026178 k( 218) = ( 0.1238598 0.0000000 -0.1238598), wk = 0.0026178 k( 219) = ( 0.1288142 0.0000000 -0.1288142), wk = 0.0026178 k( 220) = ( 0.1337686 -0.0000000 -0.1337686), wk = 0.0026178 k( 221) = ( 0.1387229 0.0000000 -0.1387229), wk = 0.0026178 k( 222) = ( 0.1436773 0.0000000 -0.1436773), wk = 0.0026178 k( 223) = ( 0.1486317 0.0000000 -0.1486317), wk = 0.0026178 k( 224) = ( 0.1535861 0.0000000 -0.1535861), wk = 0.0026178 k( 225) = ( 0.1585405 -0.0000000 -0.1585405), wk = 0.0026178 k( 226) = ( 0.1634949 0.0000000 -0.1634949), wk = 0.0026178 k( 227) = ( 0.1684493 0.0000000 -0.1684493), wk = 0.0026178 k( 228) = ( 0.1734037 -0.0000000 -0.1734037), wk = 0.0026178 k( 229) = ( 0.1783581 0.0000000 -0.1783581), wk = 0.0026178 k( 230) = ( 0.1833124 0.0000000 -0.1833124), wk = 0.0026178 k( 231) = ( 0.1882669 0.0000000 -0.1882669), wk = 0.0026178 k( 232) = ( 0.1932212 0.0000000 -0.1932212), wk = 0.0026178 k( 233) = ( 0.1981756 0.0000000 -0.1981756), wk = 0.0026178 k( 234) = ( 0.2031300 0.0000000 -0.2031300), wk = 0.0026178 k( 235) = ( 0.2080844 -0.0000000 -0.2080844), wk = 0.0026178 k( 236) = ( 0.2130388 0.0000000 -0.2130388), wk = 0.0026178 k( 237) = ( 0.2179932 0.0000000 -0.2179932), wk = 0.0026178 k( 238) = ( 0.2229476 -0.0000000 -0.2229476), wk = 0.0026178 k( 239) = ( 0.2279020 0.0000000 -0.2279020), wk = 0.0026178 k( 240) = ( 0.2328564 0.0000000 -0.2328564), wk = 0.0026178 k( 241) = ( 0.2378107 0.0000000 -0.2378107), wk = 0.0026178 k( 242) = ( 0.2427651 -0.0000000 -0.2427651), wk = 0.0026178 k( 243) = ( 0.2477195 -0.0000000 -0.2477195), wk = 0.0026178 k( 244) = ( 0.2526739 0.0000000 -0.2526739), wk = 0.0026178 k( 245) = ( 0.2576283 0.0000000 -0.2576283), wk = 0.0026178 k( 246) = ( 0.2625827 0.0000000 -0.2625827), wk = 0.0026178 k( 247) = ( 0.2675371 -0.0000000 -0.2675371), wk = 0.0026178 k( 248) = ( 0.2724915 -0.0000000 -0.2724915), wk = 0.0026178 k( 249) = ( 0.2774459 0.0000000 -0.2774459), wk = 0.0026178 k( 250) = ( 0.2824003 0.0000000 -0.2824003), wk = 0.0026178 k( 251) = ( 0.2873547 0.0000000 -0.2873547), wk = 0.0026178 k( 252) = ( 0.2923091 0.0000000 -0.2923091), wk = 0.0026178 k( 253) = ( 0.2972634 0.0000000 -0.2972634), wk = 0.0026178 k( 254) = ( 0.3022178 -0.0000000 -0.3022178), wk = 0.0026178 k( 255) = ( 0.3071722 0.0000000 -0.3071722), wk = 0.0026178 k( 256) = ( 0.3121266 -0.0000000 -0.3121266), wk = 0.0026178 k( 257) = ( 0.3170810 -0.0000000 -0.3170810), wk = 0.0026178 k( 258) = ( 0.3220354 0.0000000 -0.3220354), wk = 0.0026178 k( 259) = ( 0.3269898 0.0000000 -0.3269898), wk = 0.0026178 k( 260) = ( 0.3319442 0.0000000 -0.3319442), wk = 0.0026178 k( 261) = ( 0.3368986 -0.0000000 -0.3368986), wk = 0.0026178 k( 262) = ( 0.3418530 0.0000000 -0.3418530), wk = 0.0026178 k( 263) = ( 0.6581470 0.3418530 -0.0000000), wk = 0.0026178 k( 264) = ( 0.6532050 0.3467950 -0.0000000), wk = 0.0026178 k( 265) = ( 0.6482628 0.3517371 -0.0000000), wk = 0.0026178 k( 266) = ( 0.6433208 0.3566792 -0.0000000), wk = 0.0026178 k( 267) = ( 0.6383787 0.3616213 -0.0000000), wk = 0.0026178 k( 268) = ( 0.6334366 0.3665634 -0.0000000), wk = 0.0026178 k( 269) = ( 0.6284945 0.3715055 -0.0000000), wk = 0.0026178 k( 270) = ( 0.6235524 0.3764476 -0.0000000), wk = 0.0026178 k( 271) = ( 0.6186103 0.3813897 -0.0000000), wk = 0.0026178 k( 272) = ( 0.6136682 0.3863318 0.0000000), wk = 0.0026178 k( 273) = ( 0.6087261 0.3912739 -0.0000000), wk = 0.0026178 k( 274) = ( 0.6037840 0.3962160 -0.0000000), wk = 0.0026178 k( 275) = ( 0.5988419 0.4011581 -0.0000000), wk = 0.0026178 k( 276) = ( 0.5938998 0.4061002 -0.0000000), wk = 0.0026178 k( 277) = ( 0.5889577 0.4110423 -0.0000000), wk = 0.0026178 k( 278) = ( 0.5840156 0.4159844 0.0000000), wk = 0.0026178 k( 279) = ( 0.5790735 0.4209265 -0.0000000), wk = 0.0026178 k( 280) = ( 0.5741314 0.4258686 -0.0000000), wk = 0.0026178 k( 281) = ( 0.5691893 0.4308107 -0.0000000), wk = 0.0026178 k( 282) = ( 0.5642472 0.4357528 -0.0000000), wk = 0.0026178 k( 283) = ( 0.5593051 0.4406949 -0.0000000), wk = 0.0026178 k( 284) = ( 0.5543630 0.4456369 -0.0000000), wk = 0.0026178 k( 285) = ( 0.5494210 0.4505790 -0.0000000), wk = 0.0026178 k( 286) = ( 0.5444789 0.4555211 -0.0000000), wk = 0.0026178 k( 287) = ( 0.5395368 0.4604632 -0.0000000), wk = 0.0026178 k( 288) = ( 0.5345947 0.4654053 0.0000000), wk = 0.0026178 k( 289) = ( 0.5296526 0.4703474 -0.0000000), wk = 0.0026178 k( 290) = ( 0.5247105 0.4752895 -0.0000000), wk = 0.0026178 k( 291) = ( 0.5197684 0.4802316 0.0000000), wk = 0.0026178 k( 292) = ( 0.5148263 0.4851737 -0.0000000), wk = 0.0026178 k( 293) = ( 0.5098842 0.4901158 0.0000000), wk = 0.0026178 k( 294) = ( 0.5049421 0.4950579 -0.0000000), wk = 0.0026178 k( 295) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026178 k( 296) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026178 k( 297) = ( 0.5158147 0.5158147 0.0183706), wk = 0.0026178 k( 298) = ( 0.5316294 0.5316294 0.0367412), wk = 0.0026178 k( 299) = ( 0.5474441 0.5474441 0.0551118), wk = 0.0026178 k( 300) = ( 0.5632588 0.5632588 0.0734824), wk = 0.0026178 k( 301) = ( 0.5790735 0.5790735 0.0918530), wk = 0.0026178 k( 302) = ( 0.5948882 0.5948882 0.1102236), wk = 0.0026178 k( 303) = ( 0.6107029 0.6107029 0.1285941), wk = 0.0026178 k( 304) = ( 0.6265176 0.6265176 0.1469647), wk = 0.0026178 k( 305) = ( 0.6423323 0.6423323 0.1653353), wk = 0.0026178 k( 306) = ( 0.6581470 0.6581470 0.1837059), wk = 0.0026178 k( 307) = ( 0.6581470 0.6581470 0.1837059), wk = 0.0026178 k( 308) = ( 0.6552716 0.6552716 0.1894567), wk = 0.0026178 k( 309) = ( 0.6523962 0.6523962 0.1952075), wk = 0.0026178 k( 310) = ( 0.6495208 0.6495208 0.2009583), wk = 0.0026178 k( 311) = ( 0.6466454 0.6466454 0.2067091), wk = 0.0026178 k( 312) = ( 0.6437700 0.6437700 0.2124599), wk = 0.0026178 k( 313) = ( 0.6408946 0.6408946 0.2182107), wk = 0.0026178 k( 314) = ( 0.6380192 0.6380192 0.2239615), wk = 0.0026178 k( 315) = ( 0.6351438 0.6351438 0.2297123), wk = 0.0026178 k( 316) = ( 0.6322684 0.6322684 0.2354631), wk = 0.0026178 k( 317) = ( 0.6293930 0.6293930 0.2412139), wk = 0.0026178 k( 318) = ( 0.6265176 0.6265176 0.2469647), wk = 0.0026178 k( 319) = ( 0.6236422 0.6236422 0.2527155), wk = 0.0026178 k( 320) = ( 0.6207668 0.6207668 0.2584663), wk = 0.0026178 k( 321) = ( 0.6178914 0.6178914 0.2642171), wk = 0.0026178 k( 322) = ( 0.6150160 0.6150160 0.2699679), wk = 0.0026178 k( 323) = ( 0.6121406 0.6121406 0.2757187), wk = 0.0026178 k( 324) = ( 0.6092652 0.6092652 0.2814695), wk = 0.0026178 k( 325) = ( 0.6063898 0.6063898 0.2872203), wk = 0.0026178 k( 326) = ( 0.6035144 0.6035144 0.2929711), wk = 0.0026178 k( 327) = ( 0.6006390 0.6006390 0.2987219), wk = 0.0026178 k( 328) = ( 0.5977636 0.5977636 0.3044727), wk = 0.0026178 k( 329) = ( 0.5948882 0.5948882 0.3102236), wk = 0.0026178 k( 330) = ( 0.5920128 0.5920128 0.3159744), wk = 0.0026178 k( 331) = ( 0.5891374 0.5891374 0.3217252), wk = 0.0026178 k( 332) = ( 0.5862620 0.5862620 0.3274760), wk = 0.0026178 k( 333) = ( 0.5833866 0.5833866 0.3332268), wk = 0.0026178 k( 334) = ( 0.5805112 0.5805112 0.3389776), wk = 0.0026178 k( 335) = ( 0.5776358 0.5776358 0.3447284), wk = 0.0026178 k( 336) = ( 0.5747604 0.5747604 0.3504792), wk = 0.0026178 k( 337) = ( 0.5718850 0.5718850 0.3562300), wk = 0.0026178 k( 338) = ( 0.5690096 0.5690096 0.3619808), wk = 0.0026178 k( 339) = ( 0.5661342 0.5661342 0.3677316), wk = 0.0026178 k( 340) = ( 0.5632588 0.5632588 0.3734824), wk = 0.0026178 k( 341) = ( 0.5603834 0.5603834 0.3792332), wk = 0.0026178 k( 342) = ( 0.5575080 0.5575080 0.3849840), wk = 0.0026178 k( 343) = ( 0.5546326 0.5546326 0.3907348), wk = 0.0026178 k( 344) = ( 0.5517572 0.5517572 0.3964856), wk = 0.0026178 k( 345) = ( 0.5488818 0.5488818 0.4022364), wk = 0.0026178 k( 346) = ( 0.5460064 0.5460064 0.4079872), wk = 0.0026178 k( 347) = ( 0.5431310 0.5431310 0.4137380), wk = 0.0026178 k( 348) = ( 0.5402556 0.5402556 0.4194888), wk = 0.0026178 k( 349) = ( 0.5373802 0.5373802 0.4252396), wk = 0.0026178 k( 350) = ( 0.5345048 0.5345048 0.4309904), wk = 0.0026178 k( 351) = ( 0.5316294 0.5316294 0.4367412), wk = 0.0026178 k( 352) = ( 0.5287540 0.5287540 0.4424920), wk = 0.0026178 k( 353) = ( 0.5258786 0.5258786 0.4482428), wk = 0.0026178 k( 354) = ( 0.5230032 0.5230032 0.4539936), wk = 0.0026178 k( 355) = ( 0.5201278 0.5201278 0.4597444), wk = 0.0026178 k( 356) = ( 0.5172524 0.5172524 0.4654952), wk = 0.0026178 k( 357) = ( 0.5143770 0.5143770 0.4712460), wk = 0.0026178 k( 358) = ( 0.5115016 0.5115016 0.4769968), wk = 0.0026178 k( 359) = ( 0.5086262 0.5086262 0.4827476), wk = 0.0026178 k( 360) = ( 0.5057508 0.5057508 0.4884984), wk = 0.0026178 k( 361) = ( 0.5028754 0.5028754 0.4942492), wk = 0.0026178 k( 362) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026178 k( 363) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0026178 k( 364) = ( 0.5166471 0.0179923 0.0179923), wk = 0.0026178 k( 365) = ( 0.5332941 0.0359845 0.0359845), wk = 0.0026178 k( 366) = ( 0.5499412 0.0539768 0.0539768), wk = 0.0026178 k( 367) = ( 0.5665882 0.0719690 0.0719690), wk = 0.0026178 k( 368) = ( 0.5832353 0.0899613 0.0899613), wk = 0.0026178 k( 369) = ( 0.5998823 0.1079536 0.1079536), wk = 0.0026178 k( 370) = ( 0.6165294 0.1259458 0.1259458), wk = 0.0026178 k( 371) = ( 0.6331765 0.1439381 0.1439381), wk = 0.0026178 k( 372) = ( 0.6498235 0.1619304 0.1619304), wk = 0.0026178 k( 373) = ( 0.6664706 0.1799226 0.1799226), wk = 0.0026178 k( 374) = ( 0.6831176 0.1979149 0.1979149), wk = 0.0026178 k( 375) = ( 0.6997647 0.2159071 0.2159071), wk = 0.0026178 k( 376) = ( 0.7164117 0.2338994 0.2338994), wk = 0.0026178 k( 377) = ( 0.7330588 0.2518917 0.2518917), wk = 0.0026178 k( 378) = ( 0.7497059 0.2698839 0.2698839), wk = 0.0026178 k( 379) = ( 0.7663529 0.2878762 0.2878762), wk = 0.0026178 k( 380) = ( 0.7830000 0.3058684 0.3058684), wk = 0.0026178 k( 381) = ( 0.7996470 0.3238607 0.3238607), wk = 0.0026178 k( 382) = ( 0.8162941 0.3418530 0.3418530), wk = 0.0026178 Dense grid: 31873 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 24097 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.11 Mb ( 178, 40) NL pseudopotentials 0.10 Mb ( 89, 76) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.01 Mb ( 886) G-vector shells 0.01 Mb ( 700) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.43 Mb ( 178, 160) Each subspace H/S matrix 0.02 Mb ( 40, 40) Each matrix 0.09 Mb ( 76, 2, 40) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./NaTaN2.save/charge-density.dat Starting wfc are 46 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.2 secs Computing kpt #: 2 total cpu time spent up to now is 3.5 secs Computing kpt #: 3 total cpu time spent up to now is 3.8 secs Computing kpt #: 4 total cpu time spent up to now is 4.1 secs Computing kpt #: 5 total cpu time spent up to now is 4.4 secs Computing kpt #: 6 total cpu time spent up to now is 4.7 secs Computing kpt #: 7 total cpu time spent up to now is 5.0 secs Computing kpt #: 8 total cpu time spent up to now is 5.3 secs Computing kpt #: 9 total cpu time spent up to now is 5.6 secs Computing kpt #: 10 total cpu time spent up to now is 5.9 secs Computing kpt #: 11 total cpu time spent up to now is 6.2 secs Computing kpt #: 12 total cpu time spent up to now is 6.5 secs Computing kpt #: 13 total cpu time spent up to now is 6.8 secs Computing kpt #: 14 total cpu time spent up to now is 7.1 secs Computing kpt #: 15 total cpu time spent up to now is 7.4 secs Computing kpt #: 16 total cpu time spent up to now is 7.7 secs Computing kpt #: 17 total cpu time spent up to now is 8.0 secs Computing kpt #: 18 total cpu time spent up to now is 8.3 secs Computing kpt #: 19 total cpu time spent up to now is 8.7 secs Computing kpt #: 20 total cpu time spent up to now is 9.0 secs Computing kpt #: 21 total cpu time spent up to now is 9.3 secs Computing kpt #: 22 total cpu time spent up to now is 9.7 secs Computing kpt #: 23 total cpu time spent up to now is 10.0 secs Computing kpt #: 24 total cpu time spent up to now is 10.3 secs Computing kpt #: 25 total cpu time spent up to now is 10.7 secs Computing kpt #: 26 total cpu time spent up to now is 11.0 secs Computing kpt #: 27 total cpu time spent up to now is 11.3 secs Computing kpt #: 28 total cpu time spent up to now is 11.7 secs Computing kpt #: 29 total cpu time spent up to now is 12.0 secs Computing kpt #: 30 total cpu time spent up to now is 12.3 secs Computing kpt #: 31 total cpu time spent up to now is 12.7 secs Computing kpt #: 32 total cpu time spent up to now is 13.0 secs Computing kpt #: 33 total cpu time spent up to now is 13.3 secs Computing kpt #: 34 total cpu time spent up to now is 13.7 secs Computing kpt #: 35 total cpu time spent up to now is 14.1 secs Computing kpt #: 36 total cpu time spent up to now is 14.5 secs Computing kpt #: 37 total cpu time spent up to now is 14.8 secs Computing kpt #: 38 total cpu time spent up to now is 15.1 secs Computing kpt #: 39 total cpu time spent up to now is 15.5 secs Computing kpt #: 40 total cpu time spent up to now is 15.8 secs Computing kpt #: 41 total cpu time spent up to now is 16.1 secs Computing kpt #: 42 total cpu time spent up to now is 16.4 secs Computing kpt #: 43 total cpu time spent up to now is 16.7 secs Computing kpt #: 44 total cpu time spent up to now is 17.0 secs Computing kpt #: 45 total cpu time spent up to now is 17.4 secs Computing kpt #: 46 total cpu time spent up to now is 17.7 secs Computing kpt #: 47 total cpu time spent up to now is 18.1 secs Computing kpt #: 48 total cpu time spent up to now is 18.4 secs Computing kpt #: 49 total cpu time spent up to now is 18.7 secs Computing kpt #: 50 total cpu time spent up to now is 19.1 secs Computing kpt #: 51 total cpu time spent up to now is 19.5 secs Computing kpt #: 52 total cpu time spent up to now is 19.9 secs Computing kpt #: 53 total cpu time spent up to now is 20.3 secs Computing kpt #: 54 total cpu time spent up to now is 20.8 secs Computing kpt #: 55 total cpu time spent up to now is 21.2 secs Computing kpt #: 56 total cpu time spent up to now is 21.7 secs Computing kpt #: 57 total cpu time spent up to now is 22.2 secs Computing kpt #: 58 total cpu time spent up to now is 22.7 secs Computing kpt #: 59 total cpu time spent up to now is 23.2 secs Computing kpt #: 60 total cpu time spent up to now is 23.6 secs Computing kpt #: 61 total cpu time spent up to now is 24.1 secs Computing kpt #: 62 total cpu time spent up to now is 24.6 secs Computing kpt #: 63 total cpu time spent up to now is 25.1 secs Computing kpt #: 64 total cpu time spent up to now is 25.6 secs Computing kpt #: 65 total cpu time spent up to now is 26.1 secs Computing kpt #: 66 total cpu time spent up to now is 26.7 secs Computing kpt #: 67 total cpu time spent up to now is 27.3 secs Computing kpt #: 68 total cpu time spent up to now is 27.8 secs Computing kpt #: 69 total cpu time spent up to now is 28.4 secs Computing kpt #: 70 total cpu time spent up to now is 28.8 secs Computing kpt #: 71 total cpu time spent up to now is 29.3 secs Computing kpt #: 72 total cpu time spent up to now is 29.8 secs Computing kpt #: 73 total cpu time spent up to now is 30.2 secs Computing kpt #: 74 total cpu time spent up to now is 30.7 secs Computing kpt #: 75 total cpu time spent up to now is 31.1 secs Computing kpt #: 76 total cpu time spent up to now is 31.6 secs Computing kpt #: 77 total cpu time spent up to now is 32.0 secs Computing kpt #: 78 total cpu time spent up to now is 32.3 secs Computing kpt #: 79 total cpu time spent up to now is 32.7 secs Computing kpt #: 80 total cpu time spent up to now is 33.1 secs Computing kpt #: 81 total cpu time spent up to now is 33.4 secs Computing kpt #: 82 total cpu time spent up to now is 33.8 secs Computing kpt #: 83 total cpu time spent up to now is 34.2 secs Computing kpt #: 84 total cpu time spent up to now is 34.5 secs Computing kpt #: 85 total cpu time spent up to now is 34.9 secs Computing kpt #: 86 total cpu time spent up to now is 35.2 secs Computing kpt #: 87 total cpu time spent up to now is 35.6 secs Computing kpt #: 88 total cpu time spent up to now is 35.9 secs Computing kpt #: 89 total cpu time spent up to now is 36.3 secs Computing kpt #: 90 total cpu time spent up to now is 36.7 secs Computing kpt #: 91 total cpu time spent up to now is 37.0 secs Computing kpt #: 92 total cpu time spent up to now is 37.4 secs Computing kpt #: 93 total cpu time spent up to now is 37.7 secs Computing kpt #: 94 total cpu time spent up to now is 38.1 secs Computing kpt #: 95 total cpu time spent up to now is 38.5 secs Computing kpt #: 96 total cpu time spent up to now is 38.8 secs Computing kpt #: 97 total cpu time spent up to now is 39.2 secs Computing kpt #: 98 total cpu time spent up to now is 39.7 secs Computing kpt #: 99 total cpu time spent up to now is 40.1 secs Computing kpt #: 100 total cpu time spent up to now is 40.5 secs Computing kpt #: 101 total cpu time spent up to now is 41.0 secs Computing kpt #: 102 total cpu time spent up to now is 41.4 secs Computing kpt #: 103 total cpu time spent up to now is 41.9 secs Computing kpt #: 104 total cpu time 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secs Computing kpt #: 120 total cpu time spent up to now is 48.3 secs Computing kpt #: 121 total cpu time spent up to now is 48.7 secs Computing kpt #: 122 total cpu time spent up to now is 49.0 secs Computing kpt #: 123 total cpu time spent up to now is 49.4 secs Computing kpt #: 124 total cpu time spent up to now is 49.7 secs Computing kpt #: 125 total cpu time spent up to now is 50.0 secs Computing kpt #: 126 total cpu time spent up to now is 50.3 secs Computing kpt #: 127 total cpu time spent up to now is 50.7 secs Computing kpt #: 128 total cpu time spent up to now is 51.0 secs Computing kpt #: 129 total cpu time spent up to now is 51.3 secs Computing kpt #: 130 total cpu time spent up to now is 51.6 secs Computing kpt #: 131 total cpu time spent up to now is 51.9 secs Computing kpt #: 132 total cpu time spent up to now is 52.3 secs Computing kpt #: 133 total cpu time spent up to now is 52.6 secs Computing kpt #: 134 total cpu time spent up to now is 52.9 secs Computing kpt #: 135 total cpu time spent up to now is 53.2 secs Computing kpt #: 136 total cpu time spent up to now is 53.5 secs Computing kpt #: 137 total cpu time spent up to now is 53.8 secs Computing kpt #: 138 total cpu time spent up to now is 54.1 secs Computing kpt #: 139 total cpu time spent up to now is 54.5 secs Computing kpt #: 140 total cpu time spent up to now is 54.8 secs Computing kpt #: 141 total cpu time spent up to now is 55.1 secs Computing kpt #: 142 total cpu time spent up to now is 55.4 secs Computing kpt #: 143 total cpu time spent up to now is 55.7 secs Computing kpt #: 144 total cpu time spent up to now is 56.0 secs Computing kpt #: 145 total cpu time spent up to now is 56.3 secs Computing kpt #: 146 total cpu time spent up to now is 56.6 secs Computing kpt #: 147 total cpu time spent up to now is 56.9 secs Computing kpt #: 148 total cpu time spent up to now is 57.2 secs Computing kpt #: 149 total cpu time spent up to now is 57.5 secs Computing kpt #: 150 total cpu time spent up to now is 57.8 secs Computing kpt #: 151 total cpu time spent up to now is 58.1 secs Computing kpt #: 152 total cpu time spent up to now is 58.4 secs Computing kpt #: 153 total cpu time spent up to now is 58.7 secs Computing kpt #: 154 total cpu time spent up to now is 59.0 secs Computing kpt #: 155 total cpu time spent up to now is 59.3 secs Computing kpt #: 156 total cpu time spent up to now is 59.7 secs Computing kpt #: 157 total cpu time spent up to now is 60.0 secs Computing kpt #: 158 total cpu time spent up to now is 60.3 secs Computing kpt #: 159 total cpu time spent up to now is 60.6 secs Computing kpt #: 160 total cpu time spent up to now is 60.9 secs Computing kpt #: 161 total cpu time spent up to now is 61.2 secs Computing kpt #: 162 total cpu time spent up to now is 61.5 secs Computing kpt #: 163 total cpu time spent up to now is 61.8 secs Computing kpt #: 164 total cpu time spent up to now is 62.1 secs Computing kpt #: 165 total cpu time spent up to now is 62.4 secs Computing kpt #: 166 total cpu time spent up to now is 62.7 secs Computing kpt #: 167 total cpu time spent up to now is 63.0 secs Computing kpt #: 168 total cpu time spent up to now is 63.3 secs Computing kpt #: 169 total cpu time spent up to now is 63.6 secs Computing kpt #: 170 total cpu time spent up to now is 63.9 secs Computing kpt #: 171 total cpu time spent up to now is 64.2 secs Computing kpt #: 172 total cpu time spent up to now is 64.6 secs Computing kpt #: 173 total cpu time spent up to now is 64.9 secs Computing kpt #: 174 total cpu time spent up to now is 65.2 secs Computing kpt #: 175 total cpu time spent up to now is 65.5 secs Computing kpt #: 176 total cpu time spent up to now is 65.8 secs Computing kpt #: 177 total cpu time spent up to now is 66.1 secs Computing kpt #: 178 total cpu time spent up to now is 66.4 secs Computing kpt #: 179 total cpu time spent up to now is 66.7 secs Computing kpt #: 180 total cpu time spent up to now is 67.0 secs Computing kpt #: 181 total cpu time spent up to now is 67.3 secs Computing kpt #: 182 total cpu time spent up to now is 67.6 secs Computing kpt #: 183 total cpu time spent up to now is 67.9 secs Computing kpt #: 184 total cpu time spent up to now is 68.2 secs Computing kpt #: 185 total cpu time spent up to now is 68.5 secs Computing kpt #: 186 total cpu time spent up to now is 68.8 secs Computing kpt #: 187 total cpu time spent up to now is 69.1 secs Computing kpt #: 188 total cpu time spent up to now is 69.4 secs Computing kpt #: 189 total cpu time spent up to now is 69.7 secs Computing kpt #: 190 total cpu time spent up to now is 69.9 secs Computing kpt #: 191 total cpu time spent up to now is 70.2 secs Computing kpt #: 192 total cpu time spent up to now is 70.5 secs Computing kpt #: 193 total cpu time spent up to now is 70.8 secs Computing kpt #: 194 total cpu time spent up to now is 71.1 secs Computing kpt #: 195 total cpu time spent up to now is 71.4 secs Computing kpt #: 196 total cpu time spent up to now is 71.7 secs Computing kpt #: 197 total cpu time spent up to now is 72.0 secs Computing kpt #: 198 total cpu time spent up to now is 72.3 secs Computing kpt #: 199 total cpu time spent up to now is 72.6 secs Computing kpt #: 200 total cpu time spent up to now is 72.9 secs Computing kpt #: 201 total cpu time spent up to now is 73.2 secs Computing kpt #: 202 total cpu time spent up to now is 73.5 secs Computing kpt #: 203 total cpu time spent up to now is 73.8 secs Computing kpt #: 204 total cpu time spent up to now is 74.1 secs Computing kpt #: 205 total cpu time spent up to now is 74.4 secs Computing kpt #: 206 total cpu time spent up to now is 74.7 secs Computing kpt #: 207 total cpu time spent up to now is 75.0 secs Computing kpt #: 208 total cpu time spent up to now is 75.3 secs Computing kpt #: 209 total cpu time spent up to now is 75.6 secs Computing kpt #: 210 total cpu time spent up to now is 75.9 secs Computing kpt #: 211 total cpu time spent up to now is 76.3 secs Computing kpt #: 212 total cpu time spent up to now is 76.6 secs Computing kpt #: 213 total cpu time spent up to now is 76.9 secs Computing kpt #: 214 total cpu time spent up to now is 77.3 secs Computing kpt #: 215 total cpu time spent up to now is 77.6 secs Computing kpt #: 216 total cpu time spent up to now is 77.9 secs Computing kpt #: 217 total cpu time spent up to now is 78.3 secs Computing kpt #: 218 total cpu time spent up to now is 78.6 secs Computing kpt #: 219 total cpu time spent up to now is 79.0 secs Computing kpt #: 220 total cpu time spent up to now is 79.3 secs Computing kpt #: 221 total cpu time spent up to now is 79.6 secs Computing kpt #: 222 total cpu time spent up to now is 80.0 secs Computing kpt #: 223 total cpu time spent up to now is 80.3 secs Computing kpt #: 224 total cpu time spent up to now is 80.7 secs Computing kpt #: 225 total cpu time spent up to now is 81.0 secs Computing kpt #: 226 total cpu time spent up to now is 81.3 secs Computing kpt #: 227 total cpu time spent up to now is 81.7 secs Computing kpt #: 228 total cpu time spent up to now is 82.0 secs Computing kpt #: 229 total cpu time spent up to now is 82.3 secs Computing kpt #: 230 total cpu time spent up to now is 82.7 secs Computing kpt #: 231 total cpu time spent up to now is 83.0 secs Computing kpt #: 232 total cpu time spent up to now is 83.3 secs Computing kpt #: 233 total cpu time spent up to now is 83.7 secs Computing kpt #: 234 total cpu time spent up to now is 84.0 secs Computing kpt #: 235 total cpu time spent up to now is 84.3 secs Computing kpt #: 236 total cpu time spent up to now is 84.7 secs Computing kpt #: 237 total cpu time spent up to now is 85.0 secs Computing kpt #: 238 total cpu time spent up to now is 85.3 secs Computing kpt #: 239 total cpu time spent up to now is 85.6 secs Computing kpt #: 240 total cpu time spent up to now is 85.9 secs Computing kpt #: 241 total cpu time spent up to now is 86.2 secs Computing kpt #: 242 total cpu time spent up to now is 86.5 secs Computing kpt #: 243 total cpu time spent up to now is 86.9 secs Computing kpt #: 244 total cpu time spent up to now is 87.2 secs Computing kpt #: 245 total cpu time spent up to now is 87.5 secs Computing kpt #: 246 total cpu time spent up to now is 87.9 secs Computing kpt #: 247 total cpu time spent up to now is 88.2 secs Computing kpt #: 248 total cpu time spent up to now is 88.5 secs Computing kpt #: 249 total cpu time spent up to now is 88.8 secs Computing kpt #: 250 total cpu time spent up to now is 89.2 secs Computing kpt #: 251 total cpu time spent up to now is 89.5 secs Computing kpt #: 252 total cpu time spent up to now is 89.8 secs Computing kpt #: 253 total cpu time spent up to now is 90.2 secs Computing kpt #: 254 total cpu time spent up to now is 90.5 secs Computing kpt #: 255 total cpu time spent up to now is 90.9 secs Computing kpt #: 256 total cpu time spent up to now is 91.2 secs Computing kpt #: 257 total cpu time spent up to now is 91.6 secs Computing kpt #: 258 total cpu time spent up to now is 91.9 secs Computing kpt #: 259 total cpu time spent up to now is 92.4 secs Computing kpt #: 260 total cpu time spent up to now is 92.8 secs Computing kpt #: 261 total cpu time spent up to now is 93.3 secs Computing kpt #: 262 total cpu time spent up to now is 93.7 secs Computing kpt #: 263 total cpu time spent up to now is 94.2 secs Computing kpt #: 264 total cpu time spent up to now is 94.6 secs Computing kpt #: 265 total cpu time spent up to now is 95.0 secs Computing kpt #: 266 total cpu time spent up to now is 95.4 secs Computing kpt #: 267 total cpu time spent up to now is 95.8 secs Computing kpt #: 268 total cpu time spent up to now is 96.2 secs Computing kpt #: 269 total cpu time spent up to now is 96.6 secs Computing kpt #: 270 total cpu time spent up to now is 96.9 secs Computing kpt #: 271 total cpu time spent up to now is 97.2 secs Computing kpt #: 272 total cpu time spent up to now is 97.6 secs Computing kpt #: 273 total cpu time spent up to now is 97.9 secs Computing kpt #: 274 total cpu time spent up to now is 98.2 secs Computing kpt #: 275 total cpu time spent up to now is 98.6 secs Computing kpt #: 276 total cpu time spent up to now is 98.9 secs Computing kpt #: 277 total cpu time spent up to now is 99.2 secs Computing kpt #: 278 total cpu time spent up to now is 99.6 secs Computing kpt #: 279 total cpu time spent up to now is 99.9 secs Computing kpt #: 280 total cpu time spent up to now is 100.2 secs Computing kpt #: 281 total cpu time spent up to now is 100.5 secs Computing kpt #: 282 total cpu time spent up to now is 100.9 secs Computing kpt #: 283 total cpu time spent up to now is 101.2 secs Computing kpt #: 284 total cpu time spent up to now is 101.5 secs Computing kpt #: 285 total cpu time spent up to now is 101.8 secs Computing kpt #: 286 total cpu time spent up to now is 102.2 secs Computing kpt #: 287 total cpu time spent up to now is 102.5 secs Computing kpt #: 288 total cpu time spent up to now is 102.8 secs Computing kpt #: 289 total cpu time spent up to now is 103.1 secs Computing kpt #: 290 total cpu time spent up to now is 103.5 secs Computing kpt #: 291 total cpu time spent up to now is 103.8 secs Computing kpt #: 292 total cpu time spent up to now is 104.1 secs Computing kpt #: 293 total cpu time spent up to now is 104.5 secs Computing kpt #: 294 total cpu time spent up to now is 104.8 secs Computing kpt #: 295 total cpu time spent up to now is 105.1 secs Computing kpt #: 296 total cpu time spent up to now is 105.5 secs Computing kpt #: 297 total cpu time spent up to now is 105.8 secs Computing kpt #: 298 total cpu time spent up to now is 106.2 secs Computing kpt #: 299 total cpu time spent up to now is 106.5 secs Computing kpt #: 300 total cpu time spent up to now is 106.8 secs Computing kpt #: 301 total cpu time spent up to now is 107.2 secs Computing kpt #: 302 total cpu time spent up to now is 107.5 secs Computing kpt #: 303 total cpu time spent up to now is 107.8 secs Computing kpt #: 304 total cpu time spent up to now is 108.2 secs Computing kpt #: 305 total cpu time spent up to now is 108.5 secs Computing kpt #: 306 total cpu time spent up to now is 108.9 secs Computing kpt #: 307 total cpu time spent up to now is 109.2 secs Computing kpt #: 308 total cpu time spent up to now is 109.5 secs Computing kpt #: 309 total cpu time spent up to now is 109.9 secs Computing kpt #: 310 total cpu time spent up to now is 110.2 secs Computing kpt #: 311 total cpu time spent up to now is 110.6 secs Computing kpt #: 312 total cpu time spent up to now is 110.9 secs Computing kpt #: 313 total cpu time spent up to now is 111.2 secs Computing kpt #: 314 total cpu time spent up to now is 111.6 secs Computing kpt #: 315 total cpu time spent up to now is 111.9 secs Computing kpt #: 316 total cpu time spent up to now is 112.3 secs Computing kpt #: 317 total cpu time spent up to now is 112.6 secs Computing kpt #: 318 total cpu time spent up to now is 112.9 secs Computing kpt #: 319 total cpu time spent up to now is 113.2 secs Computing kpt #: 320 total cpu time spent up to now is 113.5 secs Computing kpt #: 321 total cpu time spent up to now is 113.9 secs Computing kpt #: 322 total cpu time spent up to now is 114.2 secs Computing kpt #: 323 total cpu time spent up to now is 114.5 secs Computing kpt #: 324 total cpu time spent up to now is 114.8 secs Computing kpt #: 325 total cpu time spent up to now is 115.1 secs Computing kpt #: 326 total cpu time spent up to now is 115.4 secs Computing kpt #: 327 total cpu time spent up to now is 115.7 secs Computing kpt #: 328 total cpu time spent up to now is 116.0 secs Computing kpt #: 329 total cpu time spent up to now is 116.3 secs Computing kpt #: 330 total cpu time spent up to now is 116.6 secs Computing kpt #: 331 total cpu time spent up to now is 117.0 secs Computing kpt #: 332 total cpu time spent up to now is 117.3 secs Computing kpt #: 333 total cpu time spent up to now is 117.6 secs Computing kpt #: 334 total cpu time spent up to now is 117.9 secs Computing kpt #: 335 total cpu time spent up to now is 118.2 secs Computing kpt #: 336 total cpu time spent up to now is 118.5 secs Computing kpt #: 337 total cpu time spent up to now is 118.9 secs Computing kpt #: 338 total cpu time spent up to now is 119.2 secs Computing kpt #: 339 total cpu time spent up to now is 119.5 secs Computing kpt #: 340 total cpu time spent up to now is 119.8 secs Computing kpt #: 341 total cpu time spent up to now is 120.1 secs Computing kpt #: 342 total cpu time spent up to now is 120.4 secs Computing kpt #: 343 total cpu time spent up to now is 120.7 secs Computing kpt #: 344 total cpu time spent up to now is 121.0 secs Computing kpt #: 345 total cpu time spent up to now is 121.3 secs Computing kpt #: 346 total cpu time spent up to now is 121.6 secs Computing kpt #: 347 total cpu time spent up to now is 121.9 secs Computing kpt #: 348 total cpu time spent up to now is 122.2 secs Computing kpt #: 349 total cpu time spent up to now is 122.6 secs Computing kpt #: 350 total cpu time spent up to now is 122.9 secs Computing kpt #: 351 total cpu time spent up to now is 123.2 secs Computing kpt #: 352 total cpu time spent up to now is 123.5 secs Computing kpt #: 353 total cpu time spent up to now is 123.8 secs Computing kpt #: 354 total cpu time spent up to now is 124.1 secs Computing kpt #: 355 total cpu time spent up to now is 124.4 secs Computing kpt #: 356 total cpu time spent up to now is 124.7 secs Computing kpt #: 357 total cpu time spent up to now is 125.0 secs Computing kpt #: 358 total cpu time spent up to now is 125.3 secs Computing kpt #: 359 total cpu time spent up to now is 125.6 secs Computing kpt #: 360 total cpu time spent up to now is 125.9 secs Computing kpt #: 361 total cpu time spent up to now is 126.2 secs Computing kpt #: 362 total cpu time spent up to now is 126.5 secs Computing kpt #: 363 total cpu time spent up to now is 127.0 secs Computing kpt #: 364 total cpu time spent up to now is 127.5 secs Computing kpt #: 365 total cpu time spent up to now is 128.0 secs Computing kpt #: 366 total cpu time spent up to now is 128.5 secs Computing kpt #: 367 total cpu time spent up to now is 128.9 secs Computing kpt #: 368 total cpu time spent up to now is 129.4 secs Computing kpt #: 369 total cpu time spent up to now is 129.8 secs Computing kpt #: 370 total cpu time spent up to now is 130.1 secs Computing kpt #: 371 total cpu time spent up to now is 130.6 secs Computing kpt #: 372 total cpu time spent up to now is 130.9 secs Computing kpt #: 373 total cpu time spent up to now is 131.3 secs Computing kpt #: 374 total cpu time spent up to now is 131.6 secs Computing kpt #: 375 total cpu time spent up to now is 132.0 secs Computing kpt #: 376 total cpu time spent up to now is 132.4 secs Computing kpt #: 377 total cpu time spent up to now is 132.7 secs Computing kpt #: 378 total cpu time spent up to now is 133.1 secs Computing kpt #: 379 total cpu time spent up to now is 133.4 secs Computing kpt #: 380 total cpu time spent up to now is 133.8 secs Computing kpt #: 381 total cpu time spent up to now is 134.1 secs Computing kpt #: 382 total cpu time spent up to now is 134.5 secs ethr = 3.13E-08, avg # of iterations = 15.5 total cpu time spent up to now is 134.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3045 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3411 -21.3411 -21.0685 -21.0685 -11.8652 -11.8652 -11.6972 -11.6972 -11.6673 -11.6673 -4.3081 -4.3081 -1.5770 -1.5770 5.2469 5.2469 6.4967 6.4967 6.6287 6.6287 9.9428 9.9428 10.6868 10.6868 10.8151 10.8151 12.6817 12.6817 12.7438 12.7438 14.3637 14.3637 15.4825 15.4825 k = 0.0085-0.0143-0.0087 ( 3041 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9699 -29.9699 -21.3411 -21.3411 -21.0688 -21.0688 -11.8652 -11.8652 -11.6972 -11.6972 -11.6673 -11.6673 -4.3066 -4.3066 -1.5778 -1.5778 5.2484 5.2484 6.4967 6.4967 6.6287 6.6287 9.9448 9.9448 10.6811 10.6811 10.8089 10.8089 12.6857 12.6857 12.7473 12.7473 14.3643 14.3643 15.4860 15.4860 k = 0.0169-0.0287-0.0174 ( 3043 PWs) bands (ev): -57.1872 -57.1872 -39.8357 -39.8357 -29.9702 -29.9702 -21.3413 -21.3413 -21.0699 -21.0699 -11.8653 -11.8653 -11.6973 -11.6973 -11.6675 -11.6675 -4.3022 -4.3022 -1.5803 -1.5803 5.2530 5.2530 6.4967 6.4967 6.6291 6.6291 9.9506 9.9506 10.6638 10.6638 10.7910 10.7910 12.6972 12.6972 12.7576 12.7576 14.3661 14.3661 15.4965 15.4965 k = 0.0254-0.0430-0.0261 ( 3039 PWs) bands (ev): -57.1871 -57.1871 -39.8356 -39.8356 -29.9706 -29.9706 -21.3415 -21.3415 -21.0717 -21.0717 -11.8654 -11.8654 -11.6974 -11.6974 -11.6679 -11.6679 -4.2948 -4.2948 -1.5845 -1.5845 5.2605 5.2605 6.4965 6.4965 6.6299 6.6299 9.9600 9.9600 10.6342 10.6342 10.7631 10.7631 12.7153 12.7153 12.7748 12.7748 14.3691 14.3691 15.5139 15.5139 k = 0.0339-0.0574-0.0348 ( 3035 PWs) bands (ev): -57.1869 -57.1869 -39.8356 -39.8356 -29.9711 -29.9711 -21.3418 -21.3418 -21.0741 -21.0741 -11.8656 -11.8656 -11.6975 -11.6975 -11.6684 -11.6684 -4.2845 -4.2845 -1.5904 -1.5904 5.2711 5.2711 6.4957 6.4957 6.6317 6.6317 9.9729 9.9729 10.5918 10.5918 10.7276 10.7276 12.7382 12.7382 12.7992 12.7992 14.3734 14.3734 15.5378 15.5378 k = 0.0424-0.0717-0.0435 ( 3033 PWs) bands (ev): -57.1867 -57.1867 -39.8355 -39.8355 -29.9719 -29.9719 -21.3423 -21.3423 -21.0773 -21.0773 -11.8658 -11.8658 -11.6977 -11.6977 -11.6690 -11.6690 -4.2713 -4.2713 -1.5979 -1.5979 5.2846 5.2846 6.4939 6.4939 6.6349 6.6349 9.9890 9.9890 10.5362 10.5362 10.6871 10.6871 12.7636 12.7636 12.8312 12.8312 14.3791 14.3791 15.5680 15.5680 k = 0.0508-0.0860-0.0521 ( 3034 PWs) bands (ev): -57.1865 -57.1865 -39.8354 -39.8354 -29.9728 -29.9728 -21.3428 -21.3428 -21.0811 -21.0811 -11.8661 -11.8661 -11.6979 -11.6979 -11.6698 -11.6698 -4.2553 -4.2553 -1.6069 -1.6069 5.3010 5.3010 6.4908 6.4908 6.6401 6.6401 10.0074 10.0074 10.4683 10.4683 10.6431 10.6431 12.7896 12.7896 12.8708 12.8708 14.3861 14.3861 15.6041 15.6041 k = 0.0593-0.1004-0.0608 ( 3034 PWs) bands (ev): -57.1861 -57.1861 -39.8352 -39.8352 -29.9738 -29.9738 -21.3435 -21.3435 -21.0856 -21.0856 -11.8665 -11.8665 -11.6982 -11.6982 -11.6707 -11.6707 -4.2365 -4.2365 -1.6175 -1.6175 5.3203 5.3203 6.4862 6.4862 6.6477 6.6477 10.0272 10.0272 10.3904 10.3904 10.5966 10.5966 12.8150 12.8150 12.9173 12.9173 14.3946 14.3946 15.6455 15.6455 k = 0.0678-0.1147-0.0695 ( 3040 PWs) bands (ev): -57.1858 -57.1858 -39.8351 -39.8351 -29.9751 -29.9751 -21.3443 -21.3443 -21.0907 -21.0907 -11.8669 -11.8669 -11.6986 -11.6986 -11.6717 -11.6717 -4.2149 -4.2149 -1.6296 -1.6296 5.3423 5.3423 6.4799 6.4799 6.6577 6.6577 10.0455 10.0455 10.3066 10.3066 10.5479 10.5479 12.8393 12.8393 12.9696 12.9696 14.4046 14.4046 15.6917 15.6917 k = 0.0763-0.1290-0.0782 ( 3034 PWs) bands (ev): -57.1854 -57.1854 -39.8349 -39.8349 -29.9764 -29.9764 -21.3452 -21.3452 -21.0964 -21.0964 -11.8673 -11.8673 -11.6989 -11.6989 -11.6727 -11.6727 -4.1905 -4.1905 -1.6432 -1.6432 5.3670 5.3670 6.4723 6.4723 6.6703 6.6703 10.0529 10.0529 10.2275 10.2275 10.4976 10.4976 12.8620 12.8620 13.0266 13.0266 14.4162 14.4162 15.7421 15.7421 k = 0.0847-0.1434-0.0869 ( 3034 PWs) bands (ev): -57.1850 -57.1850 -39.8348 -39.8348 -29.9779 -29.9779 -21.3463 -21.3463 -21.1026 -21.1026 -11.8679 -11.8679 -11.6994 -11.6994 -11.6739 -11.6739 -4.1636 -4.1636 -1.6580 -1.6580 5.3942 5.3942 6.4635 6.4635 6.6854 6.6854 10.0200 10.0200 10.1835 10.1835 10.4459 10.4459 12.8828 12.8828 13.0873 13.0873 14.4294 14.4294 15.7958 15.7958 k = 0.0932-0.1577-0.0956 ( 3029 PWs) bands (ev): -57.1845 -57.1845 -39.8346 -39.8346 -29.9796 -29.9796 -21.3475 -21.3475 -21.1093 -21.1093 -11.8685 -11.8685 -11.6999 -11.6999 -11.6751 -11.6751 -4.1340 -4.1340 -1.6742 -1.6742 5.4239 5.4239 6.4541 6.4541 6.7027 6.7027 9.9352 9.9352 10.1865 10.1865 10.3937 10.3937 12.9014 12.9014 13.1510 13.1510 14.4443 14.4443 15.8522 15.8522 k = 0.1017-0.1721-0.1043 ( 3031 PWs) bands (ev): -57.1840 -57.1840 -39.8343 -39.8343 -29.9814 -29.9814 -21.3490 -21.3490 -21.1165 -21.1165 -11.8691 -11.8691 -11.7005 -11.7005 -11.6764 -11.6764 -4.1020 -4.1020 -1.6916 -1.6916 5.4559 5.4559 6.4444 6.4444 6.7221 6.7221 9.8278 9.8278 10.2067 10.2067 10.3425 10.3425 12.9175 12.9175 13.2169 13.2169 14.4609 14.4609 15.9105 15.9105 k = 0.1102-0.1864-0.1130 ( 3031 PWs) bands (ev): -57.1834 -57.1834 -39.8341 -39.8341 -29.9833 -29.9833 -21.3506 -21.3506 -21.1240 -21.1240 -11.8699 -11.8699 -11.7012 -11.7012 -11.6778 -11.6778 -4.0675 -4.0675 -1.7101 -1.7101 5.4899 5.4899 6.4348 6.4348 6.7434 6.7434 9.7113 9.7113 10.2247 10.2247 10.2990 10.2990 12.9311 12.9311 13.2845 13.2845 14.4792 14.4792 15.9696 15.9696 k = 0.1186-0.2007-0.1217 ( 3029 PWs) bands (ev): -57.1828 -57.1828 -39.8339 -39.8339 -29.9854 -29.9854 -21.3525 -21.3525 -21.1320 -21.1320 -11.8707 -11.8707 -11.7019 -11.7019 -11.6791 -11.6791 -4.0308 -4.0308 -1.7296 -1.7296 5.5257 5.5257 6.4258 6.4258 6.7664 6.7664 9.5897 9.5897 10.2085 10.2085 10.2918 10.2918 12.9421 12.9421 13.3532 13.3532 14.4992 14.4992 16.0288 16.0288 k = 0.1271-0.2151-0.1304 ( 3023 PWs) bands (ev): -57.1822 -57.1822 -39.8336 -39.8336 -29.9876 -29.9876 -21.3546 -21.3546 -21.1402 -21.1402 -11.8715 -11.8715 -11.7028 -11.7028 -11.6804 -11.6804 -3.9918 -3.9918 -1.7500 -1.7500 5.5630 5.5630 6.4180 6.4180 6.7909 6.7909 9.4648 9.4648 10.1626 10.1626 10.3153 10.3153 12.9505 12.9505 13.4227 13.4227 14.5209 14.5209 16.0870 16.0870 k = 0.1356-0.2294-0.1391 ( 3024 PWs) bands (ev): -57.1815 -57.1815 -39.8333 -39.8333 -29.9899 -29.9899 -21.3571 -21.3571 -21.1486 -21.1486 -11.8725 -11.8725 -11.7038 -11.7038 -11.6817 -11.6817 -3.9507 -3.9507 -1.7712 -1.7712 5.6015 5.6015 6.4118 6.4118 6.8167 6.8167 9.3376 9.3376 10.1114 10.1114 10.3441 10.3441 12.9563 12.9563 13.4924 13.4924 14.5442 14.5442 16.1432 16.1432 k = 0.1441-0.2437-0.1477 ( 3020 PWs) bands (ev): -57.1808 -57.1808 -39.8330 -39.8330 -29.9923 -29.9923 -21.3598 -21.3598 -21.1571 -21.1571 -11.8736 -11.8736 -11.7050 -11.7050 -11.6829 -11.6829 -3.9077 -3.9077 -1.7931 -1.7931 5.6407 5.6407 6.4077 6.4077 6.8437 6.8437 9.2089 9.2089 10.0598 10.0598 10.3734 10.3734 12.9597 12.9597 13.5622 13.5622 14.5691 14.5691 16.1965 16.1965 k = 0.1525-0.2581-0.1564 ( 3018 PWs) bands (ev): -57.1801 -57.1801 -39.8327 -39.8327 -29.9948 -29.9948 -21.3630 -21.3630 -21.1658 -21.1658 -11.8747 -11.8747 -11.7062 -11.7062 -11.6840 -11.6840 -3.8629 -3.8629 -1.8156 -1.8156 5.6800 5.6800 6.4064 6.4064 6.8716 6.8716 9.0792 9.0792 10.0089 10.0089 10.4014 10.4014 12.9607 12.9607 13.6316 13.6316 14.5955 14.5955 16.2459 16.2459 k = 0.1610-0.2724-0.1651 ( 3016 PWs) bands (ev): -57.1793 -57.1793 -39.8324 -39.8324 -29.9974 -29.9974 -21.3666 -21.3666 -21.1744 -21.1744 -11.8759 -11.8759 -11.7076 -11.7076 -11.6850 -11.6850 -3.8164 -3.8164 -1.8385 -1.8385 5.7189 5.7189 6.4085 6.4085 6.9003 6.9003 8.9491 8.9491 9.9591 9.9591 10.4275 10.4275 12.9596 12.9596 13.7004 13.7004 14.6234 14.6234 16.2906 16.2906 k = 0.1695-0.2868-0.1738 ( 3017 PWs) bands (ev): -57.1786 -57.1786 -39.8321 -39.8321 -30.0002 -30.0002 -21.3706 -21.3706 -21.1829 -21.1829 -11.8772 -11.8772 -11.7091 -11.7091 -11.6860 -11.6860 -3.7684 -3.7684 -1.8617 -1.8617 5.7566 5.7566 6.4149 6.4149 6.9296 6.9296 8.8191 8.8191 9.9110 9.9110 10.4508 10.4508 12.9565 12.9565 13.7683 13.7683 14.6526 14.6526 16.3302 16.3302 k = 0.1780-0.3011-0.1825 ( 3017 PWs) bands (ev): -57.1777 -57.1777 -39.8318 -39.8318 -30.0030 -30.0030 -21.3752 -21.3752 -21.1912 -21.1912 -11.8786 -11.8786 -11.7108 -11.7108 -11.6868 -11.6868 -3.7190 -3.7190 -1.8850 -1.8850 5.7922 5.7922 6.4262 6.4262 6.9592 6.9592 8.6896 8.6896 9.8647 9.8647 10.4710 10.4710 12.9516 12.9516 13.8351 13.8351 14.6831 14.6831 16.3643 16.3643 k = 0.1864-0.3154-0.1912 ( 3019 PWs) bands (ev): -57.1769 -57.1769 -39.8314 -39.8314 -30.0058 -30.0058 -21.3804 -21.3804 -21.1992 -21.1992 -11.8801 -11.8801 -11.7126 -11.7126 -11.6876 -11.6876 -3.6684 -3.6684 -1.9084 -1.9084 5.8250 5.8250 6.4432 6.4432 6.9891 6.9891 8.5610 8.5610 9.8206 9.8206 10.4875 10.4875 12.9450 12.9450 13.9006 13.9006 14.7148 14.7148 16.3933 16.3933 k = 0.1949-0.3298-0.1999 ( 3015 PWs) bands (ev): -57.1761 -57.1761 -39.8311 -39.8311 -30.0088 -30.0088 -21.3861 -21.3861 -21.2068 -21.2068 -11.8817 -11.8817 -11.7144 -11.7144 -11.6882 -11.6882 -3.6169 -3.6169 -1.9315 -1.9315 5.8542 5.8542 6.4665 6.4665 7.0190 7.0190 8.4338 8.4338 9.7788 9.7788 10.5000 10.5000 12.9370 12.9370 13.9646 13.9646 14.7476 14.7476 16.4175 16.4175 k = 0.2034-0.3441-0.2086 ( 3013 PWs) bands (ev): -57.1752 -57.1752 -39.8307 -39.8307 -30.0118 -30.0118 -21.3924 -21.3924 -21.2141 -21.2141 -11.8834 -11.8834 -11.7163 -11.7163 -11.6887 -11.6887 -3.5647 -3.5647 -1.9542 -1.9542 5.8793 5.8793 6.4964 6.4964 7.0486 7.0486 8.3084 8.3084 9.7395 9.7395 10.5080 10.5080 12.9278 12.9278 14.0270 14.0270 14.7813 14.7813 16.4378 16.4378 k = 0.2119-0.3585-0.2173 ( 3009 PWs) bands (ev): -57.1743 -57.1743 -39.8304 -39.8304 -30.0148 -30.0148 -21.3994 -21.3994 -21.2208 -21.2208 -11.8851 -11.8851 -11.7183 -11.7183 -11.6892 -11.6892 -3.5121 -3.5121 -1.9763 -1.9763 5.9001 5.9001 6.5331 6.5331 7.0779 7.0779 8.1852 8.1852 9.7030 9.7030 10.5113 10.5113 12.9175 12.9175 14.0877 14.0877 14.8158 14.8158 16.4552 16.4552 k = 0.2203-0.3728-0.2260 ( 3011 PWs) bands (ev): -57.1735 -57.1735 -39.8300 -39.8300 -30.0180 -30.0180 -21.4070 -21.4070 -21.2271 -21.2271 -11.8870 -11.8870 -11.7203 -11.7203 -11.6896 -11.6896 -3.4592 -3.4592 -1.9976 -1.9976 5.9164 5.9164 6.5760 6.5760 7.1065 7.1065 8.0648 8.0648 9.6695 9.6695 10.5095 10.5095 12.9063 12.9063 14.1465 14.1465 14.8509 14.8509 16.4708 16.4708 k = 0.2288-0.3871-0.2347 ( 3007 PWs) bands (ev): -57.1726 -57.1726 -39.8296 -39.8296 -30.0211 -30.0211 -21.4153 -21.4153 -21.2328 -21.2328 -11.8889 -11.8889 -11.7223 -11.7223 -11.6899 -11.6899 -3.4064 -3.4064 -2.0178 -2.0178 5.9285 5.9285 6.6248 6.6248 7.1344 7.1344 7.9476 7.9476 9.6390 9.6390 10.5027 10.5027 12.8944 12.8944 14.2033 14.2033 14.8863 14.8863 16.4859 16.4859 k = 0.2373-0.4015-0.2433 ( 3005 PWs) bands (ev): -57.1717 -57.1717 -39.8293 -39.8293 -30.0242 -30.0242 -21.4240 -21.4240 -21.2380 -21.2380 -11.8909 -11.8909 -11.7243 -11.7243 -11.6902 -11.6902 -3.3541 -3.3541 -2.0366 -2.0366 5.9365 5.9365 6.6786 6.6786 7.1613 7.1613 7.8344 7.8344 9.6117 9.6117 10.4905 10.4905 12.8819 12.8819 14.2580 14.2580 14.9219 14.9219 16.5013 16.5013 k = 0.2458-0.4158-0.2520 ( 3008 PWs) bands (ev): -57.1708 -57.1708 -39.8289 -39.8289 -30.0274 -30.0274 -21.4334 -21.4334 -21.2427 -21.2427 -11.8930 -11.8930 -11.7263 -11.7263 -11.6904 -11.6904 -3.3027 -3.3027 -2.0537 -2.0537 5.9408 5.9408 6.7365 6.7365 7.1870 7.1870 7.7257 7.7257 9.5877 9.5877 10.4731 10.4731 12.8691 12.8691 14.3107 14.3107 14.9572 14.9572 16.5182 16.5182 k = 0.2542-0.4301-0.2607 ( 3007 PWs) bands (ev): -57.1699 -57.1699 -39.8285 -39.8285 -30.0306 -30.0306 -21.4431 -21.4431 -21.2469 -21.2469 -11.8952 -11.8952 -11.7283 -11.7283 -11.6905 -11.6905 -3.2525 -3.2525 -2.0687 -2.0687 5.9413 5.9413 6.7975 6.7975 7.2115 7.2115 7.6227 7.6227 9.5672 9.5672 10.4504 10.4504 12.8560 12.8560 14.3611 14.3611 14.9918 14.9918 16.5374 16.5374 k = 0.2627-0.4445-0.2694 ( 3007 PWs) bands (ev): -57.1689 -57.1689 -39.8282 -39.8282 -30.0338 -30.0338 -21.4533 -21.4533 -21.2506 -21.2506 -11.8974 -11.8974 -11.7303 -11.7303 -11.6907 -11.6907 -3.2040 -3.2040 -2.0813 -2.0813 5.9382 5.9382 6.8604 6.8604 7.2348 7.2348 7.5263 7.5263 9.5501 9.5501 10.4227 10.4227 12.8428 12.8428 14.4092 14.4092 15.0255 15.0255 16.5598 16.5598 k = 0.2712-0.4588-0.2781 ( 3009 PWs) bands (ev): -57.1680 -57.1680 -39.8278 -39.8278 -30.0370 -30.0370 -21.4637 -21.4637 -21.2539 -21.2539 -11.8997 -11.8997 -11.7323 -11.7323 -11.6907 -11.6907 -3.1578 -3.1578 -2.0910 -2.0910 5.9310 5.9310 6.9235 6.9235 7.2568 7.2568 7.4382 7.4382 9.5364 9.5364 10.3900 10.3900 12.8296 12.8296 14.4550 14.4550 15.0577 15.0577 16.5861 16.5861 k = 0.2797-0.4732-0.2868 ( 3005 PWs) bands (ev): -57.1671 -57.1671 -39.8274 -39.8274 -30.0401 -30.0401 -21.4744 -21.4744 -21.2568 -21.2568 -11.9019 -11.9019 -11.7341 -11.7341 -11.6908 -11.6908 -3.1144 -3.1144 -2.0974 -2.0974 5.9196 5.9196 6.9843 6.9843 7.2773 7.2773 7.3616 7.3616 9.5262 9.5262 10.3528 10.3528 12.8164 12.8164 14.4985 14.4985 15.0881 15.0881 16.6169 16.6169 k = 0.2881-0.4875-0.2955 ( 3005 PWs) bands (ev): -57.1663 -57.1663 -39.8271 -39.8271 -30.0433 -30.0433 -21.4852 -21.4852 -21.2593 -21.2593 -11.9043 -11.9043 -11.7360 -11.7360 -11.6908 -11.6908 -3.0742 -3.0742 -2.1001 -2.1001 5.9033 5.9033 7.0369 7.0369 7.2865 7.2865 7.3123 7.3123 9.5193 9.5193 10.3112 10.3112 12.8034 12.8034 14.5395 14.5395 15.1163 15.1163 16.6528 16.6528 k = 0.2966-0.5018-0.3042 ( 3005 PWs) bands (ev): -57.1654 -57.1654 -39.8267 -39.8267 -30.0464 -30.0464 -21.4961 -21.4961 -21.2615 -21.2615 -11.9067 -11.9067 -11.7378 -11.7378 -11.6908 -11.6908 -3.0379 -3.0379 -2.0986 -2.0986 5.8819 5.8819 7.0683 7.0683 7.2606 7.2606 7.3273 7.3273 9.5157 9.5157 10.2658 10.2658 12.7905 12.7905 14.5781 14.5781 15.1418 15.1418 16.6943 16.6943 k = 0.3051-0.5162-0.3129 ( 2999 PWs) bands (ev): -57.1645 -57.1645 -39.8263 -39.8263 -30.0494 -30.0494 -21.5070 -21.5070 -21.2635 -21.2635 -11.9090 -11.9090 -11.7395 -11.7395 -11.6907 -11.6907 -3.0058 -3.0058 -2.0927 -2.0927 5.8548 5.8548 7.0658 7.0658 7.2629 7.2629 7.3566 7.3566 9.5152 9.5152 10.2170 10.2170 12.7778 12.7778 14.6142 14.6142 15.1645 15.1645 16.7416 16.7416 k = 0.3136-0.5305-0.3216 ( 3002 PWs) bands (ev): -57.1637 -57.1637 -39.8260 -39.8260 -30.0524 -30.0524 -21.5179 -21.5179 -21.2652 -21.2652 -11.9114 -11.9114 -11.7412 -11.7412 -11.6906 -11.6906 -2.9783 -2.9783 -2.0821 -2.0821 5.8218 5.8218 7.0423 7.0423 7.2825 7.2825 7.3978 7.3978 9.5176 9.5176 10.1654 10.1654 12.7654 12.7654 14.6478 14.6478 15.1841 15.1841 16.7950 16.7950 k = 0.3220-0.5448-0.3303 ( 3005 PWs) bands (ev): -57.1629 -57.1629 -39.8257 -39.8257 -30.0554 -30.0554 -21.5287 -21.5287 -21.2667 -21.2667 -11.9138 -11.9138 -11.7428 -11.7428 -11.6905 -11.6905 -2.9554 -2.9554 -2.0668 -2.0668 5.7831 5.7831 7.0165 7.0165 7.3008 7.3008 7.4508 7.4508 9.5225 9.5225 10.1115 10.1115 12.7532 12.7532 14.6789 14.6789 15.2007 15.2007 16.8545 16.8545 k = 0.3305-0.5592-0.3389 ( 3006 PWs) bands (ev): -57.1620 -57.1620 -39.8253 -39.8253 -30.0582 -30.0582 -21.5392 -21.5392 -21.2681 -21.2681 -11.9162 -11.9162 -11.7443 -11.7443 -11.6904 -11.6904 -2.9372 -2.9372 -2.0471 -2.0471 5.7391 5.7391 6.9962 6.9962 7.3139 7.3139 7.5110 7.5110 9.5296 9.5296 10.0562 10.0562 12.7412 12.7412 14.7074 14.7074 15.2141 15.2141 16.9201 16.9201 k = 0.3390-0.5735-0.3476 ( 3004 PWs) bands (ev): -57.1613 -57.1613 -39.8250 -39.8250 -30.0610 -30.0610 -21.5496 -21.5496 -21.2692 -21.2692 -11.9185 -11.9185 -11.7458 -11.7458 -11.6903 -11.6903 -2.9234 -2.9234 -2.0232 -2.0232 5.6903 5.6903 6.9835 6.9835 7.3232 7.3232 7.5739 7.5739 9.5384 9.5384 10.0001 10.0001 12.7294 12.7294 14.7334 14.7334 15.2246 15.2246 16.9916 16.9916 k = 0.3475-0.5879-0.3563 ( 3007 PWs) bands (ev): -57.1605 -57.1605 -39.8247 -39.8247 -30.0637 -30.0637 -21.5597 -21.5597 -21.2702 -21.2702 -11.9209 -11.9209 -11.7472 -11.7472 -11.6901 -11.6901 -2.9136 -2.9136 -1.9958 -1.9958 5.6378 5.6378 6.9790 6.9790 7.3295 7.3295 7.6369 7.6369 9.5484 9.5484 9.9443 9.9443 12.7178 12.7178 14.7569 14.7569 15.2323 15.2323 17.0687 17.0687 k = 0.3559-0.6022-0.3650 ( 3009 PWs) bands (ev): -57.1598 -57.1598 -39.8244 -39.8244 -30.0663 -30.0663 -21.5694 -21.5694 -21.2711 -21.2711 -11.9231 -11.9231 -11.7485 -11.7485 -11.6900 -11.6900 -2.9073 -2.9073 -1.9655 -1.9655 5.5824 5.5824 6.9822 6.9822 7.3338 7.3338 7.6981 7.6981 9.5588 9.5588 9.8901 9.8901 12.7064 12.7064 14.7779 14.7779 15.2377 15.2377 17.1511 17.1511 k = 0.3644-0.6165-0.3737 ( 3005 PWs) bands (ev): -57.1591 -57.1591 -39.8241 -39.8241 -30.0688 -30.0688 -21.5788 -21.5788 -21.2719 -21.2719 -11.9253 -11.9253 -11.7497 -11.7497 -11.6898 -11.6898 -2.9040 -2.9040 -1.9329 -1.9329 5.5253 5.5253 6.9927 6.9927 7.3363 7.3363 7.7562 7.7562 9.5681 9.5681 9.8392 9.8392 12.6952 12.6952 14.7964 14.7964 15.2410 15.2410 17.2383 17.2383 k = 0.3729-0.6309-0.3824 ( 2998 PWs) bands (ev): -57.1584 -57.1584 -39.8238 -39.8238 -30.0711 -30.0711 -21.5878 -21.5878 -21.2725 -21.2725 -11.9273 -11.9273 -11.7508 -11.7508 -11.6896 -11.6896 -2.9031 -2.9031 -1.8988 -1.8988 5.4675 5.4675 7.0097 7.0097 7.3376 7.3376 7.8100 7.8100 9.5742 9.5742 9.7943 9.7943 12.6842 12.6842 14.8123 14.8123 15.2426 15.2426 17.3299 17.3299 k = 0.3814-0.6452-0.3911 ( 3003 PWs) bands (ev): -57.1578 -57.1578 -39.8236 -39.8236 -30.0734 -30.0734 -21.5964 -21.5964 -21.2731 -21.2731 -11.9294 -11.9294 -11.7520 -11.7520 -11.6894 -11.6894 -2.9042 -2.9042 -1.8639 -1.8639 5.4098 5.4098 7.0324 7.0324 7.3379 7.3379 7.8585 7.8585 9.5738 9.5738 9.7593 9.7593 12.6734 12.6734 14.8259 14.8259 15.2428 15.2428 17.4254 17.4254 k = 0.3898-0.6595-0.3998 ( 3006 PWs) bands (ev): -57.1572 -57.1572 -39.8234 -39.8234 -30.0755 -30.0755 -21.6045 -21.6045 -21.2736 -21.2736 -11.9314 -11.9314 -11.7530 -11.7530 -11.6893 -11.6893 -2.9068 -2.9068 -1.8288 -1.8288 5.3531 5.3531 7.0602 7.0602 7.3374 7.3374 7.9005 7.9005 9.5633 9.5633 9.7383 9.7383 12.6628 12.6628 14.8370 14.8370 15.2422 15.2422 17.5243 17.5243 k = 0.3983-0.6739-0.4085 ( 3006 PWs) bands (ev): -57.1566 -57.1566 -39.8231 -39.8231 -30.0775 -30.0775 -21.6121 -21.6121 -21.2741 -21.2741 -11.9332 -11.9332 -11.7539 -11.7539 -11.6891 -11.6891 -2.9105 -2.9105 -1.7941 -1.7941 5.2981 5.2981 7.0924 7.0924 7.3365 7.3365 7.9353 7.9353 9.5427 9.5427 9.7316 9.7316 12.6525 12.6525 14.8459 14.8459 15.2410 15.2410 17.6259 17.6259 k = 0.4068-0.6882-0.4172 ( 3002 PWs) bands (ev): -57.1561 -57.1561 -39.8229 -39.8229 -30.0794 -30.0794 -21.6192 -21.6192 -21.2745 -21.2745 -11.9349 -11.9349 -11.7548 -11.7548 -11.6889 -11.6889 -2.9149 -2.9149 -1.7603 -1.7603 5.2455 5.2455 7.1283 7.1283 7.3354 7.3354 7.9618 7.9618 9.5167 9.5167 9.7353 9.7353 12.6424 12.6424 14.8526 14.8526 15.2394 15.2394 17.7297 17.7297 k = 0.4153-0.7026-0.4259 ( 3002 PWs) bands (ev): -57.1556 -57.1556 -39.8227 -39.8227 -30.0811 -30.0811 -21.6258 -21.6258 -21.2748 -21.2748 -11.9365 -11.9365 -11.7556 -11.7556 -11.6888 -11.6888 -2.9197 -2.9197 -1.7279 -1.7279 5.1958 5.1958 7.1672 7.1672 7.3345 7.3345 7.9794 7.9794 9.4901 9.4901 9.7445 9.7445 12.6328 12.6328 14.8574 14.8574 15.2378 15.2378 17.8349 17.8349 k = 0.4237-0.7169-0.4345 ( 3005 PWs) bands (ev): -57.1552 -57.1552 -39.8225 -39.8225 -30.0827 -30.0827 -21.6318 -21.6318 -21.2751 -21.2751 -11.9380 -11.9380 -11.7563 -11.7563 -11.6886 -11.6886 -2.9246 -2.9246 -1.6973 -1.6973 5.1495 5.1495 7.2079 7.2079 7.3348 7.3348 7.9877 7.9877 9.4661 9.4661 9.7563 9.7563 12.6235 12.6235 14.8604 14.8604 15.2363 15.2363 17.9408 17.9408 k = 0.4322-0.7312-0.4432 ( 3004 PWs) bands (ev): -57.1548 -57.1548 -39.8224 -39.8224 -30.0841 -30.0841 -21.6372 -21.6372 -21.2753 -21.2753 -11.9393 -11.9393 -11.7569 -11.7569 -11.6885 -11.6885 -2.9295 -2.9295 -1.6689 -1.6689 5.1070 5.1070 7.2478 7.2478 7.3384 7.3384 7.9867 7.9867 9.4461 9.4461 9.7690 9.7690 12.6148 12.6148 14.8619 14.8619 15.2351 15.2351 18.0467 18.0467 k = 0.4407-0.7456-0.4519 ( 3006 PWs) bands (ev): -57.1544 -57.1544 -39.8222 -39.8222 -30.0854 -30.0854 -21.6420 -21.6420 -21.2755 -21.2755 -11.9405 -11.9405 -11.7575 -11.7575 -11.6884 -11.6884 -2.9342 -2.9342 -1.6431 -1.6431 5.0687 5.0687 7.2804 7.2804 7.3516 7.3516 7.9766 7.9766 9.4304 9.4304 9.7816 9.7816 12.6068 12.6068 14.8623 14.8623 15.2341 15.2341 18.1515 18.1515 k = 0.4492-0.7599-0.4606 ( 3008 PWs) bands (ev): -57.1541 -57.1541 -39.8221 -39.8221 -30.0865 -30.0865 -21.6462 -21.6462 -21.2757 -21.2757 -11.9416 -11.9416 -11.7580 -11.7580 -11.6883 -11.6883 -2.9385 -2.9385 -1.6202 -1.6202 5.0348 5.0348 7.2970 7.2970 7.3824 7.3824 7.9581 7.9581 9.4190 9.4190 9.7935 9.7935 12.5995 12.5995 14.8618 14.8618 15.2333 15.2333 18.2540 18.2540 k = 0.4576-0.7743-0.4693 ( 3009 PWs) bands (ev): -57.1538 -57.1538 -39.8220 -39.8220 -30.0874 -30.0874 -21.6498 -21.6498 -21.2758 -21.2758 -11.9425 -11.9425 -11.7584 -11.7584 -11.6882 -11.6882 -2.9424 -2.9424 -1.6003 -1.6003 5.0058 5.0058 7.3024 7.3024 7.4257 7.4257 7.9322 7.9322 9.4112 9.4112 9.8041 9.8041 12.5930 12.5930 14.8608 14.8608 15.2328 15.2328 18.3530 18.3530 k = 0.4661-0.7886-0.4780 ( 3010 PWs) bands (ev): -57.1536 -57.1536 -39.8219 -39.8219 -30.0882 -30.0882 -21.6528 -21.6528 -21.2759 -21.2759 -11.9432 -11.9432 -11.7587 -11.7587 -11.6881 -11.6881 -2.9456 -2.9456 -1.5838 -1.5838 4.9817 4.9817 7.3039 7.3039 7.4736 7.4736 7.9004 7.9004 9.4063 9.4063 9.8133 9.8133 12.5876 12.5876 14.8595 14.8595 15.2325 15.2325 18.4466 18.4466 k = 0.4746-0.8029-0.4867 ( 3008 PWs) bands (ev): -57.1535 -57.1535 -39.8218 -39.8218 -30.0888 -30.0888 -21.6551 -21.6551 -21.2760 -21.2760 -11.9438 -11.9438 -11.7590 -11.7590 -11.6880 -11.6880 -2.9482 -2.9482 -1.5707 -1.5707 4.9628 4.9628 7.3040 7.3040 7.5222 7.5222 7.8645 7.8645 9.4036 9.4036 9.8207 9.8207 12.5832 12.5832 14.8582 14.8582 15.2324 15.2324 18.5325 18.5325 k = 0.4831-0.8173-0.4954 ( 3003 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0892 -30.0892 -21.6567 -21.6567 -21.2760 -21.2760 -11.9442 -11.9442 -11.7592 -11.7592 -11.6880 -11.6880 -2.9501 -2.9501 -1.5613 -1.5613 4.9492 4.9492 7.3038 7.3038 7.5683 7.5683 7.8272 7.8272 9.4022 9.4022 9.8261 9.8261 12.5800 12.5800 14.8571 14.8571 15.2323 15.2323 18.6067 18.6067 k = 0.4915-0.8316-0.5041 ( 3007 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0895 -30.0895 -21.6577 -21.6577 -21.2761 -21.2761 -11.9445 -11.9445 -11.7593 -11.7593 -11.6880 -11.6880 -2.9513 -2.9513 -1.5556 -1.5556 4.9410 4.9410 7.3036 7.3036 7.6062 7.6062 7.7946 7.7946 9.4016 9.4016 9.8294 9.8294 12.5781 12.5781 14.8564 14.8564 15.2323 15.2323 18.6618 18.6618 k = 0.5000-0.8459-0.5128 ( 3010 PWs) bands (ev): -57.1532 -57.1532 -39.8218 -39.8218 -30.0896 -30.0896 -21.6580 -21.6580 -21.2761 -21.2761 -11.9446 -11.9446 -11.7593 -11.7593 -11.6880 -11.6880 -2.9517 -2.9517 -1.5537 -1.5537 4.9382 4.9382 7.3035 7.3035 7.6226 7.6226 7.7799 7.7799 9.4014 9.4014 9.8305 9.8305 12.5774 12.5774 14.8561 14.8561 15.2323 15.2323 18.6835 18.6835 k = 0.5000-0.8459-0.5128 ( 3010 PWs) bands (ev): -57.1532 -57.1532 -39.8218 -39.8218 -30.0896 -30.0896 -21.6580 -21.6580 -21.2761 -21.2761 -11.9446 -11.9446 -11.7593 -11.7593 -11.6880 -11.6880 -2.9517 -2.9517 -1.5537 -1.5537 4.9382 4.9382 7.3035 7.3035 7.6226 7.6226 7.7799 7.7799 9.4014 9.4014 9.8305 9.8305 12.5774 12.5774 14.8561 14.8561 15.2323 15.2323 18.6835 18.6835 k = 0.5000-0.8362-0.5289 ( 3014 PWs) bands (ev): -57.1532 -57.1532 -39.8218 -39.8218 -30.0896 -30.0896 -21.6579 -21.6579 -21.2763 -21.2763 -11.9446 -11.9446 -11.7594 -11.7594 -11.6880 -11.6880 -2.9506 -2.9506 -1.5545 -1.5545 4.9401 4.9401 7.2973 7.2973 7.6221 7.6221 7.7873 7.7873 9.4009 9.4009 9.8251 9.8251 12.5812 12.5812 14.8554 14.8554 15.2315 15.2315 18.6844 18.6844 k = 0.5000-0.8264-0.5450 ( 3008 PWs) bands (ev): -57.1532 -57.1532 -39.8217 -39.8217 -30.0897 -30.0897 -21.6576 -21.6576 -21.2771 -21.2771 -11.9444 -11.9444 -11.7595 -11.7595 -11.6881 -11.6881 -2.9475 -2.9475 -1.5569 -1.5569 4.9457 4.9457 7.2797 7.2797 7.6215 7.6215 7.8078 7.8078 9.3991 9.3991 9.8092 9.8092 12.5926 12.5926 14.8533 14.8533 15.2291 15.2291 18.6871 18.6871 k = 0.5000-0.8167-0.5611 ( 3010 PWs) bands (ev): -57.1532 -57.1532 -39.8217 -39.8217 -30.0898 -30.0898 -21.6571 -21.6571 -21.2784 -21.2784 -11.9443 -11.9443 -11.7596 -11.7596 -11.6882 -11.6882 -2.9423 -2.9423 -1.5609 -1.5609 4.9549 4.9549 7.2530 7.2530 7.6217 7.6217 7.8382 7.8382 9.3961 9.3961 9.7832 9.7832 12.6109 12.6109 14.8497 14.8497 15.2252 15.2252 18.6914 18.6914 k = 0.5000-0.8069-0.5772 ( 3006 PWs) bands (ev): -57.1531 -57.1531 -39.8217 -39.8217 -30.0900 -30.0900 -21.6564 -21.6564 -21.2801 -21.2801 -11.9441 -11.9441 -11.7599 -11.7599 -11.6884 -11.6884 -2.9351 -2.9351 -1.5664 -1.5664 4.9679 4.9679 7.2196 7.2196 7.6232 7.6232 7.8753 7.8753 9.3915 9.3915 9.7482 9.7482 12.6358 12.6358 14.8448 14.8448 15.2199 15.2199 18.6972 18.6972 k = 0.5000-0.7972-0.5933 ( 3008 PWs) bands (ev): -57.1530 -57.1530 -39.8217 -39.8217 -30.0902 -30.0902 -21.6555 -21.6555 -21.2824 -21.2824 -11.9439 -11.9439 -11.7602 -11.7602 -11.6887 -11.6887 -2.9259 -2.9259 -1.5734 -1.5734 4.9846 4.9846 7.1817 7.1817 7.6261 7.6261 7.9166 7.9166 9.3848 9.3848 9.7054 9.7054 12.6662 12.6662 14.8386 14.8386 15.2134 15.2134 18.7042 18.7042 k = 0.5000-0.7874-0.6094 ( 3008 PWs) bands (ev): -57.1530 -57.1530 -39.8216 -39.8216 -30.0905 -30.0905 -21.6544 -21.6544 -21.2851 -21.2851 -11.9436 -11.9436 -11.7605 -11.7605 -11.6890 -11.6890 -2.9146 -2.9146 -1.5820 -1.5820 5.0049 5.0049 7.1411 7.1411 7.6303 7.6303 7.9606 7.9606 9.3752 9.3752 9.6568 9.6568 12.7013 12.7013 14.8311 14.8311 15.2058 15.2058 18.7118 18.7118 k = 0.5000-0.7776-0.6255 ( 3010 PWs) bands (ev): -57.1529 -57.1529 -39.8216 -39.8216 -30.0908 -30.0908 -21.6532 -21.6532 -21.2883 -21.2883 -11.9433 -11.9433 -11.7610 -11.7610 -11.6893 -11.6893 -2.9015 -2.9015 -1.5920 -1.5920 5.0288 5.0288 7.0990 7.0990 7.6356 7.6356 8.0058 8.0058 9.3610 9.3610 9.6050 9.6050 12.7402 12.7402 14.8225 14.8225 15.1974 15.1974 18.7191 18.7191 k = 0.5000-0.7679-0.6415 ( 3004 PWs) bands (ev): -57.1527 -57.1527 -39.8215 -39.8215 -30.0912 -30.0912 -21.6517 -21.6517 -21.2919 -21.2919 -11.9429 -11.9429 -11.7614 -11.7614 -11.6896 -11.6896 -2.8865 -2.8865 -1.6035 -1.6035 5.0562 5.0562 7.0563 7.0563 7.6416 7.6416 8.0516 8.0516 9.3394 9.3394 9.5541 9.5541 12.7817 12.7817 14.8128 14.8128 15.1884 15.1884 18.7242 18.7242 k = 0.5000-0.7581-0.6576 ( 3006 PWs) bands (ev): -57.1526 -57.1526 -39.8215 -39.8215 -30.0916 -30.0916 -21.6501 -21.6501 -21.2959 -21.2959 -11.9425 -11.9425 -11.7620 -11.7620 -11.6900 -11.6900 -2.8697 -2.8697 -1.6163 -1.6163 5.0871 5.0871 7.0135 7.0135 7.6481 7.6481 8.0972 8.0972 9.3064 9.3064 9.5091 9.5091 12.8249 12.8249 14.8022 14.8022 15.1791 15.1791 18.7237 18.7237 k = 0.5000-0.7484-0.6737 ( 3006 PWs) bands (ev): -57.1525 -57.1525 -39.8214 -39.8214 -30.0920 -30.0920 -21.6484 -21.6484 -21.3003 -21.3003 -11.9421 -11.9421 -11.7627 -11.7627 -11.6905 -11.6905 -2.8512 -2.8512 -1.6305 -1.6305 5.1214 5.1214 6.9712 6.9712 7.6548 7.6548 8.1420 8.1420 9.2590 9.2590 9.4742 9.4742 12.8689 12.8689 14.7908 14.7908 15.1698 15.1698 18.7127 18.7127 k = 0.5000-0.7386-0.6898 ( 3004 PWs) bands (ev): -57.1523 -57.1523 -39.8214 -39.8214 -30.0925 -30.0925 -21.6464 -21.6464 -21.3050 -21.3050 -11.9416 -11.9416 -11.7633 -11.7633 -11.6909 -11.6909 -2.8310 -2.8310 -1.6459 -1.6459 5.1591 5.1591 6.9297 6.9297 7.6613 7.6613 8.1858 8.1858 9.1985 9.1985 9.4492 9.4492 12.9126 12.9126 14.7788 14.7788 15.1607 15.1607 18.6879 18.6879 k = 0.5000-0.7288-0.7059 ( 3008 PWs) bands (ev): -57.1521 -57.1521 -39.8213 -39.8213 -30.0930 -30.0930 -21.6444 -21.6444 -21.3101 -21.3101 -11.9411 -11.9411 -11.7641 -11.7641 -11.6914 -11.6914 -2.8093 -2.8093 -1.6625 -1.6625 5.2001 5.2001 6.8892 6.8892 7.6670 7.6670 8.2280 8.2280 9.1291 9.1291 9.4312 9.4312 12.9553 12.9553 14.7665 14.7665 15.1521 15.1521 18.6520 18.6520 k = 0.5000-0.7191-0.7220 ( 3010 PWs) bands (ev): -57.1520 -57.1520 -39.8212 -39.8212 -30.0936 -30.0936 -21.6423 -21.6423 -21.3154 -21.3154 -11.9406 -11.9406 -11.7650 -11.7650 -11.6918 -11.6918 -2.7862 -2.7862 -1.6803 -1.6803 5.2442 5.2442 6.8500 6.8500 7.6715 7.6715 8.2684 8.2684 9.0550 9.0550 9.4173 9.4173 12.9962 12.9962 14.7543 14.7543 15.1441 15.1441 18.6102 18.6102 k = 0.5000-0.7093-0.7381 ( 3014 PWs) bands (ev): -57.1518 -57.1518 -39.8212 -39.8212 -30.0941 -30.0941 -21.6400 -21.6400 -21.3209 -21.3209 -11.9400 -11.9400 -11.7659 -11.7659 -11.6923 -11.6923 -2.7617 -2.7617 -1.6991 -1.6991 5.2914 5.2914 6.8122 6.8122 7.6741 7.6741 8.3067 8.3067 8.9794 8.9794 9.4056 9.4056 13.0345 13.0345 14.7423 14.7423 15.1369 15.1369 18.5667 18.5667 k = 0.5000-0.6996-0.7542 ( 3014 PWs) bands (ev): -57.1516 -57.1516 -39.8211 -39.8211 -30.0947 -30.0947 -21.6377 -21.6377 -21.3266 -21.3266 -11.9395 -11.9395 -11.7668 -11.7668 -11.6927 -11.6927 -2.7360 -2.7360 -1.7188 -1.7188 5.3415 5.3415 6.7760 6.7760 7.6738 7.6738 8.3425 8.3425 8.9047 8.9047 9.3952 9.3952 13.0696 13.0696 14.7311 14.7311 15.1306 15.1306 18.5241 18.5241 k = 0.5000-0.6898-0.7703 ( 3012 PWs) bands (ev): -57.1514 -57.1514 -39.8210 -39.8210 -30.0953 -30.0953 -21.6353 -21.6353 -21.3324 -21.3324 -11.9389 -11.9389 -11.7678 -11.7678 -11.6931 -11.6931 -2.7091 -2.7091 -1.7395 -1.7395 5.3944 5.3944 6.7414 6.7414 7.6697 7.6697 8.3754 8.3754 8.8332 8.8332 9.3855 9.3855 13.1008 13.1008 14.7209 14.7209 15.1252 15.1252 18.4840 18.4840 k = 0.5000-0.6801-0.7864 ( 3014 PWs) bands (ev): -57.1512 -57.1512 -39.8209 -39.8209 -30.0959 -30.0959 -21.6328 -21.6328 -21.3384 -21.3384 -11.9384 -11.9384 -11.7688 -11.7688 -11.6935 -11.6935 -2.6814 -2.6814 -1.7609 -1.7609 5.4499 5.4499 6.7085 6.7085 7.6605 7.6605 8.4051 8.4051 8.7671 8.7671 9.3764 9.3764 13.1275 13.1275 14.7124 14.7124 15.1206 15.1206 18.4474 18.4474 k = 0.5000-0.6703-0.8025 ( 3016 PWs) bands (ev): -57.1510 -57.1510 -39.8209 -39.8209 -30.0965 -30.0965 -21.6304 -21.6304 -21.3443 -21.3443 -11.9378 -11.9378 -11.7698 -11.7698 -11.6938 -11.6938 -2.6528 -2.6528 -1.7830 -1.7830 5.5080 5.5080 6.6774 6.6774 7.6451 7.6451 8.4306 8.4306 8.7087 8.7087 9.3677 9.3677 13.1496 13.1496 14.7057 14.7057 15.1168 15.1168 18.4148 18.4148 k = 0.5000-0.6605-0.8186 ( 3016 PWs) bands (ev): -57.1508 -57.1508 -39.8208 -39.8208 -30.0972 -30.0972 -21.6279 -21.6279 -21.3503 -21.3503 -11.9373 -11.9373 -11.7709 -11.7709 -11.6942 -11.6942 -2.6235 -2.6235 -1.8057 -1.8057 5.5683 5.5683 6.6481 6.6481 7.6222 7.6222 8.4511 8.4511 8.6607 8.6607 9.3594 9.3594 13.1665 13.1665 14.7013 14.7013 15.1136 15.1136 18.3869 18.3869 k = 0.5000-0.6508-0.8347 ( 3016 PWs) bands (ev): -57.1506 -57.1506 -39.8207 -39.8207 -30.0978 -30.0978 -21.6255 -21.6255 -21.3562 -21.3562 -11.9367 -11.9367 -11.7719 -11.7719 -11.6945 -11.6945 -2.5938 -2.5938 -1.8288 -1.8288 5.6307 5.6307 6.6208 6.6208 7.5911 7.5911 8.4649 8.4649 8.6256 8.6256 9.3516 9.3516 13.1782 13.1782 14.6993 14.6993 15.1108 15.1108 18.3641 18.3641 k = 0.5000-0.6410-0.8508 ( 3012 PWs) bands (ev): -57.1504 -57.1504 -39.8206 -39.8206 -30.0984 -30.0984 -21.6231 -21.6231 -21.3619 -21.3619 -11.9362 -11.9362 -11.7730 -11.7730 -11.6947 -11.6947 -2.5637 -2.5637 -1.8523 -1.8523 5.6950 5.6950 6.5954 6.5954 7.5512 7.5512 8.4709 8.4709 8.6051 8.6051 9.3444 9.3444 13.1847 13.1847 14.6999 14.6999 15.1083 15.1083 18.3467 18.3467 k = 0.5000-0.6313-0.8669 ( 3018 PWs) bands (ev): -57.1503 -57.1503 -39.8205 -39.8205 -30.0990 -30.0990 -21.6209 -21.6209 -21.3675 -21.3675 -11.9357 -11.9357 -11.7740 -11.7740 -11.6949 -11.6949 -2.5335 -2.5335 -1.8759 -1.8759 5.7607 5.7607 6.5721 6.5721 7.5029 7.5029 8.4705 8.4705 8.5976 8.5976 9.3380 9.3380 13.1862 13.1862 14.7031 14.7031 15.1058 15.1058 18.3349 18.3349 k = 0.5000-0.6215-0.8830 ( 3014 PWs) bands (ev): -57.1501 -57.1501 -39.8205 -39.8205 -30.0996 -30.0996 -21.6187 -21.6187 -21.3728 -21.3728 -11.9352 -11.9352 -11.7750 -11.7750 -11.6951 -11.6951 -2.5033 -2.5033 -1.8997 -1.8997 5.8275 5.8275 6.5510 6.5510 7.4471 7.4471 8.4683 8.4683 8.5980 8.5980 9.3326 9.3326 13.1830 13.1830 14.7086 14.7086 15.1031 15.1031 18.3288 18.3288 k = 0.5000-0.6118-0.8991 ( 3012 PWs) bands (ev): -57.1499 -57.1499 -39.8204 -39.8204 -30.1001 -30.1001 -21.6167 -21.6167 -21.3778 -21.3778 -11.9348 -11.9348 -11.7760 -11.7760 -11.6953 -11.6953 -2.4735 -2.4735 -1.9233 -1.9233 5.8950 5.8950 6.5323 6.5323 7.3848 7.3848 8.4678 8.4678 8.6013 8.6013 9.3284 9.3284 13.1756 13.1756 14.7161 14.7161 15.1001 15.1001 18.3287 18.3287 k = 0.5000-0.6020-0.9152 ( 3016 PWs) bands (ev): -57.1497 -57.1497 -39.8203 -39.8203 -30.1007 -30.1007 -21.6148 -21.6148 -21.3825 -21.3825 -11.9344 -11.9344 -11.7769 -11.7769 -11.6954 -11.6954 -2.4442 -2.4442 -1.9466 -1.9466 5.9624 5.9624 6.5165 6.5165 7.3177 7.3177 8.4708 8.4708 8.6045 8.6045 9.3258 9.3258 13.1645 13.1645 14.7253 14.7253 15.0966 15.0966 18.3345 18.3345 k = 0.5000-0.5922-0.9313 ( 3018 PWs) bands (ev): -57.1496 -57.1496 -39.8203 -39.8203 -30.1012 -30.1012 -21.6132 -21.6132 -21.3867 -21.3867 -11.9341 -11.9341 -11.7778 -11.7778 -11.6956 -11.6956 -2.4158 -2.4158 -1.9694 -1.9694 6.0287 6.0287 6.5042 6.5042 7.2472 7.2472 8.4773 8.4773 8.6061 8.6061 9.3248 9.3248 13.1504 13.1504 14.7356 14.7356 15.0926 15.0926 18.3460 18.3460 k = 0.5000-0.5825-0.9474 ( 3012 PWs) bands (ev): -57.1494 -57.1494 -39.8202 -39.8202 -30.1016 -30.1016 -21.6117 -21.6117 -21.3906 -21.3906 -11.9338 -11.9338 -11.7785 -11.7785 -11.6956 -11.6956 -2.3887 -2.3887 -1.9913 -1.9913 6.0923 6.0923 6.4966 6.4966 7.1748 7.1748 8.4868 8.4868 8.6054 8.6054 9.3259 9.3259 13.1340 13.1340 14.7464 14.7464 15.0879 15.0879 18.3632 18.3632 k = 0.5000-0.5727-0.9635 ( 3014 PWs) bands (ev): -57.1493 -57.1493 -39.8202 -39.8202 -30.1020 -30.1020 -21.6105 -21.6105 -21.3939 -21.3939 -11.9335 -11.9335 -11.7792 -11.7792 -11.6957 -11.6957 -2.3632 -2.3632 -2.0121 -2.0121 6.1508 6.1508 6.4957 6.4957 7.1016 7.1016 8.4985 8.4985 8.6020 8.6020 9.3291 9.3291 13.1160 13.1160 14.7569 14.7569 15.0828 15.0828 18.3855 18.3855 k = 0.5000-0.5630-0.9796 ( 3018 PWs) bands (ev): -57.1492 -57.1492 -39.8201 -39.8201 -30.1024 -30.1024 -21.6095 -21.6095 -21.3967 -21.3967 -11.9333 -11.9333 -11.7798 -11.7798 -11.6958 -11.6958 -2.3399 -2.3399 -2.0312 -2.0312 6.2007 6.2007 6.5043 6.5043 7.0290 7.0290 8.5117 8.5117 8.5958 8.5958 9.3346 9.3346 13.0972 13.0972 14.7664 14.7664 15.0773 15.0773 18.4125 18.4125 k = 0.5000-0.5532-0.9957 ( 3012 PWs) bands (ev): -57.1491 -57.1491 -39.8201 -39.8201 -30.1026 -30.1026 -21.6087 -21.6087 -21.3990 -21.3990 -11.9331 -11.9331 -11.7802 -11.7802 -11.6958 -11.6958 -2.3196 -2.3196 -2.0479 -2.0479 6.2379 6.2379 6.5258 6.5258 6.9583 6.9583 8.5253 8.5253 8.5872 8.5872 9.3426 9.3426 13.0782 13.0782 14.7741 14.7741 15.0719 15.0719 18.4434 18.4434 k = 0.5000-0.5434-1.0118 ( 3016 PWs) bands (ev): -57.1491 -57.1491 -39.8200 -39.8200 -30.1029 -30.1029 -21.6082 -21.6082 -21.4007 -21.4007 -11.9330 -11.9330 -11.7806 -11.7806 -11.6958 -11.6958 -2.3032 -2.3032 -2.0615 -2.0615 6.2606 6.2606 6.5604 6.5604 6.8914 6.8914 8.5378 8.5378 8.5771 8.5771 9.3530 9.3530 13.0598 13.0598 14.7791 14.7791 15.0669 15.0669 18.4773 18.4773 k = 0.5000-0.5337-1.0279 ( 3018 PWs) bands (ev): -57.1490 -57.1490 -39.8200 -39.8200 -30.1030 -30.1030 -21.6079 -21.6079 -21.4018 -21.4018 -11.9329 -11.9329 -11.7809 -11.7809 -11.6958 -11.6958 -2.2916 -2.2916 -2.0712 -2.0712 6.2706 6.2706 6.6026 6.6026 6.8322 6.8322 8.5439 8.5439 8.5705 8.5705 9.3659 9.3659 13.0425 13.0425 14.7805 14.7805 15.0628 15.0628 18.5126 18.5126 k = 0.5000-0.5239-1.0440 ( 3020 PWs) bands (ev): -57.1490 -57.1490 -39.8200 -39.8200 -30.1031 -30.1031 -21.6077 -21.6077 -21.4024 -21.4024 -11.9329 -11.9329 -11.7810 -11.7810 -11.6958 -11.6958 -2.2856 -2.2856 -2.0762 -2.0762 6.2717 6.2717 6.6367 6.6367 6.7929 6.7929 8.5351 8.5351 8.5757 8.5757 9.3811 9.3811 13.0270 13.0270 14.7778 14.7778 15.0598 15.0598 18.5475 18.5475 k = 0.5000-0.5142-1.0601 ( 3016 PWs) bands (ev): -57.1490 -57.1490 -39.8200 -39.8200 -30.1031 -30.1031 -21.6077 -21.6077 -21.4024 -21.4024 -11.9328 -11.9328 -11.7810 -11.7810 -11.6958 -11.6958 -2.2852 -2.2852 -2.0766 -2.0766 6.2666 6.2666 6.6329 6.6329 6.8005 6.8005 8.5183 8.5183 8.5855 8.5855 9.3988 9.3988 13.0138 13.0138 14.7703 14.7703 15.0584 15.0584 18.5797 18.5797 k = 0.5000-0.5044-1.0762 ( 3018 PWs) bands (ev): -57.1490 -57.1490 -39.8200 -39.8200 -30.1031 -30.1031 -21.6078 -21.6078 -21.4019 -21.4019 -11.9328 -11.9328 -11.7809 -11.7809 -11.6957 -11.6957 -2.2899 -2.2899 -2.0731 -2.0731 6.2572 6.2572 6.5963 6.5963 6.8482 6.8482 8.4986 8.4986 8.5949 8.5949 9.4186 9.4186 13.0032 13.0032 14.7580 14.7580 15.0584 15.0584 18.6063 18.6063 k = 0.5000-0.4947-1.0923 ( 3014 PWs) bands (ev): -57.1491 -57.1491 -39.8200 -39.8200 -30.1029 -30.1029 -21.6079 -21.6079 -21.4010 -21.4010 -11.9328 -11.9328 -11.7806 -11.7806 -11.6957 -11.6957 -2.2983 -2.2983 -2.0671 -2.0671 6.2444 6.2444 6.5524 6.5524 6.9095 6.9095 8.4772 8.4772 8.6025 8.6025 9.4407 9.4407 12.9957 12.9957 14.7410 14.7410 15.0597 15.0597 18.6243 18.6243 k = 0.5000-0.4849-1.1084 ( 3014 PWs) bands (ev): -57.1491 -57.1491 -39.8201 -39.8201 -30.1026 -30.1026 -21.6081 -21.6081 -21.3996 -21.3996 -11.9328 -11.9328 -11.7802 -11.7802 -11.6957 -11.6957 -2.3092 -2.3092 -2.0598 -2.0598 6.2285 6.2285 6.5103 6.5103 6.9749 6.9749 8.4547 8.4547 8.6079 8.6079 9.4647 9.4647 12.9915 12.9915 14.7197 14.7197 15.0618 15.0618 18.6310 18.6310 k = 0.8163-0.3984-0.9427 ( 3014 PWs) bands (ev): -57.1491 -57.1491 -39.8201 -39.8201 -30.1026 -30.1026 -21.6081 -21.6081 -21.3996 -21.3996 -11.9328 -11.9328 -11.7802 -11.7802 -11.6957 -11.6957 -2.3092 -2.3092 -2.0598 -2.0598 6.2285 6.2285 6.5103 6.5103 6.9749 6.9749 8.4547 8.4547 8.6079 8.6079 9.4647 9.4647 12.9915 12.9915 14.7197 14.7197 15.0618 15.0618 18.6310 18.6310 k = 0.8114-0.3901-0.9266 ( 3018 PWs) bands (ev): -57.1492 -57.1492 -39.8201 -39.8201 -30.1023 -30.1023 -21.6082 -21.6082 -21.3978 -21.3978 -11.9328 -11.9328 -11.7797 -11.7797 -11.6957 -11.6957 -2.3216 -2.3216 -2.0524 -2.0524 6.2100 6.2100 6.4727 6.4727 7.0410 7.0410 8.4317 8.4317 8.6106 8.6106 9.4906 9.4906 12.9908 12.9908 14.6945 14.6945 15.0645 15.0645 18.6252 18.6252 k = 0.8064-0.3817-0.9106 ( 3016 PWs) bands (ev): -57.1494 -57.1494 -39.8202 -39.8202 -30.1018 -30.1018 -21.6082 -21.6082 -21.3956 -21.3956 -11.9328 -11.9328 -11.7791 -11.7791 -11.6956 -11.6956 -2.3347 -2.3347 -2.0458 -2.0458 6.1893 6.1893 6.4402 6.4402 7.1068 7.1068 8.4085 8.4085 8.6105 8.6105 9.5183 9.5183 12.9937 12.9937 14.6658 14.6658 15.0673 15.0673 18.6071 18.6071 k = 0.8015-0.3733-0.8946 ( 3014 PWs) bands (ev): -57.1495 -57.1495 -39.8202 -39.8202 -30.1012 -30.1012 -21.6081 -21.6081 -21.3931 -21.3931 -11.9327 -11.9327 -11.7783 -11.7783 -11.6956 -11.6956 -2.3479 -2.3479 -2.0405 -2.0405 6.1673 6.1673 6.4126 6.4126 7.1713 7.1713 8.3854 8.3854 8.6075 8.6075 9.5477 9.5477 13.0000 13.0000 14.6341 14.6341 15.0701 15.0701 18.5780 18.5780 k = 0.7965-0.3650-0.8786 ( 3018 PWs) bands (ev): -57.1497 -57.1497 -39.8203 -39.8203 -30.1006 -30.1006 -21.6078 -21.6078 -21.3903 -21.3903 -11.9326 -11.9326 -11.7775 -11.7775 -11.6956 -11.6956 -2.3610 -2.3610 -2.0370 -2.0370 6.1449 6.1449 6.3894 6.3894 7.2340 7.2340 8.3628 8.3628 8.6014 8.6014 9.5787 9.5787 13.0098 13.0098 14.5997 14.5997 15.0726 15.0726 18.5396 18.5396 k = 0.7916-0.3566-0.8625 ( 3012 PWs) bands (ev): -57.1500 -57.1500 -39.8204 -39.8204 -30.0998 -30.0998 -21.6072 -21.6072 -21.3872 -21.3872 -11.9325 -11.9325 -11.7766 -11.7766 -11.6955 -11.6955 -2.3736 -2.3736 -2.0356 -2.0356 6.1233 6.1233 6.3696 6.3696 7.2943 7.2943 8.3409 8.3409 8.5925 8.5925 9.6112 9.6112 13.0228 13.0228 14.5630 14.5630 15.0750 15.0750 18.4935 18.4935 k = 0.7866-0.3482-0.8465 ( 3006 PWs) bands (ev): -57.1502 -57.1502 -39.8205 -39.8205 -30.0989 -30.0989 -21.6064 -21.6064 -21.3839 -21.3839 -11.9323 -11.9323 -11.7755 -11.7755 -11.6955 -11.6955 -2.3855 -2.3855 -2.0366 -2.0366 6.1035 6.1035 6.3523 6.3523 7.3519 7.3519 8.3201 8.3201 8.5807 8.5807 9.6451 9.6451 13.0387 13.0387 14.5243 14.5243 15.0772 15.0772 18.4411 18.4411 k = 0.7817-0.3399-0.8305 ( 3008 PWs) bands (ev): -57.1505 -57.1505 -39.8206 -39.8206 -30.0979 -30.0979 -21.6052 -21.6052 -21.3805 -21.3805 -11.9320 -11.9320 -11.7744 -11.7744 -11.6955 -11.6955 -2.3967 -2.3967 -2.0401 -2.0401 6.0863 6.0863 6.3369 6.3369 7.4062 7.4062 8.3006 8.3006 8.5663 8.5663 9.6802 9.6802 13.0571 13.0571 14.4838 14.4838 15.0794 15.0794 18.3834 18.3834 k = 0.7768-0.3315-0.8145 ( 3008 PWs) bands (ev): -57.1509 -57.1509 -39.8208 -39.8208 -30.0967 -30.0967 -21.6037 -21.6037 -21.3769 -21.3769 -11.9317 -11.9317 -11.7732 -11.7732 -11.6955 -11.6955 -2.4069 -2.4069 -2.0463 -2.0463 6.0724 6.0724 6.3227 6.3227 7.4570 7.4570 8.2825 8.2825 8.5496 8.5496 9.7165 9.7165 13.0776 13.0776 14.4418 14.4418 15.0817 15.0817 18.3214 18.3214 k = 0.7718-0.3232-0.7984 ( 3008 PWs) bands (ev): -57.1512 -57.1512 -39.8209 -39.8209 -30.0955 -30.0955 -21.6018 -21.6018 -21.3731 -21.3731 -11.9313 -11.9313 -11.7719 -11.7719 -11.6955 -11.6955 -2.4162 -2.4162 -2.0552 -2.0552 6.0623 6.0623 6.3093 6.3093 7.5038 7.5038 8.2661 8.2661 8.5311 8.5311 9.7537 9.7537 13.0995 13.0995 14.3986 14.3986 15.0844 15.0844 18.2556 18.2556 k = 0.7669-0.3148-0.7824 ( 3004 PWs) bands (ev): -57.1516 -57.1516 -39.8211 -39.8211 -30.0941 -30.0941 -21.5995 -21.5995 -21.3693 -21.3693 -11.9308 -11.9308 -11.7705 -11.7705 -11.6955 -11.6955 -2.4245 -2.4245 -2.0669 -2.0669 6.0563 6.0563 6.2963 6.2963 7.5461 7.5461 8.2513 8.2513 8.5113 8.5113 9.7917 9.7917 13.1226 13.1226 14.3544 14.3544 15.0878 15.0878 18.1868 18.1868 k = 0.7619-0.3064-0.7664 ( 3008 PWs) bands (ev): -57.1521 -57.1521 -39.8213 -39.8213 -30.0926 -30.0926 -21.5968 -21.5968 -21.3654 -21.3654 -11.9303 -11.9303 -11.7691 -11.7691 -11.6955 -11.6955 -2.4318 -2.4318 -2.0814 -2.0814 6.0544 6.0544 6.2836 6.2836 7.5836 7.5836 8.2382 8.2382 8.4910 8.4910 9.8304 9.8304 13.1460 13.1460 14.3094 14.3094 15.0921 15.0921 18.1153 18.1153 k = 0.7570-0.2981-0.7504 ( 3008 PWs) bands (ev): -57.1525 -57.1525 -39.8215 -39.8215 -30.0910 -30.0910 -21.5937 -21.5937 -21.3614 -21.3614 -11.9296 -11.9296 -11.7676 -11.7676 -11.6956 -11.6956 -2.4381 -2.4381 -2.0986 -2.0986 6.0569 6.0569 6.2711 6.2711 7.6157 7.6157 8.2266 8.2266 8.4708 8.4708 9.8695 9.8695 13.1694 13.1694 14.2639 14.2639 15.0976 15.0976 18.0416 18.0416 k = 0.7520-0.2897-0.7343 ( 3010 PWs) bands (ev): -57.1530 -57.1530 -39.8217 -39.8217 -30.0893 -30.0893 -21.5901 -21.5901 -21.3573 -21.3573 -11.9289 -11.9289 -11.7661 -11.7661 -11.6956 -11.6956 -2.4435 -2.4435 -2.1184 -2.1184 6.0636 6.0636 6.2589 6.2589 7.6421 7.6421 8.2165 8.2165 8.4517 8.4517 9.9089 9.9089 13.1922 13.1922 14.2179 14.2179 15.1045 15.1045 17.9661 17.9661 k = 0.7471-0.2814-0.7183 ( 3000 PWs) bands (ev): -57.1536 -57.1536 -39.8219 -39.8219 -30.0874 -30.0874 -21.5861 -21.5861 -21.3533 -21.3533 -11.9279 -11.9279 -11.7645 -11.7645 -11.6956 -11.6956 -2.4480 -2.4480 -2.1407 -2.1407 6.0742 6.0742 6.2472 6.2472 7.6621 7.6621 8.2077 8.2077 8.4346 8.4346 9.9482 9.9482 13.2140 13.2140 14.1719 14.1719 15.1128 15.1128 17.8892 17.8892 k = 0.7422-0.2730-0.7023 ( 3000 PWs) bands (ev): -57.1541 -57.1541 -39.8221 -39.8221 -30.0855 -30.0855 -21.5816 -21.5816 -21.3491 -21.3491 -11.9270 -11.9270 -11.7629 -11.7629 -11.6956 -11.6956 -2.4519 -2.4519 -2.1652 -2.1652 6.0879 6.0879 6.2367 6.2367 7.6753 7.6753 8.1999 8.1999 8.4205 8.4205 9.9873 9.9873 13.2344 13.2344 14.1259 14.1259 15.1227 15.1227 17.8111 17.8111 k = 0.7372-0.2646-0.6863 ( 2998 PWs) bands (ev): -57.1547 -57.1547 -39.8223 -39.8223 -30.0834 -30.0834 -21.5766 -21.5766 -21.3450 -21.3450 -11.9259 -11.9259 -11.7612 -11.7612 -11.6957 -11.6957 -2.4554 -2.4554 -2.1916 -2.1916 6.1032 6.1032 6.2288 6.2288 7.6814 7.6814 8.1932 8.1932 8.4101 8.4101 10.0258 10.0258 13.2532 13.2532 14.0802 14.0802 15.1341 15.1341 17.7321 17.7321 k = 0.7323-0.2563-0.6703 ( 3006 PWs) bands (ev): -57.1554 -57.1554 -39.8226 -39.8226 -30.0812 -30.0812 -21.5712 -21.5712 -21.3409 -21.3409 -11.9248 -11.9248 -11.7595 -11.7595 -11.6958 -11.6958 -2.4590 -2.4590 -2.2194 -2.2194 6.1171 6.1171 6.2265 6.2265 7.6799 7.6799 8.1875 8.1875 8.4039 8.4039 10.0635 10.0635 13.2701 13.2701 14.0350 14.0350 15.1468 15.1468 17.6525 17.6525 k = 0.7273-0.2479-0.6542 ( 3008 PWs) bands (ev): -57.1560 -57.1560 -39.8229 -39.8229 -30.0789 -30.0789 -21.5654 -21.5654 -21.3368 -21.3368 -11.9235 -11.9235 -11.7578 -11.7578 -11.6959 -11.6959 -2.4635 -2.4635 -2.2476 -2.2476 6.1248 6.1248 6.2346 6.2346 7.6709 7.6709 8.1829 8.1829 8.4021 8.4021 10.1001 10.1001 13.2851 13.2851 13.9906 13.9906 15.1606 15.1606 17.5726 17.5726 k = 0.7224-0.2395-0.6382 ( 3008 PWs) bands (ev): -57.1567 -57.1567 -39.8232 -39.8232 -30.0765 -30.0765 -21.5591 -21.5591 -21.3327 -21.3327 -11.9222 -11.9222 -11.7561 -11.7561 -11.6959 -11.6959 -2.4700 -2.4700 -2.2749 -2.2749 6.1237 6.1237 6.2553 6.2553 7.6546 7.6546 8.1796 8.1796 8.4049 8.4049 10.1352 10.1352 13.2981 13.2981 13.9471 13.9471 15.1751 15.1751 17.4927 17.4927 k = 0.7175-0.2312-0.6222 ( 3004 PWs) bands (ev): -57.1574 -57.1574 -39.8234 -39.8234 -30.0740 -30.0740 -21.5524 -21.5524 -21.3285 -21.3285 -11.9207 -11.9207 -11.7542 -11.7542 -11.6960 -11.6960 -2.4806 -2.4806 -2.2994 -2.2994 6.1160 6.1160 6.2865 6.2865 7.6316 7.6316 8.1773 8.1773 8.4121 8.4121 10.1685 10.1685 13.3094 13.3094 13.9048 13.9048 15.1900 15.1900 17.4130 17.4130 k = 0.7125-0.2228-0.6062 ( 3004 PWs) bands (ev): -57.1582 -57.1582 -39.8238 -39.8238 -30.0714 -30.0714 -21.5453 -21.5453 -21.3244 -21.3244 -11.9191 -11.9191 -11.7524 -11.7524 -11.6960 -11.6960 -2.4972 -2.4972 -2.3187 -2.3187 6.1047 6.1047 6.3250 6.3250 7.6025 7.6025 8.1756 8.1756 8.4238 8.4238 10.1996 10.1996 13.3189 13.3189 13.8639 13.8639 15.2048 15.2048 17.3339 17.3339 k = 0.7076-0.2145-0.5901 ( 3000 PWs) bands (ev): -57.1589 -57.1589 -39.8241 -39.8241 -30.0687 -30.0687 -21.5378 -21.5378 -21.3202 -21.3202 -11.9175 -11.9175 -11.7506 -11.7506 -11.6960 -11.6960 -2.5215 -2.5215 -2.3313 -2.3313 6.0916 6.0916 6.3688 6.3688 7.5682 7.5682 8.1742 8.1742 8.4399 8.4399 10.2281 10.2281 13.3269 13.3269 13.8246 13.8246 15.2190 15.2190 17.2557 17.2557 k = 0.7026-0.2061-0.5741 ( 2996 PWs) bands (ev): -57.1597 -57.1597 -39.8244 -39.8244 -30.0660 -30.0660 -21.5300 -21.5300 -21.3161 -21.3161 -11.9157 -11.9157 -11.7487 -11.7487 -11.6960 -11.6960 -2.5535 -2.5535 -2.3369 -2.3369 6.0777 6.0777 6.4167 6.4167 7.5297 7.5297 8.1725 8.1725 8.4605 8.4605 10.2537 10.2537 13.3335 13.3335 13.7871 13.7871 15.2321 15.2321 17.1786 17.1786 k = 0.6977-0.1977-0.5581 ( 2996 PWs) bands (ev): -57.1605 -57.1605 -39.8247 -39.8247 -30.0631 -30.0631 -21.5218 -21.5218 -21.3119 -21.3119 -11.9139 -11.9139 -11.7469 -11.7469 -11.6961 -11.6961 -2.5917 -2.5917 -2.3370 -2.3370 6.0636 6.0636 6.4676 6.4676 7.4877 7.4877 8.1703 8.1703 8.4855 8.4855 10.2759 10.2759 13.3390 13.3390 13.7514 13.7514 15.2437 15.2437 17.1030 17.1030 k = 0.6927-0.1894-0.5421 ( 3002 PWs) bands (ev): -57.1614 -57.1614 -39.8251 -39.8251 -30.0602 -30.0602 -21.5134 -21.5134 -21.3076 -21.3076 -11.9122 -11.9122 -11.7450 -11.7450 -11.6961 -11.6961 -2.6347 -2.6347 -2.3328 -2.3328 6.0496 6.0496 6.5209 6.5209 7.4430 7.4430 8.1675 8.1675 8.5149 8.5149 10.2945 10.2945 13.3435 13.3435 13.7179 13.7179 15.2534 15.2534 17.0294 17.0294 k = 0.6878-0.1810-0.5260 ( 2998 PWs) bands (ev): -57.1622 -57.1622 -39.8254 -39.8254 -30.0572 -30.0572 -21.5048 -21.5048 -21.3033 -21.3033 -11.9102 -11.9102 -11.7431 -11.7431 -11.6960 -11.6960 -2.6812 -2.6812 -2.3255 -2.3255 6.0361 6.0361 6.5758 6.5758 7.3963 7.3963 8.1645 8.1645 8.5485 8.5485 10.3089 10.3089 13.3471 13.3471 13.6865 13.6865 15.2609 15.2609 16.9581 16.9581 k = 0.6829-0.1727-0.5100 ( 3002 PWs) bands (ev): -57.1631 -57.1631 -39.8258 -39.8258 -30.0542 -30.0542 -21.4959 -21.4959 -21.2989 -21.2989 -11.9083 -11.9083 -11.7413 -11.7413 -11.6960 -11.6960 -2.7304 -2.7304 -2.3158 -2.3158 6.0233 6.0233 6.6313 6.6313 7.3482 7.3482 8.1616 8.1616 8.5862 8.5862 10.3190 10.3190 13.3500 13.3500 13.6573 13.6573 15.2659 15.2659 16.8894 16.8894 k = 0.6779-0.1643-0.4940 ( 3002 PWs) bands (ev): -57.1640 -57.1640 -39.8261 -39.8261 -30.0510 -30.0510 -21.4869 -21.4869 -21.2944 -21.2944 -11.9064 -11.9064 -11.7394 -11.7394 -11.6959 -11.6959 -2.7816 -2.7816 -2.3042 -2.3042 6.0114 6.0114 6.6864 6.6864 7.2993 7.2993 8.1595 8.1595 8.6276 8.6276 10.3243 10.3243 13.3522 13.3522 13.6303 13.6303 15.2683 15.2683 16.8239 16.8239 k = 0.6730-0.1559-0.4780 ( 3004 PWs) bands (ev): -57.1649 -57.1649 -39.8265 -39.8265 -30.0479 -30.0479 -21.4778 -21.4778 -21.2898 -21.2898 -11.9044 -11.9044 -11.7375 -11.7375 -11.6958 -11.6958 -2.8343 -2.8343 -2.2911 -2.2911 6.0006 6.0006 6.7399 6.7399 7.2503 7.2503 8.1593 8.1593 8.6726 8.6726 10.3247 10.3247 13.3537 13.3537 13.6054 13.6054 15.2680 15.2680 16.7618 16.7618 k = 0.6680-0.1476-0.4619 ( 3006 PWs) bands (ev): -57.1658 -57.1658 -39.8269 -39.8269 -30.0447 -30.0447 -21.4687 -21.4687 -21.2850 -21.2850 -11.9025 -11.9025 -11.7356 -11.7356 -11.6957 -11.6957 -2.8884 -2.8884 -2.2767 -2.2767 5.9910 5.9910 6.7900 6.7900 7.2018 7.2018 8.1621 8.1621 8.7210 8.7210 10.3199 10.3199 13.3546 13.3546 13.5825 13.5825 15.2650 15.2650 16.7038 16.7038 k = 0.6631-0.1392-0.4459 ( 3006 PWs) bands (ev): -57.1667 -57.1667 -39.8273 -39.8273 -30.0415 -30.0415 -21.4596 -21.4596 -21.2800 -21.2800 -11.9005 -11.9005 -11.7337 -11.7337 -11.6955 -11.6955 -2.9433 -2.9433 -2.2613 -2.2613 5.9829 5.9829 6.8347 6.8347 7.1551 7.1551 8.1691 8.1691 8.7726 8.7726 10.3098 10.3098 13.3547 13.3547 13.5615 13.5615 15.2595 15.2595 16.6502 16.6502 k = 0.6581-0.1308-0.4299 ( 3008 PWs) bands (ev): -57.1676 -57.1676 -39.8276 -39.8276 -30.0383 -30.0383 -21.4506 -21.4506 -21.2747 -21.2747 -11.8985 -11.8985 -11.7317 -11.7317 -11.6953 -11.6953 -2.9989 -2.9989 -2.2449 -2.2449 5.9763 5.9763 6.8706 6.8706 7.1124 7.1124 8.1819 8.1819 8.8270 8.8270 10.2943 10.2943 13.3540 13.3540 13.5420 13.5420 15.2514 15.2514 16.6015 16.6015 k = 0.6532-0.1225-0.4139 ( 3012 PWs) bands (ev): -57.1686 -57.1686 -39.8280 -39.8280 -30.0350 -30.0350 -21.4417 -21.4417 -21.2692 -21.2692 -11.8966 -11.8966 -11.7299 -11.7299 -11.6951 -11.6951 -3.0550 -3.0550 -2.2277 -2.2277 5.9714 5.9714 6.8922 6.8922 7.0781 7.0781 8.2017 8.2017 8.8842 8.8842 10.2734 10.2734 13.3524 13.3524 13.5239 13.5239 15.2411 15.2411 16.5580 16.5580 k = 0.6483-0.1141-0.3978 ( 3008 PWs) bands (ev): -57.1695 -57.1695 -39.8284 -39.8284 -30.0317 -30.0317 -21.4331 -21.4331 -21.2634 -21.2634 -11.8947 -11.8947 -11.7279 -11.7279 -11.6948 -11.6948 -3.1113 -3.1113 -2.2099 -2.2099 5.9683 5.9683 6.8924 6.8924 7.0583 7.0583 8.2300 8.2300 8.9438 8.9438 10.2471 10.2471 13.3495 13.3495 13.5067 13.5067 15.2286 15.2286 16.5203 16.5203 k = 0.6433-0.1058-0.3818 ( 3002 PWs) bands (ev): -57.1704 -57.1704 -39.8288 -39.8288 -30.0285 -30.0285 -21.4248 -21.4248 -21.2573 -21.2573 -11.8927 -11.8927 -11.7260 -11.7260 -11.6944 -11.6944 -3.1676 -3.1676 -2.1915 -2.1915 5.9671 5.9671 6.8702 6.8702 7.0533 7.0533 8.2675 8.2675 9.0058 9.0058 10.2155 10.2155 13.3453 13.3453 13.4904 13.4904 15.2142 15.2142 16.4886 16.4886 k = 0.6384-0.0974-0.3658 ( 3000 PWs) bands (ev): -57.1714 -57.1714 -39.8291 -39.8291 -30.0252 -30.0252 -21.4168 -21.4168 -21.2508 -21.2508 -11.8909 -11.8909 -11.7241 -11.7241 -11.6939 -11.6939 -3.2239 -3.2239 -2.1726 -2.1726 5.9680 5.9680 6.8342 6.8342 7.0545 7.0545 8.3147 8.3147 9.0698 9.0698 10.1788 10.1788 13.3395 13.3395 13.4744 13.4744 15.1980 15.1980 16.4632 16.4632 k = 0.6334-0.0890-0.3498 ( 3002 PWs) bands (ev): -57.1723 -57.1723 -39.8295 -39.8295 -30.0220 -30.0220 -21.4092 -21.4092 -21.2439 -21.2439 -11.8892 -11.8892 -11.7223 -11.7223 -11.6934 -11.6934 -3.2797 -3.2797 -2.1534 -2.1534 5.9710 5.9710 6.7918 6.7918 7.0546 7.0546 8.3716 8.3716 9.1357 9.1357 10.1373 10.1373 13.3318 13.3318 13.4587 13.4587 15.1803 15.1803 16.4444 16.4444 k = 0.6285-0.0807-0.3338 ( 3006 PWs) bands (ev): -57.1732 -57.1732 -39.8299 -39.8299 -30.0188 -30.0188 -21.4021 -21.4021 -21.2366 -21.2366 -11.8875 -11.8875 -11.7206 -11.7206 -11.6929 -11.6929 -3.3351 -3.3351 -2.1339 -2.1339 5.9761 5.9761 6.7468 6.7468 7.0504 7.0504 8.4378 8.4378 9.2031 9.2031 10.0912 10.0912 13.3219 13.3219 13.4430 13.4430 15.1612 15.1612 16.4324 16.4324 k = 0.6236-0.0723-0.3177 ( 3004 PWs) bands (ev): -57.1741 -57.1741 -39.8303 -39.8303 -30.0156 -30.0156 -21.3955 -21.3955 -21.2290 -21.2290 -11.8859 -11.8859 -11.7188 -11.7188 -11.6922 -11.6922 -3.3899 -3.3899 -2.1143 -2.1143 5.9835 5.9835 6.7010 6.7010 7.0414 7.0414 8.5124 8.5124 9.2717 9.2717 10.0411 10.0411 13.3096 13.3096 13.4271 13.4271 15.1408 15.1408 16.4272 16.4272 k = 0.6186-0.0640-0.3017 ( 3012 PWs) bands (ev): -57.1750 -57.1750 -39.8307 -39.8307 -30.0125 -30.0125 -21.3893 -21.3893 -21.2210 -21.2210 -11.8843 -11.8843 -11.7172 -11.7172 -11.6915 -11.6915 -3.4438 -3.4438 -2.0946 -2.0946 5.9932 5.9932 6.6550 6.6550 7.0276 7.0276 8.5945 8.5945 9.3411 9.3411 9.9874 9.9874 13.2946 13.2946 13.4110 13.4110 15.1192 15.1192 16.4288 16.4288 k = 0.6137-0.0556-0.2857 ( 3006 PWs) bands (ev): -57.1759 -57.1759 -39.8310 -39.8310 -30.0095 -30.0095 -21.3837 -21.3837 -21.2127 -21.2127 -11.8828 -11.8828 -11.7156 -11.7156 -11.6906 -11.6906 -3.4968 -3.4968 -2.0750 -2.0750 6.0052 6.0052 6.6096 6.6096 7.0098 7.0098 8.6832 8.6832 9.4106 9.4106 9.9312 9.9312 13.2770 13.2770 13.3943 13.3943 15.0966 15.0966 16.4371 16.4371 k = 0.6087-0.0472-0.2697 ( 3008 PWs) bands (ev): -57.1767 -57.1767 -39.8314 -39.8314 -30.0065 -30.0065 -21.3785 -21.3785 -21.2042 -21.2042 -11.8815 -11.8815 -11.7141 -11.7141 -11.6897 -11.6897 -3.5487 -3.5487 -2.0554 -2.0554 6.0194 6.0194 6.5649 6.5649 6.9887 6.9887 8.7772 8.7772 9.4787 9.4787 9.8738 9.8738 13.2567 13.2567 13.3769 13.3769 15.0730 15.0730 16.4519 16.4519 k = 0.6038-0.0389-0.2536 ( 3012 PWs) bands (ev): -57.1776 -57.1776 -39.8317 -39.8317 -30.0035 -30.0035 -21.3739 -21.3739 -21.1954 -21.1954 -11.8802 -11.8802 -11.7127 -11.7127 -11.6887 -11.6887 -3.5993 -3.5993 -2.0361 -2.0361 6.0360 6.0360 6.5212 6.5212 6.9652 6.9652 8.8758 8.8758 9.5417 9.5417 9.8193 9.8193 13.2339 13.2339 13.3584 13.3584 15.0485 15.0485 16.4726 16.4726 k = 0.5988-0.0305-0.2376 ( 3010 PWs) bands (ev): -57.1784 -57.1784 -39.8320 -39.8320 -30.0007 -30.0007 -21.3696 -21.3696 -21.1864 -21.1864 -11.8789 -11.8789 -11.7114 -11.7114 -11.6876 -11.6876 -3.6485 -3.6485 -2.0170 -2.0170 6.0548 6.0548 6.4786 6.4786 6.9399 6.9399 8.9780 8.9780 9.5876 9.5876 9.7800 9.7800 13.2088 13.2088 13.3387 13.3387 15.0232 15.0232 16.4990 16.4990 k = 0.5939-0.0222-0.2216 ( 3006 PWs) bands (ev): -57.1792 -57.1792 -39.8324 -39.8324 -29.9979 -29.9979 -21.3658 -21.3658 -21.1774 -21.1774 -11.8778 -11.8778 -11.7102 -11.7102 -11.6863 -11.6863 -3.6962 -3.6962 -1.9983 -1.9983 6.0757 6.0757 6.4374 6.4374 6.9134 6.9134 9.0827 9.0827 9.5883 9.5883 9.7843 9.7843 13.1817 13.1817 13.3173 13.3173 14.9973 14.9973 16.5305 16.5305 k = 0.5890-0.0138-0.2056 ( 3008 PWs) bands (ev): -57.1799 -57.1799 -39.8327 -39.8327 -29.9952 -29.9952 -21.3624 -21.3624 -21.1683 -21.1683 -11.8767 -11.8767 -11.7091 -11.7091 -11.6850 -11.6850 -3.7423 -3.7423 -1.9801 -1.9801 6.0987 6.0987 6.3977 6.3977 6.8864 6.8864 9.1886 9.1886 9.5448 9.5448 9.8319 9.8319 13.1530 13.1530 13.2942 13.2942 14.9707 14.9707 16.5662 16.5662 k = 0.5840-0.0054-0.1895 ( 3002 PWs) bands (ev): -57.1807 -57.1807 -39.8330 -39.8330 -29.9926 -29.9926 -21.3594 -21.3594 -21.1593 -21.1593 -11.8757 -11.8757 -11.7081 -11.7081 -11.6837 -11.6837 -3.7866 -3.7866 -1.9624 -1.9624 6.1235 6.1235 6.3597 6.3597 6.8592 6.8592 9.2917 9.2917 9.4877 9.4877 9.8959 9.8959 13.1230 13.1230 13.2690 13.2690 14.9437 14.9437 16.6057 16.6057 k = 0.5791 0.0029-0.1735 ( 3002 PWs) bands (ev): -57.1814 -57.1814 -39.8333 -39.8333 -29.9902 -29.9902 -21.3567 -21.3567 -21.1504 -21.1504 -11.8749 -11.8749 -11.7073 -11.7073 -11.6823 -11.6823 -3.8291 -3.8291 -1.9453 -1.9453 6.1498 6.1498 6.3236 6.3236 6.8324 6.8324 9.3591 9.3591 9.4609 9.4609 9.9648 9.9648 13.0920 13.0920 13.2416 13.2416 14.9165 14.9165 16.6478 16.6478 k = 0.5741 0.0113-0.1575 ( 3004 PWs) bands (ev): -57.1821 -57.1821 -39.8336 -39.8336 -29.9878 -29.9878 -21.3543 -21.3543 -21.1418 -21.1418 -11.8741 -11.8741 -11.7065 -11.7065 -11.6809 -11.6809 -3.8695 -3.8695 -1.9289 -1.9289 6.1767 6.1767 6.2904 6.2904 6.8062 6.8062 9.3183 9.3183 9.5399 9.5399 10.0350 10.0350 13.0604 13.0604 13.2120 13.2120 14.8892 14.8892 16.6919 16.6919 k = 0.5692 0.0197-0.1415 ( 3008 PWs) bands (ev): -57.1827 -57.1827 -39.8338 -39.8338 -29.9856 -29.9856 -21.3522 -21.3522 -21.1333 -21.1333 -11.8734 -11.8734 -11.7058 -11.7058 -11.6794 -11.6794 -3.9079 -3.9079 -1.9132 -1.9132 6.2006 6.2006 6.2633 6.2633 6.7809 6.7809 9.2497 9.2497 9.6453 9.6453 10.1050 10.1050 13.0285 13.0285 13.1801 13.1801 14.8619 14.8619 16.7370 16.7370 k = 0.5642 0.0280-0.1254 ( 3012 PWs) bands (ev): -57.1833 -57.1833 -39.8341 -39.8341 -29.9835 -29.9835 -21.3503 -21.3503 -21.1252 -21.1252 -11.8727 -11.8727 -11.7052 -11.7052 -11.6780 -11.6780 -3.9440 -3.9440 -1.8983 -1.8983 6.2044 6.2044 6.2595 6.2595 6.7569 6.7569 9.1775 9.1775 9.7533 9.7533 10.1741 10.1741 12.9965 12.9965 13.1460 13.1460 14.8351 14.8351 16.7820 16.7820 k = 0.5593 0.0364-0.1094 ( 3004 PWs) bands (ev): -57.1839 -57.1839 -39.8343 -39.8343 -29.9815 -29.9815 -21.3486 -21.3486 -21.1174 -21.1174 -11.8721 -11.8721 -11.7046 -11.7046 -11.6766 -11.6766 -3.9779 -3.9779 -1.8843 -1.8843 6.1834 6.1834 6.2830 6.2830 6.7344 6.7344 9.1051 9.1051 9.8606 9.8606 10.2415 10.2415 12.9649 12.9649 13.1099 13.1099 14.8088 14.8088 16.8259 16.8259 k = 0.5544 0.0447-0.0934 ( 3006 PWs) bands (ev): -57.1844 -57.1844 -39.8345 -39.8345 -29.9797 -29.9797 -21.3472 -21.3472 -21.1101 -21.1101 -11.8716 -11.8716 -11.7041 -11.7041 -11.6753 -11.6753 -4.0094 -4.0094 -1.8712 -1.8712 6.1583 6.1583 6.3132 6.3132 6.7136 6.7136 9.0337 9.0337 9.9659 9.9659 10.3068 10.3068 12.9339 12.9339 13.0719 13.0719 14.7835 14.7835 16.8679 16.8679 k = 0.5494 0.0531-0.0774 ( 3004 PWs) bands (ev): -57.1849 -57.1849 -39.8347 -39.8347 -29.9780 -29.9780 -21.3459 -21.3459 -21.1032 -21.1032 -11.8711 -11.8711 -11.7037 -11.7037 -11.6740 -11.6740 -4.0384 -4.0384 -1.8591 -1.8591 6.1339 6.1339 6.3446 6.3446 6.6948 6.6948 8.9642 8.9642 10.0680 10.0680 10.3696 10.3696 12.9038 12.9038 13.0326 13.0326 14.7592 14.7592 16.9070 16.9070 k = 0.5445 0.0615-0.0613 ( 3006 PWs) bands (ev): -57.1854 -57.1854 -39.8349 -39.8349 -29.9764 -29.9764 -21.3448 -21.3448 -21.0969 -21.0969 -11.8707 -11.8707 -11.7033 -11.7033 -11.6728 -11.6728 -4.0649 -4.0649 -1.8480 -1.8480 6.1113 6.1113 6.3757 6.3757 6.6781 6.6781 8.8976 8.8976 10.1657 10.1657 10.4293 10.4293 12.8748 12.8748 12.9924 12.9924 14.7363 14.7363 16.9425 16.9425 k = 0.5395 0.0698-0.0453 ( 3006 PWs) bands (ev): -57.1858 -57.1858 -39.8351 -39.8351 -29.9750 -29.9750 -21.3438 -21.3438 -21.0911 -21.0911 -11.8703 -11.8703 -11.7030 -11.7030 -11.6717 -11.6717 -4.0888 -4.0888 -1.8379 -1.8379 6.0906 6.0906 6.4055 6.4055 6.6640 6.6640 8.8346 8.8346 10.2579 10.2579 10.4858 10.4858 12.8472 12.8472 12.9520 12.9520 14.7151 14.7151 16.9738 16.9738 k = 0.5346 0.0782-0.0293 ( 3004 PWs) bands (ev): -57.1861 -57.1861 -39.8352 -39.8352 -29.9738 -29.9738 -21.3430 -21.3430 -21.0859 -21.0859 -11.8700 -11.8700 -11.7027 -11.7027 -11.6707 -11.6707 -4.1100 -4.1100 -1.8289 -1.8289 6.0722 6.0722 6.4330 6.4330 6.6528 6.6528 8.7761 8.7761 10.3430 10.3430 10.5387 10.5387 12.8212 12.8212 12.9126 12.9126 14.6958 14.6958 17.0006 17.0006 k = 0.5297 0.0865-0.0133 ( 2998 PWs) bands (ev): -57.1864 -57.1864 -39.8353 -39.8353 -29.9727 -29.9727 -21.3423 -21.3423 -21.0814 -21.0814 -11.8697 -11.8697 -11.7024 -11.7024 -11.6697 -11.6697 -4.1285 -4.1285 -1.8211 -1.8211 6.0560 6.0560 6.4572 6.4572 6.6448 6.6448 8.7229 8.7229 10.4195 10.4195 10.5879 10.5879 12.7969 12.7969 12.8752 12.8752 14.6786 14.6786 17.0227 17.0227 k = 0.5247 0.0949 0.0028 ( 2996 PWs) bands (ev): -57.1867 -57.1867 -39.8354 -39.8354 -29.9718 -29.9718 -21.3417 -21.3417 -21.0775 -21.0775 -11.8695 -11.8695 -11.7022 -11.7022 -11.6690 -11.6690 -4.1443 -4.1443 -1.8144 -1.8144 6.0423 6.0423 6.4770 6.4770 6.6404 6.6404 8.6758 8.6758 10.4855 10.4855 10.6331 10.6331 12.7743 12.7743 12.8414 12.8414 14.6638 14.6638 17.0404 17.0404 k = 0.5198 0.1033 0.0188 ( 2996 PWs) bands (ev): -57.1869 -57.1869 -39.8355 -39.8355 -29.9710 -29.9710 -21.3413 -21.3413 -21.0742 -21.0742 -11.8693 -11.8693 -11.7021 -11.7021 -11.6683 -11.6683 -4.1572 -4.1572 -1.8089 -1.8089 6.0309 6.0309 6.4919 6.4919 6.6393 6.6393 8.6359 8.6359 10.5395 10.5395 10.6738 10.6738 12.7536 12.7536 12.8127 12.8127 14.6514 14.6514 17.0540 17.0540 k = 0.5148 0.1116 0.0348 ( 2996 PWs) bands (ev): -57.1871 -57.1871 -39.8356 -39.8356 -29.9704 -29.9704 -21.3409 -21.3409 -21.0717 -21.0717 -11.8692 -11.8692 -11.7019 -11.7019 -11.6678 -11.6678 -4.1673 -4.1673 -1.8046 -1.8046 6.0221 6.0221 6.5021 6.5021 6.6408 6.6408 8.6038 8.6038 10.5809 10.5809 10.7088 10.7088 12.7351 12.7351 12.7904 12.7904 14.6416 14.6416 17.0639 17.0639 k = 0.5099 0.1200 0.0508 ( 2992 PWs) bands (ev): -57.1872 -57.1872 -39.8356 -39.8356 -29.9700 -29.9700 -21.3407 -21.3407 -21.0699 -21.0699 -11.8691 -11.8691 -11.7018 -11.7018 -11.6674 -11.6674 -4.1745 -4.1745 -1.8016 -1.8016 6.0157 6.0157 6.5082 6.5082 6.6435 6.6435 8.5803 8.5803 10.6098 10.6098 10.7360 10.7360 12.7200 12.7200 12.7750 12.7750 14.6345 14.6345 17.0706 17.0706 k = 0.5049 0.1284 0.0668 ( 2988 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9697 -29.9697 -21.3405 -21.3405 -21.0688 -21.0688 -11.8690 -11.8690 -11.7018 -11.7018 -11.6671 -11.6671 -4.1789 -4.1789 -1.7997 -1.7997 6.0119 6.0119 6.5113 6.5113 6.6460 6.6460 8.5659 8.5659 10.6267 10.6267 10.7534 10.7534 12.7101 12.7101 12.7660 12.7660 14.6302 14.6302 17.0745 17.0745 k = 0.5000 0.1367 0.0829 ( 2986 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9696 -29.9696 -21.3405 -21.3405 -21.0684 -21.0684 -11.8690 -11.8690 -11.7017 -11.7017 -11.6671 -11.6671 -4.1803 -4.1803 -1.7991 -1.7991 6.0106 6.0106 6.5123 6.5123 6.6469 6.6469 8.5611 8.5611 10.6323 10.6323 10.7594 10.7594 12.7067 12.7067 12.7630 12.7630 14.6288 14.6288 17.0757 17.0757 k = 0.5000 0.1367 0.0829 ( 2986 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9696 -29.9696 -21.3405 -21.3405 -21.0684 -21.0684 -11.8690 -11.8690 -11.7017 -11.7017 -11.6671 -11.6671 -4.1803 -4.1803 -1.7991 -1.7991 6.0106 6.0106 6.5123 6.5123 6.6469 6.6469 8.5611 8.5611 10.6323 10.6323 10.7594 10.7594 12.7067 12.7067 12.7630 12.7630 14.6288 14.6288 17.0757 17.0757 k = 0.4821 0.1318 0.0799 ( 2989 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9696 -29.9696 -21.3405 -21.3405 -21.0684 -21.0684 -11.8690 -11.8690 -11.7017 -11.7017 -11.6671 -11.6671 -4.1808 -4.1808 -1.7984 -1.7984 6.0073 6.0073 6.5122 6.5122 6.6468 6.6468 8.5659 8.5659 10.6324 10.6324 10.7596 10.7596 12.7066 12.7066 12.7630 12.7630 14.6287 14.6287 17.0654 17.0654 k = 0.4643 0.1270 0.0770 ( 2989 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9696 -29.9696 -21.3405 -21.3405 -21.0684 -21.0684 -11.8690 -11.8690 -11.7017 -11.7017 -11.6671 -11.6671 -4.1821 -4.1821 -1.7962 -1.7962 5.9976 5.9976 6.5121 6.5121 6.6466 6.6466 8.5802 8.5802 10.6329 10.6329 10.7601 10.7601 12.7064 12.7064 12.7628 12.7628 14.6285 14.6285 17.0353 17.0353 k = 0.4464 0.1221 0.0740 ( 3007 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9697 -29.9697 -21.3406 -21.3406 -21.0684 -21.0684 -11.8690 -11.8690 -11.7018 -11.7018 -11.6671 -11.6671 -4.1842 -4.1842 -1.7927 -1.7927 5.9817 5.9817 6.5118 6.5118 6.6463 6.6463 8.6037 8.6037 10.6338 10.6338 10.7609 10.7609 12.7061 12.7061 12.7625 12.7625 14.6281 14.6281 16.9877 16.9877 k = 0.4286 0.1172 0.0710 ( 3016 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9697 -29.9697 -21.3406 -21.3406 -21.0684 -21.0684 -11.8690 -11.8690 -11.7017 -11.7017 -11.6671 -11.6671 -4.1871 -4.1871 -1.7878 -1.7878 5.9601 5.9601 6.5115 6.5115 6.6458 6.6458 8.6360 8.6360 10.6349 10.6349 10.7621 10.7621 12.7057 12.7057 12.7621 12.7621 14.6274 14.6274 16.9258 16.9258 k = 0.4107 0.1123 0.0681 ( 3013 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9697 -29.9697 -21.3406 -21.3406 -21.0684 -21.0684 -11.8689 -11.8689 -11.7016 -11.7016 -11.6671 -11.6671 -4.1908 -4.1908 -1.7817 -1.7817 5.9334 5.9334 6.5110 6.5110 6.6452 6.6452 8.6762 8.6762 10.6364 10.6364 10.7636 10.7636 12.7052 12.7052 12.7616 12.7616 14.6264 14.6264 16.8527 16.8527 k = 0.3929 0.1074 0.0651 ( 3019 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9697 -29.9697 -21.3406 -21.3406 -21.0684 -21.0684 -11.8688 -11.8688 -11.7014 -11.7014 -11.6671 -11.6671 -4.1952 -4.1952 -1.7744 -1.7744 5.9022 5.9022 6.5105 6.5105 6.6446 6.6446 8.7237 8.7237 10.6382 10.6382 10.7654 10.7654 12.7045 12.7045 12.7610 12.7610 14.6250 14.6250 16.7713 16.7713 k = 0.3750 0.1025 0.0622 ( 3019 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9697 -29.9697 -21.3406 -21.3406 -21.0684 -21.0684 -11.8686 -11.8686 -11.7013 -11.7013 -11.6671 -11.6671 -4.2002 -4.2002 -1.7659 -1.7659 5.8674 5.8674 6.5100 6.5100 6.6438 6.6438 8.7777 8.7777 10.6402 10.6402 10.7675 10.7675 12.7038 12.7038 12.7603 12.7603 14.6231 14.6231 16.6842 16.6842 k = 0.3571 0.0977 0.0592 ( 3022 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9697 -29.9697 -21.3407 -21.3407 -21.0684 -21.0684 -11.8684 -11.8684 -11.7011 -11.7011 -11.6672 -11.6672 -4.2058 -4.2058 -1.7565 -1.7565 5.8296 5.8296 6.5093 6.5093 6.6430 6.6430 8.8373 8.8373 10.6424 10.6424 10.7698 10.7698 12.7029 12.7029 12.7595 12.7595 14.6205 14.6205 16.5934 16.5934 k = 0.3393 0.0928 0.0562 ( 3028 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3407 -21.3407 -21.0684 -21.0684 -11.8683 -11.8683 -11.7009 -11.7009 -11.6672 -11.6672 -4.2118 -4.2118 -1.7462 -1.7462 5.7896 5.7896 6.5086 6.5086 6.6421 6.6421 8.9015 8.9015 10.6449 10.6449 10.7723 10.7723 12.7020 12.7020 12.7586 12.7586 14.6171 14.6171 16.5006 16.5006 k = 0.3214 0.0879 0.0533 ( 3028 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3407 -21.3407 -21.0684 -21.0684 -11.8681 -11.8681 -11.7006 -11.7006 -11.6672 -11.6672 -4.2183 -4.2183 -1.7352 -1.7352 5.7480 5.7480 6.5078 6.5078 6.6412 6.6412 8.9696 8.9696 10.6476 10.6476 10.7750 10.7750 12.7009 12.7009 12.7577 12.7577 14.6126 14.6126 16.4072 16.4072 k = 0.3036 0.0830 0.0503 ( 3028 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3407 -21.3407 -21.0684 -21.0684 -11.8679 -11.8679 -11.7004 -11.7004 -11.6672 -11.6672 -4.2251 -4.2251 -1.7236 -1.7236 5.7055 5.7055 6.5070 6.5070 6.6403 6.6403 9.0407 9.0407 10.6504 10.6504 10.7779 10.7779 12.6998 12.6998 12.7567 12.7567 14.6070 14.6070 16.3145 16.3145 k = 0.2857 0.0781 0.0474 ( 3028 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3408 -21.3408 -21.0684 -21.0684 -11.8676 -11.8676 -11.7001 -11.7001 -11.6672 -11.6672 -4.2321 -4.2321 -1.7116 -1.7116 5.6627 5.6627 6.5062 6.5062 6.6393 6.6393 9.1139 9.1139 10.6533 10.6533 10.7809 10.7809 12.6986 12.6986 12.7557 12.7557 14.5999 14.5999 16.2235 16.2235 k = 0.2679 0.0732 0.0444 ( 3028 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3408 -21.3408 -21.0684 -21.0684 -11.8674 -11.8674 -11.6999 -11.6999 -11.6672 -11.6672 -4.2392 -4.2392 -1.6993 -1.6993 5.6201 5.6201 6.5053 6.5053 6.6383 6.6383 9.1885 9.1885 10.6563 10.6563 10.7840 10.7840 12.6974 12.6974 12.7546 12.7546 14.5912 14.5912 16.1352 16.1352 k = 0.2500 0.0684 0.0414 ( 3028 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3408 -21.3408 -21.0684 -21.0684 -11.8672 -11.8672 -11.6996 -11.6996 -11.6672 -11.6672 -4.2464 -4.2464 -1.6869 -1.6869 5.5783 5.5783 6.5044 6.5044 6.6373 6.6373 9.2636 9.2636 10.6594 10.6594 10.7871 10.7871 12.6961 12.6961 12.7535 12.7535 14.5807 14.5807 16.0505 16.0505 k = 0.2321 0.0635 0.0385 ( 3022 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3408 -21.3408 -21.0684 -21.0684 -11.8669 -11.8669 -11.6993 -11.6993 -11.6672 -11.6672 -4.2535 -4.2535 -1.6745 -1.6745 5.5376 5.5376 6.5036 6.5036 6.6363 6.6363 9.3386 9.3386 10.6625 10.6625 10.7902 10.7902 12.6947 12.6947 12.7525 12.7525 14.5683 14.5683 15.9703 15.9703 k = 0.2143 0.0586 0.0355 ( 3028 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3409 -21.3409 -21.0684 -21.0684 -11.8667 -11.8667 -11.6990 -11.6990 -11.6672 -11.6672 -4.2604 -4.2604 -1.6622 -1.6622 5.4984 5.4984 6.5027 6.5027 6.6353 6.6353 9.4125 9.4125 10.6655 10.6655 10.7933 10.7933 12.6934 12.6934 12.7514 12.7514 14.5538 14.5538 15.8952 15.8952 k = 0.1964 0.0537 0.0326 ( 3028 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3409 -21.3409 -21.0684 -21.0684 -11.8665 -11.8665 -11.6988 -11.6988 -11.6672 -11.6672 -4.2672 -4.2672 -1.6504 -1.6504 5.4612 5.4612 6.5019 6.5019 6.6344 6.6344 9.4846 9.4846 10.6684 10.6684 10.7963 10.7963 12.6920 12.6920 12.7504 12.7504 14.5374 14.5374 15.8259 15.8259 k = 0.1786 0.0488 0.0296 ( 3028 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3409 -21.3409 -21.0684 -21.0684 -11.8663 -11.8663 -11.6985 -11.6985 -11.6672 -11.6672 -4.2736 -4.2736 -1.6390 -1.6390 5.4262 5.4262 6.5011 6.5011 6.6335 6.6335 9.5541 9.5541 10.6713 10.6713 10.7992 10.7992 12.6906 12.6906 12.7494 12.7494 14.5191 14.5191 15.7629 15.7629 k = 0.1607 0.0439 0.0266 ( 3031 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3409 -21.3409 -21.0684 -21.0684 -11.8661 -11.8661 -11.6983 -11.6983 -11.6672 -11.6672 -4.2797 -4.2797 -1.6282 -1.6282 5.3938 5.3938 6.5003 6.5003 6.6327 6.6327 9.6203 9.6203 10.6739 10.6739 10.8019 10.8019 12.6892 12.6892 12.7484 12.7484 14.4993 14.4993 15.7064 15.7064 k = 0.1429 0.0391 0.0237 ( 3025 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3410 -21.3410 -21.0684 -21.0684 -11.8659 -11.8659 -11.6980 -11.6980 -11.6672 -11.6672 -4.2853 -4.2853 -1.6181 -1.6181 5.3641 5.3641 6.4996 6.4996 6.6319 6.6319 9.6823 9.6823 10.6765 10.6765 10.8045 10.8045 12.6879 12.6879 12.7475 12.7475 14.4784 14.4784 15.6567 15.6567 k = 0.1250 0.0342 0.0207 ( 3049 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3410 -21.3410 -21.0684 -21.0684 -11.8659 -11.8659 -11.6980 -11.6980 -11.6673 -11.6673 -4.2904 -4.2904 -1.6090 -1.6090 5.3374 5.3374 6.4989 6.4989 6.6312 6.6312 9.7392 9.7392 10.6787 10.6787 10.8068 10.8068 12.6866 12.6866 12.7467 12.7467 14.4570 14.4570 15.6137 15.6137 k = 0.1071 0.0293 0.0178 ( 3052 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3410 -21.3410 -21.0684 -21.0684 -11.8657 -11.8657 -11.6978 -11.6978 -11.6673 -11.6673 -4.2949 -4.2949 -1.6008 -1.6008 5.3138 5.3138 6.4983 6.4983 6.6305 6.6305 9.7905 9.7905 10.6808 10.6808 10.8089 10.8089 12.6854 12.6854 12.7460 12.7460 14.4361 14.4361 15.5774 15.5774 k = 0.0893 0.0244 0.0148 ( 3049 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3410 -21.3410 -21.0685 -21.0685 -11.8656 -11.8656 -11.6976 -11.6976 -11.6673 -11.6673 -4.2989 -4.2989 -1.5937 -1.5937 5.2937 5.2937 6.4978 6.4978 6.6300 6.6300 9.8355 9.8355 10.6826 10.6826 10.8107 10.8107 12.6844 12.6844 12.7453 12.7453 14.4163 14.4163 15.5474 15.5474 k = 0.0714 0.0195 0.0118 ( 3043 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3410 -21.3410 -21.0684 -21.0684 -11.8654 -11.8654 -11.6974 -11.6974 -11.6672 -11.6672 -4.3021 -4.3021 -1.5878 -1.5878 5.2770 5.2770 6.4974 6.4974 6.6295 6.6295 9.8732 9.8732 10.6841 10.6841 10.8123 10.8123 12.6835 12.6835 12.7448 12.7448 14.3987 14.3987 15.5235 15.5235 k = 0.0536 0.0146 0.0089 ( 3048 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3411 -21.3411 -21.0685 -21.0685 -11.8654 -11.8654 -11.6974 -11.6974 -11.6673 -11.6673 -4.3047 -4.3047 -1.5831 -1.5831 5.2639 5.2639 6.4971 6.4971 6.6291 6.6291 9.9033 9.9033 10.6852 10.6852 10.8135 10.8135 12.6827 12.6827 12.7444 12.7444 14.3840 14.3840 15.5053 15.5053 k = 0.0357 0.0098 0.0059 ( 3039 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3411 -21.3411 -21.0684 -21.0684 -11.8652 -11.8652 -11.6972 -11.6972 -11.6672 -11.6672 -4.3066 -4.3066 -1.5797 -1.5797 5.2545 5.2545 6.4969 6.4969 6.6289 6.6289 9.9251 9.9251 10.6861 10.6861 10.8144 10.8144 12.6822 12.6822 12.7441 12.7441 14.3729 14.3729 15.4925 15.4925 k = 0.0179 0.0049 0.0030 ( 3039 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3411 -21.3411 -21.0684 -21.0684 -11.8652 -11.8652 -11.6972 -11.6972 -11.6672 -11.6672 -4.3077 -4.3077 -1.5776 -1.5776 5.2488 5.2488 6.4967 6.4967 6.6287 6.6287 9.9384 9.9384 10.6867 10.6867 10.8149 10.8149 12.6818 12.6818 12.7439 12.7439 14.3660 14.3660 15.4850 15.4850 k = 0.0000 0.0000 0.0000 ( 3045 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3411 -21.3411 -21.0685 -21.0685 -11.8652 -11.8652 -11.6972 -11.6972 -11.6673 -11.6673 -4.3081 -4.3081 -1.5770 -1.5770 5.2469 5.2469 6.4967 6.4967 6.6287 6.6287 9.9428 9.9428 10.6868 10.6868 10.8151 10.8151 12.6817 12.6817 12.7438 12.7438 14.3637 14.3637 15.4825 15.4825 k = 0.0000 0.0000 0.0000 ( 3045 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9698 -29.9698 -21.3411 -21.3411 -21.0685 -21.0685 -11.8652 -11.8652 -11.6972 -11.6972 -11.6673 -11.6673 -4.3081 -4.3081 -1.5770 -1.5770 5.2469 5.2469 6.4967 6.4967 6.6287 6.6287 9.9428 9.9428 10.6868 10.6868 10.8151 10.8151 12.6817 12.6817 12.7438 12.7438 14.3637 14.3637 15.4825 15.4825 k = 0.0050-0.0084-0.0161 ( 3043 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9699 -29.9699 -21.3411 -21.3411 -21.0688 -21.0688 -11.8652 -11.8652 -11.6972 -11.6972 -11.6673 -11.6673 -4.3066 -4.3066 -1.5778 -1.5778 5.2484 5.2484 6.4967 6.4967 6.6287 6.6287 9.9449 9.9449 10.6810 10.6810 10.8087 10.8087 12.6858 12.6858 12.7474 12.7474 14.3642 14.3642 15.4860 15.4860 k = 0.0099-0.0168-0.0321 ( 3043 PWs) bands (ev): -57.1872 -57.1872 -39.8357 -39.8357 -29.9702 -29.9702 -21.3413 -21.3413 -21.0699 -21.0699 -11.8653 -11.8653 -11.6973 -11.6973 -11.6675 -11.6675 -4.3020 -4.3020 -1.5804 -1.5804 5.2529 5.2529 6.4967 6.4967 6.6291 6.6291 9.9512 9.9512 10.6632 10.6632 10.7904 10.7904 12.6976 12.6976 12.7579 12.7579 14.3659 14.3659 15.4966 15.4966 k = 0.0149-0.0251-0.0482 ( 3041 PWs) bands (ev): -57.1871 -57.1871 -39.8356 -39.8356 -29.9706 -29.9706 -21.3415 -21.3415 -21.0717 -21.0717 -11.8654 -11.8654 -11.6974 -11.6974 -11.6679 -11.6679 -4.2945 -4.2945 -1.5846 -1.5846 5.2604 5.2604 6.4965 6.4965 6.6299 6.6299 9.9614 9.9614 10.6330 10.6330 10.7619 10.7619 12.7164 12.7164 12.7752 12.7752 14.3687 14.3687 15.5141 15.5141 k = 0.0198-0.0335-0.0643 ( 3043 PWs) bands (ev): -57.1869 -57.1869 -39.8356 -39.8356 -29.9712 -29.9712 -21.3419 -21.3419 -21.0743 -21.0743 -11.8656 -11.8656 -11.6975 -11.6975 -11.6684 -11.6684 -4.2841 -4.2841 -1.5905 -1.5905 5.2710 5.2710 6.4956 6.4956 6.6318 6.6318 9.9753 9.9753 10.5896 10.5896 10.7256 10.7256 12.7408 12.7408 12.7991 12.7991 14.3726 14.3726 15.5384 15.5384 k = 0.0248-0.0419-0.0803 ( 3035 PWs) bands (ev): -57.1867 -57.1867 -39.8355 -39.8355 -29.9719 -29.9719 -21.3423 -21.3423 -21.0775 -21.0775 -11.8658 -11.8658 -11.6977 -11.6977 -11.6690 -11.6690 -4.2706 -4.2706 -1.5980 -1.5980 5.2844 5.2844 6.4937 6.4937 6.6352 6.6352 9.9925 9.9925 10.5329 10.5329 10.6841 10.6841 12.7696 12.7696 12.8290 12.8290 14.3778 14.3778 15.5690 15.5690 k = 0.0297-0.0503-0.0964 ( 3033 PWs) bands (ev): -57.1864 -57.1864 -39.8354 -39.8354 -29.9728 -29.9728 -21.3429 -21.3429 -21.0814 -21.0814 -11.8661 -11.8661 -11.6979 -11.6979 -11.6698 -11.6698 -4.2543 -4.2543 -1.6071 -1.6071 5.3009 5.3009 6.4904 6.4904 6.6406 6.6406 10.0123 10.0123 10.4639 10.4639 10.6390 10.6390 12.8019 12.8019 12.8637 12.8637 14.3841 14.3841 15.6058 15.6058 k = 0.0347-0.0587-0.1124 ( 3033 PWs) bands (ev): -57.1861 -57.1861 -39.8352 -39.8352 -29.9739 -29.9739 -21.3435 -21.3435 -21.0860 -21.0860 -11.8665 -11.8665 -11.6982 -11.6982 -11.6707 -11.6707 -4.2351 -4.2351 -1.6178 -1.6178 5.3202 5.3202 6.4854 6.4854 6.6484 6.6484 10.0339 10.0339 10.3842 10.3842 10.5913 10.5913 12.8371 12.8371 12.9022 12.9022 14.3917 14.3917 15.6482 15.6482 k = 0.0396-0.0671-0.1285 ( 3033 PWs) bands (ev): -57.1858 -57.1858 -39.8351 -39.8351 -29.9752 -29.9752 -21.3443 -21.3443 -21.0912 -21.0912 -11.8669 -11.8669 -11.6985 -11.6985 -11.6718 -11.6718 -4.2131 -4.2131 -1.6300 -1.6300 5.3424 5.3424 6.4787 6.4787 6.6588 6.6588 10.0558 10.0558 10.2960 10.2960 10.5420 10.5420 12.8747 12.8747 12.9432 12.9432 14.4007 14.4007 15.6958 15.6958 k = 0.0446-0.0754-0.1446 ( 3033 PWs) bands (ev): -57.1854 -57.1854 -39.8349 -39.8349 -29.9766 -29.9766 -21.3453 -21.3453 -21.0970 -21.0970 -11.8674 -11.8674 -11.6989 -11.6989 -11.6729 -11.6729 -4.1883 -4.1883 -1.6437 -1.6437 5.3674 5.3674 6.4704 6.4704 6.6719 6.6719 10.0747 10.0747 10.2025 10.2025 10.4927 10.4927 12.9143 12.9143 12.9856 12.9856 14.4111 14.4111 15.7481 15.7481 k = 0.0495-0.0838-0.1606 ( 3031 PWs) bands (ev): -57.1849 -57.1849 -39.8347 -39.8347 -29.9781 -29.9781 -21.3464 -21.3464 -21.1034 -21.1034 -11.8679 -11.8679 -11.6994 -11.6994 -11.6741 -11.6741 -4.1608 -4.1608 -1.6587 -1.6587 5.3952 5.3952 6.4608 6.4608 6.6874 6.6874 10.0687 10.0687 10.1242 10.1242 10.4462 10.4462 12.9557 12.9557 13.0284 13.0284 14.4229 14.4229 15.8044 15.8044 k = 0.0545-0.0922-0.1767 ( 3029 PWs) bands (ev): -57.1844 -57.1844 -39.8345 -39.8345 -29.9798 -29.9798 -21.3477 -21.3477 -21.1103 -21.1103 -11.8685 -11.8685 -11.6999 -11.6999 -11.6754 -11.6754 -4.1306 -4.1306 -1.6751 -1.6751 5.4258 5.4258 6.4503 6.4503 6.7051 6.7051 9.9808 9.9808 10.1144 10.1144 10.4072 10.4072 12.9983 12.9983 13.0711 13.0711 14.4364 14.4364 15.8641 15.8641 k = 0.0595-0.1006-0.1928 ( 3027 PWs) bands (ev): -57.1839 -57.1839 -39.8343 -39.8343 -29.9817 -29.9817 -21.3491 -21.3491 -21.1177 -21.1177 -11.8692 -11.8692 -11.7005 -11.7005 -11.6767 -11.6767 -4.0979 -4.0979 -1.6927 -1.6927 5.4589 5.4589 6.4391 6.4391 6.7250 6.7250 9.8729 9.8729 10.1057 10.1057 10.3823 10.3823 13.0419 13.0419 13.1132 13.1132 14.4515 14.4515 15.9266 15.9266 k = 0.0644-0.1090-0.2088 ( 3027 PWs) bands (ev): -57.1833 -57.1833 -39.8341 -39.8341 -29.9836 -29.9836 -21.3508 -21.3508 -21.1254 -21.1254 -11.8699 -11.8699 -11.7012 -11.7012 -11.6780 -11.6780 -4.0627 -4.0627 -1.7116 -1.7116 5.4947 5.4947 6.4275 6.4275 6.7466 6.7466 9.7606 9.7606 10.0788 10.0788 10.3756 10.3756 13.0858 13.0858 13.1545 13.1545 14.4684 14.4684 15.9912 15.9912 k = 0.0694-0.1174-0.2249 ( 3027 PWs) bands (ev): -57.1827 -57.1827 -39.8338 -39.8338 -29.9858 -29.9858 -21.3527 -21.3527 -21.1336 -21.1336 -11.8708 -11.8708 -11.7019 -11.7019 -11.6794 -11.6794 -4.0251 -4.0251 -1.7315 -1.7315 5.5331 5.5331 6.4159 6.4159 6.7698 6.7698 9.6460 9.6460 10.0349 10.0349 10.3848 10.3848 13.1296 13.1296 13.1951 13.1951 14.4871 14.4871 16.0573 16.0573 k = 0.0743-0.1257-0.2410 ( 3021 PWs) bands (ev): -57.1821 -57.1821 -39.8335 -39.8335 -29.9880 -29.9880 -21.3548 -21.3548 -21.1421 -21.1421 -11.8716 -11.8716 -11.7028 -11.7028 -11.6808 -11.6808 -3.9852 -3.9852 -1.7524 -1.7524 5.5738 5.5738 6.4044 6.4044 6.7943 6.7943 9.5300 9.5300 9.9795 9.9795 10.4039 10.4039 13.1723 13.1723 13.2352 13.2352 14.5079 14.5079 16.1241 16.1241 k = 0.0793-0.1341-0.2570 ( 3023 PWs) bands (ev): -57.1814 -57.1814 -39.8333 -39.8333 -29.9904 -29.9904 -21.3572 -21.3572 -21.1508 -21.1508 -11.8726 -11.8726 -11.7038 -11.7038 -11.6821 -11.6821 -3.9432 -3.9432 -1.7742 -1.7742 5.6170 5.6170 6.3933 6.3933 6.8198 6.8198 9.4134 9.4134 9.9173 9.9173 10.4279 10.4279 13.2130 13.2130 13.2756 13.2756 14.5307 14.5307 16.1911 16.1911 k = 0.0842-0.1425-0.2731 ( 3025 PWs) bands (ev): -57.1807 -57.1807 -39.8330 -39.8330 -29.9928 -29.9928 -21.3599 -21.3599 -21.1597 -21.1597 -11.8737 -11.8737 -11.7049 -11.7049 -11.6834 -11.6834 -3.8990 -3.8990 -1.7969 -1.7969 5.6624 5.6624 6.3828 6.3828 6.8460 6.8460 9.2969 9.2969 9.8512 9.8512 10.4537 10.4537 13.2506 13.2506 13.3170 13.3170 14.5557 14.5557 16.2575 16.2575 k = 0.0892-0.1509-0.2891 ( 3021 PWs) bands (ev): -57.1799 -57.1799 -39.8327 -39.8327 -29.9954 -29.9954 -21.3629 -21.3629 -21.1687 -21.1687 -11.8748 -11.8748 -11.7061 -11.7061 -11.6847 -11.6847 -3.8528 -3.8528 -1.8203 -1.8203 5.7101 5.7101 6.3730 6.3730 6.8726 6.8726 9.1812 9.1812 9.7828 9.7828 10.4795 10.4795 13.2844 13.2844 13.3599 13.3599 14.5828 14.5828 16.3228 16.3228 k = 0.0941-0.1593-0.3052 ( 3017 PWs) bands (ev): -57.1791 -57.1791 -39.8324 -39.8324 -29.9981 -29.9981 -21.3663 -21.3663 -21.1778 -21.1778 -11.8760 -11.8760 -11.7074 -11.7074 -11.6858 -11.6858 -3.8048 -3.8048 -1.8443 -1.8443 5.7598 5.7598 6.3640 6.3640 6.8992 6.8992 9.0667 9.0667 9.7132 9.7132 10.5040 10.5040 13.3143 13.3143 13.4043 13.4043 14.6121 14.6121 16.3864 16.3864 k = 0.0991-0.1676-0.3213 ( 3017 PWs) bands (ev): -57.1783 -57.1783 -39.8320 -39.8320 -30.0009 -30.0009 -21.3701 -21.3701 -21.1869 -21.1869 -11.8774 -11.8774 -11.7089 -11.7089 -11.6869 -11.6869 -3.7550 -3.7550 -1.8688 -1.8688 5.8116 5.8116 6.3561 6.3561 6.9253 6.9253 8.9541 8.9541 9.6431 9.6431 10.5264 10.5264 13.3405 13.3405 13.4497 13.4497 14.6437 14.6437 16.4478 16.4478 k = 0.1040-0.1760-0.3373 ( 3015 PWs) bands (ev): -57.1775 -57.1775 -39.8317 -39.8317 -30.0037 -30.0037 -21.3743 -21.3743 -21.1958 -21.1958 -11.8788 -11.8788 -11.7105 -11.7105 -11.6879 -11.6879 -3.7036 -3.7036 -1.8938 -1.8938 5.8653 5.8653 6.3492 6.3492 6.9503 6.9503 8.8442 8.8442 9.5730 9.5730 10.5461 10.5461 13.3636 13.3636 13.4956 13.4956 14.6774 14.6774 16.5063 16.5063 k = 0.1090-0.1844-0.3534 ( 3013 PWs) bands (ev): -57.1767 -57.1767 -39.8313 -39.8313 -30.0067 -30.0067 -21.3790 -21.3790 -21.2046 -21.2046 -11.8802 -11.8802 -11.7121 -11.7121 -11.6887 -11.6887 -3.6507 -3.6507 -1.9190 -1.9190 5.9207 5.9207 6.3435 6.3435 6.9737 6.9737 8.7376 8.7376 9.5034 9.5034 10.5626 10.5626 13.3837 13.3837 13.5418 13.5418 14.7131 14.7131 16.5617 16.5617 k = 0.1140-0.1928-0.3695 ( 3019 PWs) bands (ev): -57.1758 -57.1758 -39.8310 -39.8310 -30.0097 -30.0097 -21.3842 -21.3842 -21.2132 -21.2132 -11.8818 -11.8818 -11.7139 -11.7139 -11.6896 -11.6896 -3.5965 -3.5965 -1.9445 -1.9445 5.9778 5.9778 6.3390 6.3390 6.9946 6.9946 8.6352 8.6352 9.4346 9.4346 10.5754 10.5754 13.4013 13.4013 13.5879 13.5879 14.7508 14.7508 16.6134 16.6134 k = 0.1189-0.2012-0.3855 ( 3011 PWs) bands (ev): -57.1749 -57.1749 -39.8306 -39.8306 -30.0127 -30.0127 -21.3898 -21.3898 -21.2215 -21.2215 -11.8834 -11.8834 -11.7157 -11.7157 -11.6903 -11.6903 -3.5410 -3.5410 -1.9700 -1.9700 6.0363 6.0363 6.3359 6.3359 7.0123 7.0123 8.5379 8.5379 9.3669 9.3669 10.5844 10.5844 13.4165 13.4165 13.6339 13.6339 14.7901 14.7901 16.6611 16.6611 k = 0.1239-0.2096-0.4016 ( 3009 PWs) bands (ev): -57.1740 -57.1740 -39.8303 -39.8303 -30.0159 -30.0159 -21.3960 -21.3960 -21.2295 -21.2295 -11.8851 -11.8851 -11.7176 -11.7176 -11.6910 -11.6910 -3.4845 -3.4845 -1.9956 -1.9956 6.0960 6.0960 6.3343 6.3343 7.0256 7.0256 8.4466 8.4466 9.3006 9.3006 10.5892 10.5892 13.4296 13.4296 13.6794 13.6794 14.8309 14.8309 16.7047 16.7047 k = 0.1288-0.2179-0.4177 ( 3013 PWs) bands (ev): -57.1731 -57.1731 -39.8299 -39.8299 -30.0191 -30.0191 -21.4027 -21.4027 -21.2371 -21.2371 -11.8870 -11.8870 -11.7196 -11.7196 -11.6916 -11.6916 -3.4271 -3.4271 -2.0210 -2.0210 6.1563 6.1563 6.3348 6.3348 7.0334 7.0334 8.3624 8.3624 9.2359 9.2359 10.5898 10.5898 13.4409 13.4409 13.7245 13.7245 14.8729 14.8729 16.7438 16.7438 k = 0.1338-0.2263-0.4337 ( 3017 PWs) bands (ev): -57.1722 -57.1722 -39.8295 -39.8295 -30.0223 -30.0223 -21.4098 -21.4098 -21.2444 -21.2444 -11.8888 -11.8888 -11.7216 -11.7216 -11.6921 -11.6921 -3.3690 -3.3690 -2.0462 -2.0462 6.2158 6.2158 6.3384 6.3384 7.0347 7.0347 8.2866 8.2866 9.1730 9.1730 10.5861 10.5861 13.4504 13.4504 13.7691 13.7691 14.9156 14.9156 16.7784 16.7784 k = 0.1387-0.2347-0.4498 ( 3019 PWs) bands (ev): -57.1713 -57.1713 -39.8291 -39.8291 -30.0255 -30.0255 -21.4174 -21.4174 -21.2513 -21.2513 -11.8908 -11.8908 -11.7237 -11.7237 -11.6926 -11.6926 -3.3102 -3.3102 -2.0710 -2.0710 6.2697 6.2697 6.3500 6.3500 7.0283 7.0283 8.2200 8.2200 9.1121 9.1121 10.5780 10.5780 13.4586 13.4586 13.8131 13.8131 14.9587 14.9587 16.8087 16.8087 k = 0.1437-0.2431-0.4658 ( 3020 PWs) bands (ev): -57.1704 -57.1704 -39.8288 -39.8288 -30.0288 -30.0288 -21.4254 -21.4254 -21.2578 -21.2578 -11.8927 -11.8927 -11.7257 -11.7257 -11.6931 -11.6931 -3.2510 -3.2510 -2.0954 -2.0954 6.3043 6.3043 6.3828 6.3828 7.0135 7.0135 8.1635 8.1635 9.0534 9.0534 10.5657 10.5657 13.4657 13.4657 13.8565 13.8565 15.0016 15.0016 16.8348 16.8348 k = 0.1486-0.2515-0.4819 ( 3020 PWs) bands (ev): -57.1694 -57.1694 -39.8284 -39.8284 -30.0320 -30.0320 -21.4338 -21.4338 -21.2639 -21.2639 -11.8947 -11.8947 -11.7277 -11.7277 -11.6934 -11.6934 -3.1916 -3.1916 -2.1193 -2.1193 6.3187 6.3187 6.4378 6.4378 6.9899 6.9899 8.1174 8.1174 8.9971 8.9971 10.5492 10.5492 13.4718 13.4718 13.8992 13.8992 15.0437 15.0437 16.8570 16.8570 k = 0.1536-0.2598-0.4980 ( 3026 PWs) bands (ev): -57.1685 -57.1685 -39.8280 -39.8280 -30.0353 -30.0353 -21.4424 -21.4424 -21.2697 -21.2697 -11.8968 -11.8968 -11.7298 -11.7298 -11.6938 -11.6938 -3.1321 -3.1321 -2.1425 -2.1425 6.3264 6.3264 6.5009 6.5009 6.9578 6.9578 8.0814 8.0814 8.9434 8.9434 10.5287 10.5287 13.4771 13.4771 13.9414 13.9414 15.0845 15.0845 16.8760 16.8760 k = 0.1585-0.2682-0.5140 ( 3018 PWs) bands (ev): -57.1676 -57.1676 -39.8276 -39.8276 -30.0386 -30.0386 -21.4513 -21.4513 -21.2752 -21.2752 -11.8988 -11.8988 -11.7318 -11.7318 -11.6941 -11.6941 -3.0728 -3.0728 -2.1649 -2.1649 6.3326 6.3326 6.5665 6.5665 6.9183 6.9183 8.0546 8.0546 8.8923 8.8923 10.5043 10.5043 13.4820 13.4820 13.9828 13.9828 15.1231 15.1231 16.8925 16.8925 k = 0.1635-0.2766-0.5301 ( 3020 PWs) bands (ev): -57.1666 -57.1666 -39.8272 -39.8272 -30.0418 -30.0418 -21.4603 -21.4603 -21.2804 -21.2804 -11.9009 -11.9009 -11.7338 -11.7338 -11.6944 -11.6944 -3.0137 -3.0137 -2.1864 -2.1864 6.3385 6.3385 6.6319 6.6319 6.8738 6.8738 8.0357 8.0357 8.8442 8.8442 10.4763 10.4763 13.4865 13.4865 14.0237 14.0237 15.1589 15.1589 16.9074 16.9074 k = 0.1684-0.2850-0.5462 ( 3014 PWs) bands (ev): -57.1657 -57.1657 -39.8269 -39.8269 -30.0450 -30.0450 -21.4694 -21.4694 -21.2854 -21.2854 -11.9029 -11.9029 -11.7358 -11.7358 -11.6946 -11.6946 -2.9553 -2.9553 -2.2070 -2.2070 6.3444 6.3444 6.6916 6.6916 6.8308 6.8308 8.0231 8.0231 8.7990 8.7990 10.4448 10.4448 13.4910 13.4910 14.0638 14.0638 15.1910 15.1910 16.9217 16.9217 k = 0.1734-0.2934-0.5622 ( 3012 PWs) bands (ev): -57.1648 -57.1648 -39.8265 -39.8265 -30.0482 -30.0482 -21.4785 -21.4785 -21.2902 -21.2902 -11.9049 -11.9049 -11.7378 -11.7378 -11.6948 -11.6948 -2.8975 -2.8975 -2.2264 -2.2264 6.3505 6.3505 6.7154 6.7154 6.8205 6.8205 8.0152 8.0152 8.7569 8.7569 10.4103 10.4103 13.4953 13.4953 14.1033 14.1033 15.2186 15.2186 16.9365 16.9365 k = 0.1784-0.3018-0.5783 ( 3012 PWs) bands (ev): -57.1639 -57.1639 -39.8261 -39.8261 -30.0514 -30.0514 -21.4876 -21.4876 -21.2949 -21.2949 -11.9070 -11.9070 -11.7397 -11.7397 -11.6950 -11.6950 -2.8409 -2.8409 -2.2445 -2.2445 6.3566 6.3566 6.6784 6.6784 6.8694 6.8694 8.0105 8.0105 8.7180 8.7180 10.3728 10.3728 13.4998 13.4998 14.1420 14.1420 15.2412 15.2412 16.9531 16.9531 k = 0.1833-0.3101-0.5944 ( 3014 PWs) bands (ev): -57.1630 -57.1630 -39.8258 -39.8258 -30.0545 -30.0545 -21.4967 -21.4967 -21.2994 -21.2994 -11.9090 -11.9090 -11.7417 -11.7417 -11.6952 -11.6952 -2.7855 -2.7855 -2.2612 -2.2612 6.3625 6.3625 6.6240 6.6240 6.9353 6.9353 8.0075 8.0075 8.6823 8.6823 10.3328 10.3328 13.5044 13.5044 14.1800 14.1800 15.2580 15.2580 16.9723 16.9723 k = 0.1883-0.3185-0.6104 ( 3016 PWs) bands (ev): -57.1621 -57.1621 -39.8254 -39.8254 -30.0575 -30.0575 -21.5055 -21.5055 -21.3038 -21.3038 -11.9110 -11.9110 -11.7437 -11.7437 -11.6953 -11.6953 -2.7318 -2.7318 -2.2761 -2.2761 6.3676 6.3676 6.5668 6.5668 7.0049 7.0049 8.0053 8.0053 8.6499 8.6499 10.2905 10.2905 13.5090 13.5090 14.2172 14.2172 15.2687 15.2687 16.9952 16.9952 k = 0.1932-0.3269-0.6265 ( 3018 PWs) bands (ev): -57.1613 -57.1613 -39.8251 -39.8251 -30.0605 -30.0605 -21.5142 -21.5142 -21.3081 -21.3081 -11.9130 -11.9130 -11.7456 -11.7456 -11.6954 -11.6954 -2.6802 -2.6802 -2.2892 -2.2892 6.3708 6.3708 6.5112 6.5112 7.0756 7.0756 8.0028 8.0028 8.6208 8.6208 10.2462 10.2462 13.5138 13.5138 14.2536 14.2536 15.2732 15.2732 17.0223 17.0223 k = 0.1982-0.3353-0.6425 ( 3018 PWs) bands (ev): -57.1605 -57.1605 -39.8247 -39.8247 -30.0635 -30.0635 -21.5226 -21.5226 -21.3123 -21.3123 -11.9148 -11.9148 -11.7475 -11.7475 -11.6955 -11.6955 -2.6312 -2.6312 -2.2998 -2.2998 6.3684 6.3684 6.4623 6.4623 7.1467 7.1467 7.9993 7.9993 8.5950 8.5950 10.2001 10.2001 13.5184 13.5184 14.2891 14.2891 15.2716 15.2716 17.0541 17.0541 k = 0.2031-0.3437-0.6586 ( 3018 PWs) bands (ev): -57.1596 -57.1596 -39.8244 -39.8244 -30.0663 -30.0663 -21.5307 -21.5307 -21.3165 -21.3165 -11.9167 -11.9167 -11.7494 -11.7494 -11.6956 -11.6956 -2.5856 -2.5856 -2.3073 -2.3073 6.3504 6.3504 6.4308 6.4308 7.2176 7.2176 7.9944 7.9944 8.5725 8.5725 10.1527 10.1527 13.5226 13.5226 14.3237 14.3237 15.2644 15.2644 17.0906 17.0906 k = 0.2081-0.3521-0.6747 ( 3018 PWs) bands (ev): -57.1589 -57.1589 -39.8241 -39.8241 -30.0691 -30.0691 -21.5385 -21.5385 -21.3207 -21.3207 -11.9184 -11.9184 -11.7513 -11.7513 -11.6956 -11.6956 -2.5446 -2.5446 -2.3108 -2.3108 6.3128 6.3128 6.4214 6.4214 7.2880 7.2880 7.9876 7.9876 8.5532 8.5532 10.1041 10.1041 13.5263 13.5263 14.3573 14.3573 15.2522 15.2522 17.1318 17.1318 k = 0.2130-0.3604-0.6907 ( 3016 PWs) bands (ev): -57.1581 -57.1581 -39.8237 -39.8237 -30.0717 -30.0717 -21.5460 -21.5460 -21.3249 -21.3249 -11.9200 -11.9200 -11.7531 -11.7531 -11.6957 -11.6957 -2.5096 -2.5096 -2.3089 -2.3089 6.2682 6.2682 6.4218 6.4218 7.3574 7.3574 7.9788 7.9788 8.5370 8.5370 10.0547 10.0547 13.5290 13.5290 14.3898 14.3898 15.2359 15.2359 17.1773 17.1773 k = 0.2180-0.3688-0.7068 ( 3020 PWs) bands (ev): -57.1573 -57.1573 -39.8234 -39.8234 -30.0743 -30.0743 -21.5530 -21.5530 -21.3290 -21.3290 -11.9216 -11.9216 -11.7550 -11.7550 -11.6957 -11.6957 -2.4823 -2.4823 -2.3002 -2.3002 6.2239 6.2239 6.4251 6.4251 7.4253 7.4253 7.9680 7.9680 8.5239 8.5239 10.0048 10.0048 13.5303 13.5303 14.4212 14.4212 15.2167 15.2167 17.2266 17.2266 k = 0.2229-0.3772-0.7229 ( 3014 PWs) bands (ev): -57.1566 -57.1566 -39.8231 -39.8231 -30.0768 -30.0768 -21.5597 -21.5597 -21.3331 -21.3331 -11.9230 -11.9230 -11.7567 -11.7567 -11.6957 -11.6957 -2.4632 -2.4632 -2.2841 -2.2841 6.1824 6.1824 6.4294 6.4294 7.4908 7.4908 7.9556 7.9556 8.5138 8.5138 9.9545 9.9545 13.5298 13.5298 14.4514 14.4514 15.1955 15.1955 17.2790 17.2790 k = 0.2279-0.3856-0.7389 ( 3016 PWs) bands (ev): -57.1559 -57.1559 -39.8229 -39.8229 -30.0792 -30.0792 -21.5660 -21.5660 -21.3373 -21.3373 -11.9244 -11.9244 -11.7585 -11.7585 -11.6958 -11.6958 -2.4512 -2.4512 -2.2619 -2.2619 6.1445 6.1445 6.4339 6.4339 7.5528 7.5528 7.9425 7.9425 8.5067 8.5067 9.9042 9.9042 13.5269 13.5269 14.4804 14.4804 15.1737 15.1737 17.3340 17.3340 k = 0.2329-0.3940-0.7550 ( 3014 PWs) bands (ev): -57.1553 -57.1553 -39.8226 -39.8226 -30.0815 -30.0815 -21.5718 -21.5718 -21.3414 -21.3414 -11.9257 -11.9257 -11.7602 -11.7602 -11.6958 -11.6958 -2.4440 -2.4440 -2.2360 -2.2360 6.1107 6.1107 6.4383 6.4383 7.6086 7.6086 7.9307 7.9307 8.5025 8.5025 9.8542 9.8542 13.5213 13.5213 14.5082 14.5082 15.1522 15.1522 17.3909 17.3909 k = 0.2378-0.4023-0.7711 ( 3012 PWs) bands (ev): -57.1547 -57.1547 -39.8223 -39.8223 -30.0837 -30.0837 -21.5771 -21.5771 -21.3455 -21.3455 -11.9268 -11.9268 -11.7619 -11.7619 -11.6958 -11.6958 -2.4395 -2.4395 -2.2088 -2.2088 6.0815 6.0815 6.4425 6.4425 7.6540 7.6540 7.9243 7.9243 8.5010 8.5010 9.8046 9.8046 13.5123 13.5123 14.5346 14.5346 15.1320 15.1320 17.4490 17.4490 k = 0.2428-0.4107-0.7871 ( 3016 PWs) bands (ev): -57.1541 -57.1541 -39.8221 -39.8221 -30.0857 -30.0857 -21.5820 -21.5820 -21.3497 -21.3497 -11.9279 -11.9279 -11.7636 -11.7636 -11.6958 -11.6958 -2.4362 -2.4362 -2.1818 -2.1818 6.0571 6.0571 6.4466 6.4466 7.6820 7.6820 7.9300 7.9300 8.5023 8.5023 9.7558 9.7558 13.4999 13.4999 14.5598 14.5598 15.1139 15.1139 17.5080 17.5080 k = 0.2477-0.4191-0.8032 ( 3016 PWs) bands (ev): -57.1535 -57.1535 -39.8219 -39.8219 -30.0877 -30.0877 -21.5865 -21.5865 -21.3538 -21.3538 -11.9289 -11.9289 -11.7652 -11.7652 -11.6958 -11.6958 -2.4330 -2.4330 -2.1561 -2.1561 6.0377 6.0377 6.4504 6.4504 7.6874 7.6874 7.9528 7.9528 8.5060 8.5060 9.7081 9.7081 13.4837 13.4837 14.5838 14.5838 15.0985 15.0985 17.5672 17.5672 k = 0.2527-0.4275-0.8193 ( 3012 PWs) bands (ev): -57.1530 -57.1530 -39.8216 -39.8216 -30.0895 -30.0895 -21.5905 -21.5905 -21.3578 -21.3578 -11.9297 -11.9297 -11.7667 -11.7667 -11.6958 -11.6958 -2.4295 -2.4295 -2.1324 -2.1324 6.0233 6.0233 6.4541 6.4541 7.6721 7.6721 7.9905 7.9905 8.5119 8.5119 9.6618 9.6618 13.4637 13.4637 14.6066 14.6066 15.0860 15.0860 17.6263 17.6263 k = 0.2576-0.4359-0.8353 ( 3014 PWs) bands (ev): -57.1525 -57.1525 -39.8214 -39.8214 -30.0912 -30.0912 -21.5940 -21.5940 -21.3619 -21.3619 -11.9304 -11.9304 -11.7682 -11.7682 -11.6958 -11.6958 -2.4253 -2.4253 -2.1110 -2.1110 6.0141 6.0141 6.4576 6.4576 7.6425 7.6425 8.0367 8.0367 8.5197 8.5197 9.6171 9.6171 13.4402 13.4402 14.6282 14.6282 15.0765 15.0765 17.6852 17.6852 k = 0.2626-0.4443-0.8514 ( 3008 PWs) bands (ev): -57.1520 -57.1520 -39.8212 -39.8212 -30.0928 -30.0928 -21.5971 -21.5971 -21.3659 -21.3659 -11.9310 -11.9310 -11.7697 -11.7697 -11.6957 -11.6957 -2.4202 -2.4202 -2.0922 -2.0922 6.0100 6.0100 6.4612 6.4612 7.6033 7.6033 8.0864 8.0864 8.5292 8.5292 9.5744 9.5744 13.4134 13.4134 14.6487 14.6487 15.0698 15.0698 17.7438 17.7438 k = 0.2675-0.4526-0.8674 ( 3000 PWs) bands (ev): -57.1516 -57.1516 -39.8211 -39.8211 -30.0943 -30.0943 -21.5997 -21.5997 -21.3698 -21.3698 -11.9315 -11.9315 -11.7710 -11.7710 -11.6957 -11.6957 -2.4141 -2.4141 -2.0763 -2.0763 6.0111 6.0111 6.4649 6.4649 7.5574 7.5574 8.1370 8.1370 8.5398 8.5398 9.5340 9.5340 13.3838 13.3838 14.6682 14.6682 15.0656 15.0656 17.8019 17.8019 k = 0.2725-0.4610-0.8835 ( 2996 PWs) bands (ev): -57.1512 -57.1512 -39.8209 -39.8209 -30.0956 -30.0956 -21.6020 -21.6020 -21.3736 -21.3736 -11.9319 -11.9319 -11.7723 -11.7723 -11.6956 -11.6956 -2.4069 -2.4069 -2.0632 -2.0632 6.0173 6.0173 6.4688 6.4688 7.5062 7.5062 8.1869 8.1869 8.5510 8.5510 9.4964 9.4964 13.3521 13.3521 14.6865 14.6865 15.0634 15.0634 17.8597 17.8597 k = 0.2774-0.4694-0.8996 ( 2996 PWs) bands (ev): -57.1508 -57.1508 -39.8207 -39.8207 -30.0968 -30.0968 -21.6038 -21.6038 -21.3773 -21.3773 -11.9323 -11.9323 -11.7736 -11.7736 -11.6957 -11.6957 -2.3987 -2.3987 -2.0530 -2.0530 6.0284 6.0284 6.4732 6.4732 7.4507 7.4507 8.2351 8.2351 8.5623 8.5623 9.4619 9.4619 13.3189 13.3189 14.7037 14.7037 15.0629 15.0629 17.9173 17.9173 k = 0.2824-0.4778-0.9156 ( 3000 PWs) bands (ev): -57.1505 -57.1505 -39.8206 -39.8206 -30.0980 -30.0980 -21.6053 -21.6053 -21.3809 -21.3809 -11.9326 -11.9326 -11.7748 -11.7748 -11.6957 -11.6957 -2.3894 -2.3894 -2.0456 -2.0456 6.0441 6.0441 6.4782 6.4782 7.3916 7.3916 8.2811 8.2811 8.5732 8.5732 9.4310 9.4310 13.2849 13.2849 14.7195 14.7195 15.0634 15.0634 17.9750 17.9750 k = 0.2874-0.4862-0.9317 ( 3002 PWs) bands (ev): -57.1502 -57.1502 -39.8205 -39.8205 -30.0990 -30.0990 -21.6064 -21.6064 -21.3844 -21.3844 -11.9328 -11.9328 -11.7759 -11.7759 -11.6957 -11.6957 -2.3792 -2.3792 -2.0411 -2.0411 6.0642 6.0642 6.4842 6.4842 7.3295 7.3295 8.3243 8.3243 8.5829 8.5829 9.4042 9.4042 13.2509 13.2509 14.7339 14.7339 15.0645 15.0645 18.0329 18.0329 k = 0.2923-0.4946-0.9478 ( 3004 PWs) bands (ev): -57.1499 -57.1499 -39.8204 -39.8204 -30.0999 -30.0999 -21.6072 -21.6072 -21.3876 -21.3876 -11.9329 -11.9329 -11.7769 -11.7769 -11.6957 -11.6957 -2.3680 -2.3680 -2.0393 -2.0393 6.0882 6.0882 6.4913 6.4913 7.2648 7.2648 8.3646 8.3646 8.5908 8.5908 9.3819 9.3819 13.2175 13.2175 14.7467 14.7467 15.0658 15.0658 18.0915 18.0915 k = 0.2973-0.5029-0.9638 ( 3002 PWs) bands (ev): -57.1497 -57.1497 -39.8203 -39.8203 -30.1006 -30.1006 -21.6078 -21.6078 -21.3906 -21.3906 -11.9330 -11.9330 -11.7778 -11.7778 -11.6957 -11.6957 -2.3562 -2.3562 -2.0400 -2.0400 6.1154 6.1154 6.5002 6.5002 7.1982 7.1982 8.4016 8.4016 8.5965 8.5965 9.3645 9.3645 13.1852 13.1852 14.7578 14.7578 15.0670 15.0670 18.1508 18.1508 k = 0.3022-0.5113-0.9799 ( 3006 PWs) bands (ev): -57.1495 -57.1495 -39.8202 -39.8202 -30.1013 -30.1013 -21.6081 -21.6081 -21.3934 -21.3934 -11.9330 -11.9330 -11.7786 -11.7786 -11.6957 -11.6957 -2.3438 -2.3438 -2.0429 -2.0429 6.1449 6.1449 6.5113 6.5113 7.1303 7.1303 8.4351 8.4351 8.5993 8.5993 9.3524 9.3524 13.1547 13.1547 14.7669 14.7669 15.0677 15.0677 18.2112 18.2112 k = 0.3072-0.5197-0.9960 ( 3010 PWs) bands (ev): -57.1494 -57.1494 -39.8202 -39.8202 -30.1019 -30.1019 -21.6082 -21.6082 -21.3959 -21.3959 -11.9331 -11.9331 -11.7793 -11.7793 -11.6958 -11.6958 -2.3311 -2.3311 -2.0478 -2.0478 6.1754 6.1754 6.5255 6.5255 7.0618 7.0618 8.4649 8.4649 8.5990 8.5990 9.3457 9.3457 13.1263 13.1263 14.7740 14.7740 15.0680 15.0680 18.2728 18.2728 k = 0.3121-0.5281-1.0120 ( 3012 PWs) bands (ev): -57.1492 -57.1492 -39.8201 -39.8201 -30.1023 -30.1023 -21.6082 -21.6082 -21.3980 -21.3980 -11.9330 -11.9330 -11.7799 -11.7799 -11.6958 -11.6958 -2.3186 -2.3186 -2.0541 -2.0541 6.2052 6.2052 6.5436 6.5436 6.9937 6.9937 8.4909 8.4909 8.5956 8.5956 9.3444 9.3444 13.1003 13.1003 14.7789 14.7789 15.0675 15.0675 18.3356 18.3356 k = 0.3171-0.5365-1.0281 ( 3008 PWs) bands (ev): -57.1491 -57.1491 -39.8201 -39.8201 -30.1027 -30.1027 -21.6080 -21.6080 -21.3998 -21.3998 -11.9330 -11.9330 -11.7803 -11.7803 -11.6957 -11.6957 -2.3067 -2.3067 -2.0611 -2.0611 6.2322 6.2322 6.5663 6.5663 6.9275 6.9275 8.5128 8.5128 8.5892 8.5892 9.3483 9.3483 13.0770 13.0770 14.7816 14.7816 15.0663 15.0663 18.3997 18.3997 k = 0.3220-0.5448-1.0441 ( 3010 PWs) bands (ev): -57.1490 -57.1490 -39.8200 -39.8200 -30.1029 -30.1029 -21.6079 -21.6079 -21.4011 -21.4011 -11.9329 -11.9329 -11.7807 -11.7807 -11.6958 -11.6958 -2.2964 -2.2964 -2.0681 -2.0681 6.2538 6.2538 6.5936 6.5936 6.8661 6.8661 8.5301 8.5301 8.5805 8.5805 9.3569 9.3569 13.0563 13.0563 14.7820 14.7820 15.0644 15.0644 18.4649 18.4649 k = 0.3270-0.5532-1.0602 ( 3016 PWs) bands (ev): -57.1490 -57.1490 -39.8200 -39.8200 -30.1031 -30.1031 -21.6078 -21.6078 -21.4020 -21.4020 -11.9329 -11.9329 -11.7809 -11.7809 -11.6957 -11.6957 -2.2887 -2.2887 -2.0738 -2.0738 6.2675 6.2675 6.6222 6.6222 6.8153 6.8153 8.5406 8.5406 8.5721 8.5721 9.3697 9.3697 13.0384 13.0384 14.7804 14.7804 15.0618 15.0618 18.5307 18.5307 k = 0.3319-0.5616-1.0763 ( 3010 PWs) bands (ev): -57.1490 -57.1490 -39.8200 -39.8200 -30.1031 -30.1031 -21.6077 -21.6077 -21.4024 -21.4024 -11.9328 -11.9328 -11.7810 -11.7810 -11.6957 -11.6957 -2.2849 -2.2849 -2.0768 -2.0768 6.2707 6.2707 6.6404 6.6404 6.7895 6.7895 8.5386 8.5386 8.5704 8.5704 9.3862 9.3862 13.0230 13.0230 14.7767 14.7767 15.0586 15.0586 18.5959 18.5959 k = 0.3369-0.5700-1.0923 ( 3006 PWs) bands (ev): -57.1490 -57.1490 -39.8200 -39.8200 -30.1031 -30.1031 -21.6077 -21.6077 -21.4023 -21.4023 -11.9328 -11.9328 -11.7809 -11.7809 -11.6957 -11.6957 -2.2862 -2.2862 -2.0759 -2.0759 6.2607 6.2607 6.6338 6.6338 6.8058 6.8058 8.5255 8.5255 8.5745 8.5745 9.4055 9.4055 13.0099 13.0099 14.7712 14.7712 15.0548 15.0548 18.6561 18.6561 k = 0.3419-0.5784-1.1084 ( 3006 PWs) bands (ev): -57.1490 -57.1490 -39.8200 -39.8200 -30.1030 -30.1030 -21.6079 -21.6079 -21.4016 -21.4016 -11.9328 -11.9328 -11.7808 -11.7808 -11.6956 -11.6956 -2.2932 -2.2932 -2.0702 -2.0702 6.2360 6.2360 6.6147 6.6147 6.8535 6.8535 8.5081 8.5081 8.5782 8.5782 9.4271 9.4271 12.9988 12.9988 14.7642 14.7642 15.0506 15.0506 18.6899 18.6899 k = 0.6581-0.4417-1.0255 ( 3006 PWs) bands (ev): -57.1490 -57.1490 -39.8200 -39.8200 -30.1030 -30.1030 -21.6079 -21.6079 -21.4016 -21.4016 -11.9328 -11.9328 -11.7808 -11.7808 -11.6956 -11.6956 -2.2932 -2.2932 -2.0702 -2.0702 6.2360 6.2360 6.6147 6.6147 6.8535 6.8535 8.5081 8.5081 8.5782 8.5782 9.4271 9.4271 12.9988 12.9988 14.7642 14.7642 15.0506 15.0506 18.6899 18.6899 k = 0.6532-0.4236-1.0255 ( 3000 PWs) bands (ev): -57.1491 -57.1491 -39.8200 -39.8200 -30.1028 -30.1028 -21.6083 -21.6083 -21.4004 -21.4004 -11.9328 -11.9328 -11.7804 -11.7804 -11.6956 -11.6956 -2.3056 -2.3056 -2.0600 -2.0600 6.1969 6.1969 6.5992 6.5992 6.9160 6.9160 8.4887 8.4887 8.5800 8.5800 9.4503 9.4503 12.9894 12.9894 14.7560 14.7560 15.0461 15.0461 18.6634 18.6634 k = 0.6483-0.4055-1.0255 ( 2994 PWs) bands (ev): -57.1491 -57.1491 -39.8200 -39.8200 -30.1026 -30.1026 -21.6088 -21.6088 -21.3987 -21.3987 -11.9328 -11.9328 -11.7800 -11.7800 -11.6955 -11.6955 -2.3228 -2.3228 -2.0459 -2.0459 6.1458 6.1458 6.5916 6.5916 6.9868 6.9868 8.4681 8.4681 8.5798 8.5798 9.4746 9.4746 12.9812 12.9812 14.7470 14.7470 15.0414 15.0414 18.6113 18.6113 k = 0.6433-0.3874-1.0255 ( 2994 PWs) bands (ev): -57.1492 -57.1492 -39.8201 -39.8201 -30.1023 -30.1023 -21.6096 -21.6096 -21.3963 -21.3963 -11.9329 -11.9329 -11.7795 -11.7795 -11.6954 -11.6954 -2.3438 -2.3438 -2.0287 -2.0287 6.0860 6.0860 6.5909 6.5909 7.0631 7.0631 8.4467 8.4467 8.5777 8.5777 9.4994 9.4994 12.9736 12.9736 14.7375 14.7375 15.0366 15.0366 18.5560 18.5560 k = 0.6384-0.3694-1.0255 ( 3000 PWs) bands (ev): -57.1493 -57.1493 -39.8201 -39.8201 -30.1019 -30.1019 -21.6107 -21.6107 -21.3935 -21.3935 -11.9331 -11.9331 -11.7789 -11.7789 -11.6953 -11.6953 -2.3677 -2.3677 -2.0091 -2.0091 6.0206 6.0206 6.5957 6.5957 7.1432 7.1432 8.4248 8.4248 8.5743 8.5743 9.5244 9.5244 12.9660 12.9660 14.7279 14.7279 15.0320 15.0320 18.5021 18.5021 k = 0.6334-0.3513-1.0255 ( 3000 PWs) bands (ev): -57.1495 -57.1495 -39.8202 -39.8202 -30.1015 -30.1015 -21.6119 -21.6119 -21.3901 -21.3901 -11.9332 -11.9332 -11.7782 -11.7782 -11.6952 -11.6952 -2.3939 -2.3939 -1.9879 -1.9879 5.9518 5.9518 6.6046 6.6046 7.2259 7.2259 8.4025 8.4025 8.5702 8.5702 9.5489 9.5489 12.9581 12.9581 14.7187 14.7187 15.0276 15.0276 18.4507 18.4507 k = 0.6285-0.3332-1.0255 ( 2998 PWs) bands (ev): -57.1496 -57.1496 -39.8202 -39.8202 -30.1011 -30.1011 -21.6134 -21.6134 -21.3863 -21.3863 -11.9335 -11.9335 -11.7774 -11.7774 -11.6950 -11.6950 -2.4217 -2.4217 -1.9655 -1.9655 5.8812 5.8812 6.6166 6.6166 7.3103 7.3103 8.3800 8.3800 8.5660 8.5660 9.5729 9.5729 12.9491 12.9491 14.7102 14.7102 15.0238 15.0238 18.4021 18.4021 k = 0.6236-0.3151-1.0255 ( 2996 PWs) bands (ev): -57.1498 -57.1498 -39.8203 -39.8203 -30.1006 -30.1006 -21.6151 -21.6151 -21.3820 -21.3820 -11.9337 -11.9337 -11.7765 -11.7765 -11.6948 -11.6948 -2.4507 -2.4507 -1.9422 -1.9422 5.8099 5.8099 6.6312 6.6312 7.3952 7.3952 8.3573 8.3573 8.5625 8.5625 9.5958 9.5958 12.9386 12.9386 14.7027 14.7027 15.0208 15.0208 18.3563 18.3563 k = 0.6186-0.2971-1.0255 ( 2998 PWs) bands (ev): -57.1499 -57.1499 -39.8204 -39.8204 -30.1000 -30.1000 -21.6170 -21.6170 -21.3773 -21.3773 -11.9341 -11.9341 -11.7756 -11.7756 -11.6946 -11.6946 -2.4805 -2.4805 -1.9184 -1.9184 5.7387 5.7387 6.6479 6.6479 7.4794 7.4794 8.3345 8.3345 8.5607 8.5607 9.6174 9.6174 12.9260 12.9260 14.6966 14.6966 15.0188 15.0188 18.3132 18.3132 k = 0.6137-0.2790-1.0255 ( 3000 PWs) bands (ev): -57.1501 -57.1501 -39.8204 -39.8204 -30.0995 -30.0995 -21.6190 -21.6190 -21.3723 -21.3723 -11.9344 -11.9344 -11.7746 -11.7746 -11.6944 -11.6944 -2.5110 -2.5110 -1.8942 -1.8942 5.6682 5.6682 6.6666 6.6666 7.5616 7.5616 8.3117 8.3117 8.5618 8.5618 9.6376 9.6376 12.9110 12.9110 14.6921 14.6921 15.0180 15.0180 18.2725 18.2725 k = 0.6087-0.2609-1.0255 ( 2990 PWs) bands (ev): -57.1503 -57.1503 -39.8205 -39.8205 -30.0989 -30.0989 -21.6212 -21.6212 -21.3669 -21.3669 -11.9347 -11.9347 -11.7735 -11.7735 -11.6941 -11.6941 -2.5417 -2.5417 -1.8698 -1.8698 5.5988 5.5988 6.6870 6.6870 7.6402 7.6402 8.2888 8.2888 8.5674 8.5674 9.6560 9.6560 12.8932 12.8932 14.6893 14.6893 15.0186 15.0186 18.2340 18.2340 k = 0.6038-0.2428-1.0255 ( 2996 PWs) bands (ev): -57.1505 -57.1505 -39.8206 -39.8206 -30.0983 -30.0983 -21.6235 -21.6235 -21.3614 -21.3614 -11.9352 -11.9352 -11.7725 -11.7725 -11.6938 -11.6938 -2.5724 -2.5724 -1.8455 -1.8455 5.5308 5.5308 6.7090 6.7090 7.7132 7.7132 8.2658 8.2658 8.5791 8.5791 9.6727 9.6727 12.8723 12.8723 14.6883 14.6883 15.0209 15.0209 18.1972 18.1972 k = 0.5988-0.2248-1.0255 ( 2998 PWs) bands (ev): -57.1507 -57.1507 -39.8207 -39.8207 -30.0977 -30.0977 -21.6258 -21.6258 -21.3557 -21.3557 -11.9357 -11.9357 -11.7714 -11.7714 -11.6935 -11.6935 -2.6030 -2.6030 -1.8214 -1.8214 5.4646 5.4646 6.7327 6.7327 7.7786 7.7786 8.2427 8.2427 8.5988 8.5988 9.6874 9.6874 12.8481 12.8481 14.6893 14.6893 15.0249 15.0249 18.1617 18.1617 k = 0.5939-0.2067-1.0255 ( 2994 PWs) bands (ev): -57.1508 -57.1508 -39.8207 -39.8207 -30.0971 -30.0971 -21.6283 -21.6283 -21.3498 -21.3498 -11.9361 -11.9361 -11.7703 -11.7703 -11.6931 -11.6931 -2.6333 -2.6333 -1.7976 -1.7976 5.4005 5.4005 6.7579 6.7579 7.8344 7.8344 8.2196 8.2196 8.6282 8.6282 9.7002 9.7002 12.8206 12.8206 14.6921 14.6921 15.0308 15.0308 18.1273 18.1273 k = 0.5890-0.1886-1.0255 ( 2998 PWs) bands (ev): -57.1510 -57.1510 -39.8208 -39.8208 -30.0965 -30.0965 -21.6307 -21.6307 -21.3439 -21.3439 -11.9366 -11.9366 -11.7693 -11.7693 -11.6927 -11.6927 -2.6630 -2.6630 -1.7742 -1.7742 5.3386 5.3386 6.7845 6.7845 7.8792 7.8792 8.1966 8.1966 8.6685 8.6685 9.7110 9.7110 12.7898 12.7898 14.6969 14.6969 15.0385 15.0385 18.0935 18.0935 k = 0.5840-0.1705-1.0255 ( 3004 PWs) bands (ev): -57.1512 -57.1512 -39.8209 -39.8209 -30.0959 -30.0959 -21.6332 -21.6332 -21.3380 -21.3380 -11.9371 -11.9371 -11.7682 -11.7682 -11.6924 -11.6924 -2.6921 -2.6921 -1.7514 -1.7514 5.2792 5.2792 6.8125 6.8125 7.9124 7.9124 8.1737 8.1737 8.7199 8.7199 9.7199 9.7199 12.7557 12.7557 14.7034 14.7034 15.0480 15.0480 18.0601 18.0601 k = 0.5791-0.1525-1.0255 ( 3006 PWs) bands (ev): -57.1514 -57.1514 -39.8210 -39.8210 -30.0953 -30.0953 -21.6356 -21.6356 -21.3321 -21.3321 -11.9376 -11.9376 -11.7672 -11.7672 -11.6920 -11.6920 -2.7203 -2.7203 -1.7293 -1.7293 5.2223 5.2223 6.8419 6.8419 7.9345 7.9345 8.1511 8.1511 8.7813 8.7813 9.7270 9.7270 12.7185 12.7185 14.7116 14.7116 15.0593 15.0593 18.0266 18.0266 k = 0.5741-0.1344-1.0255 ( 3008 PWs) bands (ev): -57.1516 -57.1516 -39.8211 -39.8211 -30.0947 -30.0947 -21.6380 -21.6380 -21.3263 -21.3263 -11.9381 -11.9381 -11.7662 -11.7662 -11.6916 -11.6916 -2.7475 -2.7475 -1.7079 -1.7079 5.1683 5.1683 6.8725 6.8725 7.9464 7.9464 8.1292 8.1292 8.8510 8.8510 9.7325 9.7325 12.6786 12.6786 14.7213 14.7213 15.0720 15.0720 17.9931 17.9931 k = 0.5692-0.1163-1.0255 ( 3006 PWs) bands (ev): -57.1518 -57.1518 -39.8212 -39.8212 -30.0941 -30.0941 -21.6403 -21.6403 -21.3207 -21.3207 -11.9386 -11.9386 -11.7653 -11.7653 -11.6911 -11.6911 -2.7736 -2.7736 -1.6875 -1.6875 5.1172 5.1172 6.9043 6.9043 7.9496 7.9496 8.1085 8.1085 8.9268 8.9268 9.7365 9.7365 12.6361 12.6361 14.7324 14.7324 15.0861 15.0861 17.9594 17.9594 k = 0.5642-0.0982-1.0255 ( 3010 PWs) bands (ev): -57.1520 -57.1520 -39.8212 -39.8212 -30.0935 -30.0935 -21.6426 -21.6426 -21.3152 -21.3152 -11.9391 -11.9391 -11.7644 -11.7644 -11.6907 -11.6907 -2.7984 -2.7984 -1.6680 -1.6680 5.0691 5.0691 6.9372 6.9372 7.9452 7.9452 8.0892 8.0892 9.0067 9.0067 9.7393 9.7393 12.5916 12.5916 14.7447 14.7447 15.1012 15.1012 17.9255 17.9255 k = 0.5593-0.0802-1.0255 ( 3010 PWs) bands (ev): -57.1522 -57.1522 -39.8213 -39.8213 -30.0930 -30.0930 -21.6447 -21.6447 -21.3099 -21.3099 -11.9396 -11.9396 -11.7635 -11.7635 -11.6902 -11.6902 -2.8219 -2.8219 -1.6495 -1.6495 5.0241 5.0241 6.9710 6.9710 7.9343 7.9343 8.0719 8.0719 9.0884 9.0884 9.7413 9.7413 12.5455 12.5455 14.7579 14.7579 15.1170 15.1170 17.8916 17.8916 k = 0.5544-0.0621-1.0255 ( 3010 PWs) bands (ev): -57.1523 -57.1523 -39.8214 -39.8214 -30.0925 -30.0925 -21.6468 -21.6468 -21.3049 -21.3049 -11.9400 -11.9400 -11.7628 -11.7628 -11.6897 -11.6897 -2.8439 -2.8439 -1.6323 -1.6323 4.9824 4.9824 7.0056 7.0056 7.9179 7.9179 8.0567 8.0567 9.1701 9.1701 9.7427 9.7427 12.4983 12.4983 14.7717 14.7717 15.1332 15.1332 17.8579 17.8579 k = 0.5494-0.0440-1.0255 ( 3006 PWs) bands (ev): -57.1525 -57.1525 -39.8214 -39.8214 -30.0920 -30.0920 -21.6486 -21.6486 -21.3003 -21.3003 -11.9404 -11.9404 -11.7620 -11.7620 -11.6892 -11.6892 -2.8643 -2.8643 -1.6162 -1.6162 4.9441 4.9441 7.0408 7.0408 7.8973 7.8973 8.0435 8.0435 9.2501 9.2501 9.7442 9.7442 12.4506 12.4506 14.7859 14.7859 15.1496 15.1496 17.8247 17.8247 k = 0.5445-0.0260-1.0255 ( 3008 PWs) bands (ev): -57.1526 -57.1526 -39.8215 -39.8215 -30.0916 -30.0916 -21.6504 -21.6504 -21.2959 -21.2959 -11.9408 -11.9408 -11.7614 -11.7614 -11.6888 -11.6888 -2.8831 -2.8831 -1.6015 -1.6015 4.9092 4.9092 7.0764 7.0764 7.8733 7.8733 8.0320 8.0320 9.3265 9.3265 9.7464 9.7464 12.4032 12.4032 14.8002 14.8002 15.1657 15.1657 17.7924 17.7924 k = 0.5395-0.0079-1.0255 ( 3010 PWs) bands (ev): -57.1527 -57.1527 -39.8215 -39.8215 -30.0912 -30.0912 -21.6520 -21.6520 -21.2920 -21.2920 -11.9412 -11.9412 -11.7608 -11.7608 -11.6884 -11.6884 -2.9001 -2.9001 -1.5881 -1.5881 4.8777 4.8777 7.1121 7.1121 7.8471 7.8471 8.0220 8.0220 9.3973 9.3973 9.7502 9.7502 12.3568 12.3568 14.8141 14.8141 15.1813 15.1813 17.7616 17.7616 k = 0.5346 0.0102-1.0255 ( 3016 PWs) bands (ev): -57.1529 -57.1529 -39.8216 -39.8216 -30.0909 -30.0909 -21.6534 -21.6534 -21.2884 -21.2884 -11.9416 -11.9416 -11.7603 -11.7603 -11.6881 -11.6881 -2.9153 -2.9153 -1.5762 -1.5762 4.8498 4.8498 7.1475 7.1475 7.8194 7.8194 8.0133 8.0133 9.4603 9.4603 9.7566 9.7566 12.3123 12.3123 14.8275 14.8275 15.1960 15.1960 17.7326 17.7326 k = 0.5297 0.0283-1.0255 ( 3020 PWs) bands (ev): -57.1530 -57.1530 -39.8216 -39.8216 -30.0906 -30.0906 -21.6547 -21.6547 -21.2852 -21.2852 -11.9419 -11.9419 -11.7599 -11.7599 -11.6878 -11.6878 -2.9286 -2.9286 -1.5657 -1.5657 4.8256 4.8256 7.1821 7.1821 7.7911 7.7911 8.0058 8.0058 9.5132 9.5132 9.7670 9.7670 12.2706 12.2706 14.8399 14.8399 15.2096 15.2096 17.7060 17.7060 k = 0.5247 0.0463-1.0255 ( 3022 PWs) bands (ev): -57.1530 -57.1530 -39.8217 -39.8217 -30.0903 -30.0903 -21.6558 -21.6558 -21.2826 -21.2826 -11.9421 -11.9421 -11.7595 -11.7595 -11.6875 -11.6875 -2.9400 -2.9400 -1.5568 -1.5568 4.8050 4.8050 7.2153 7.2153 7.7631 7.7631 7.9994 7.9994 9.5543 9.5543 9.7821 9.7821 12.2329 12.2329 14.8510 14.8510 15.2216 15.2216 17.6824 17.6824 k = 0.5198 0.0644-1.0255 ( 3014 PWs) bands (ev): -57.1531 -57.1531 -39.8217 -39.8217 -30.0900 -30.0900 -21.6567 -21.6567 -21.2803 -21.2803 -11.9423 -11.9423 -11.7591 -11.7591 -11.6872 -11.6872 -2.9493 -2.9493 -1.5494 -1.5494 4.7881 4.7881 7.2461 7.2461 7.7364 7.7364 7.9942 7.9942 9.5831 9.5831 9.8011 9.8011 12.2000 12.2000 14.8605 14.8605 15.2319 15.2319 17.6623 17.6623 k = 0.5148 0.0825-1.0255 ( 3014 PWs) bands (ev): -57.1532 -57.1532 -39.8217 -39.8217 -30.0899 -30.0899 -21.6574 -21.6574 -21.2785 -21.2785 -11.9425 -11.9425 -11.7589 -11.7589 -11.6870 -11.6870 -2.9567 -2.9567 -1.5436 -1.5436 4.7749 4.7749 7.2732 7.2732 7.7125 7.7125 7.9901 7.9901 9.6016 9.6016 9.8212 9.8212 12.1732 12.1732 14.8682 14.8682 15.2402 15.2402 17.6462 17.6462 k = 0.5099 0.1006-1.0255 ( 3012 PWs) bands (ev): -57.1532 -57.1532 -39.8217 -39.8217 -30.0897 -30.0897 -21.6579 -21.6579 -21.2773 -21.2773 -11.9426 -11.9426 -11.7587 -11.7587 -11.6868 -11.6868 -2.9619 -2.9619 -1.5395 -1.5395 4.7654 4.7654 7.2949 7.2949 7.6930 7.6930 7.9871 7.9871 9.6124 9.6124 9.8387 9.8387 12.1532 12.1532 14.8739 14.8739 15.2463 15.2463 17.6343 17.6343 k = 0.5049 0.1186-1.0255 ( 3014 PWs) bands (ev): -57.1532 -57.1532 -39.8218 -39.8218 -30.0897 -30.0897 -21.6582 -21.6582 -21.2765 -21.2765 -11.9426 -11.9426 -11.7586 -11.7586 -11.6868 -11.6868 -2.9651 -2.9651 -1.5370 -1.5370 4.7598 4.7598 7.3091 7.3091 7.6801 7.6801 7.9854 7.9854 9.6180 9.6180 9.8504 9.8504 12.1409 12.1409 14.8773 14.8773 15.2501 15.2501 17.6271 17.6271 k = 0.5000 0.1367-1.0255 ( 3012 PWs) bands (ev): -57.1532 -57.1532 -39.8218 -39.8218 -30.0896 -30.0896 -21.6583 -21.6583 -21.2763 -21.2763 -11.9427 -11.9427 -11.7586 -11.7586 -11.6867 -11.6867 -2.9661 -2.9661 -1.5362 -1.5362 4.7579 4.7579 7.3141 7.3141 7.6755 7.6755 7.9848 7.9848 9.6197 9.6197 9.8545 9.8545 12.1367 12.1367 14.8785 14.8785 15.2513 15.2513 17.6246 17.6246 k = 0.5000 0.1367-1.0255 ( 3012 PWs) bands (ev): -57.1532 -57.1532 -39.8218 -39.8218 -30.0896 -30.0896 -21.6583 -21.6583 -21.2763 -21.2763 -11.9427 -11.9427 -11.7586 -11.7586 -11.6867 -11.6867 -2.9661 -2.9661 -1.5362 -1.5362 4.7579 4.7579 7.3141 7.3141 7.6755 7.6755 7.9848 7.9848 9.6197 9.6197 9.8545 9.8545 12.1367 12.1367 14.8785 14.8785 15.2513 15.2513 17.6246 17.6246 k = 0.5158 0.1410-1.0172 ( 3016 PWs) bands (ev): -57.1532 -57.1532 -39.8218 -39.8218 -30.0896 -30.0896 -21.6582 -21.6582 -21.2763 -21.2763 -11.9427 -11.9427 -11.7586 -11.7586 -11.6867 -11.6867 -2.9661 -2.9661 -1.5363 -1.5363 4.7585 4.7585 7.3141 7.3141 7.6732 7.6732 7.9864 7.9864 9.6193 9.6193 9.8543 9.8543 12.1377 12.1377 14.8782 14.8782 15.2510 15.2510 17.6258 17.6258 k = 0.5316 0.1454-1.0090 ( 3014 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0896 -30.0896 -21.6581 -21.6581 -21.2763 -21.2763 -11.9427 -11.9427 -11.7586 -11.7586 -11.6867 -11.6867 -2.9659 -2.9659 -1.5368 -1.5368 4.7604 4.7604 7.3141 7.3141 7.6664 7.6664 7.9909 7.9909 9.6183 9.6183 9.8537 9.8537 12.1405 12.1405 14.8774 14.8774 15.2499 15.2499 17.6292 17.6292 k = 0.5474 0.1497-1.0007 ( 3018 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0896 -30.0896 -21.6580 -21.6580 -21.2763 -21.2763 -11.9427 -11.9427 -11.7586 -11.7586 -11.6868 -11.6868 -2.9657 -2.9657 -1.5377 -1.5377 4.7635 4.7635 7.3141 7.3141 7.6555 7.6555 7.9980 7.9980 9.6165 9.6165 9.8527 9.8527 12.1452 12.1452 14.8760 14.8760 15.2483 15.2483 17.6347 17.6347 k = 0.5633 0.1540-0.9924 ( 3016 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0895 -30.0895 -21.6578 -21.6578 -21.2762 -21.2762 -11.9427 -11.9427 -11.7586 -11.7586 -11.6868 -11.6868 -2.9653 -2.9653 -1.5389 -1.5389 4.7679 4.7679 7.3140 7.3140 7.6412 7.6412 8.0070 8.0070 9.6141 9.6141 9.8514 9.8514 12.1517 12.1517 14.8742 14.8742 15.2460 15.2460 17.6423 17.6423 k = 0.5791 0.1583-0.9841 ( 3012 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0894 -30.0894 -21.6575 -21.6575 -21.2762 -21.2762 -11.9426 -11.9426 -11.7585 -11.7585 -11.6868 -11.6868 -2.9649 -2.9649 -1.5404 -1.5404 4.7735 4.7735 7.3139 7.3139 7.6243 7.6243 8.0173 8.0173 9.6110 9.6110 9.8497 9.8497 12.1600 12.1600 14.8719 14.8719 15.2433 15.2433 17.6516 17.6516 k = 0.5949 0.1627-0.9758 ( 3008 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0893 -30.0893 -21.6572 -21.6572 -21.2762 -21.2762 -11.9426 -11.9426 -11.7585 -11.7585 -11.6868 -11.6868 -2.9643 -2.9643 -1.5423 -1.5423 4.7803 4.7803 7.3138 7.3138 7.6053 7.6053 8.0282 8.0282 9.6072 9.6072 9.8477 9.8477 12.1700 12.1700 14.8692 14.8692 15.2401 15.2401 17.6625 17.6625 k = 0.6107 0.1670-0.9675 ( 3004 PWs) bands (ev): -57.1534 -57.1534 -39.8218 -39.8218 -30.0892 -30.0892 -21.6568 -21.6568 -21.2762 -21.2762 -11.9425 -11.9425 -11.7585 -11.7585 -11.6869 -11.6869 -2.9637 -2.9637 -1.5445 -1.5445 4.7883 4.7883 7.3136 7.3136 7.5847 7.5847 8.0393 8.0393 9.6028 9.6028 9.8454 9.8454 12.1816 12.1816 14.8662 14.8662 15.2367 15.2367 17.6746 17.6746 k = 0.6265 0.1713-0.9592 ( 3000 PWs) bands (ev): -57.1534 -57.1534 -39.8218 -39.8218 -30.0891 -30.0891 -21.6563 -21.6563 -21.2761 -21.2761 -11.9425 -11.9425 -11.7584 -11.7584 -11.6869 -11.6869 -2.9630 -2.9630 -1.5470 -1.5470 4.7973 4.7973 7.3135 7.3135 7.5631 7.5631 8.0502 8.0502 9.5977 9.5977 9.8429 9.8429 12.1948 12.1948 14.8630 14.8630 15.2330 15.2330 17.6876 17.6876 k = 0.6423 0.1756-0.9509 ( 3002 PWs) bands (ev): -57.1534 -57.1534 -39.8218 -39.8218 -30.0890 -30.0890 -21.6558 -21.6558 -21.2761 -21.2761 -11.9424 -11.9424 -11.7584 -11.7584 -11.6870 -11.6870 -2.9621 -2.9621 -1.5499 -1.5499 4.8075 4.8075 7.3132 7.3132 7.5407 7.5407 8.0606 8.0606 9.5921 9.5921 9.8402 9.8402 12.2093 12.2093 14.8596 14.8596 15.2293 15.2293 17.7012 17.7012 k = 0.6581 0.1800-0.9427 ( 3000 PWs) bands (ev): -57.1535 -57.1535 -39.8218 -39.8218 -30.0888 -30.0888 -21.6552 -21.6552 -21.2761 -21.2761 -11.9423 -11.9423 -11.7584 -11.7584 -11.6871 -11.6871 -2.9612 -2.9612 -1.5532 -1.5532 4.8186 4.8186 7.3129 7.3129 7.5180 7.5180 8.0702 8.0702 9.5859 9.5859 9.8374 9.8374 12.2252 12.2252 14.8562 14.8562 15.2257 15.2257 17.7152 17.7152 k = 0.6581 0.1800-0.9427 ( 3000 PWs) bands (ev): -57.1535 -57.1535 -39.8218 -39.8218 -30.0888 -30.0888 -21.6552 -21.6552 -21.2761 -21.2761 -11.9423 -11.9423 -11.7584 -11.7584 -11.6871 -11.6871 -2.9612 -2.9612 -1.5532 -1.5532 4.8186 4.8186 7.3129 7.3129 7.5180 7.5180 8.0702 8.0702 9.5859 9.5859 9.8374 9.8374 12.2252 12.2252 14.8562 14.8562 15.2257 15.2257 17.7152 17.7152 k = 0.6553 0.1792-0.9240 ( 3003 PWs) bands (ev): -57.1536 -57.1536 -39.8219 -39.8219 -30.0882 -30.0882 -21.6529 -21.6529 -21.2760 -21.2760 -11.9418 -11.9418 -11.7581 -11.7581 -11.6872 -11.6872 -2.9590 -2.9590 -1.5655 -1.5655 4.8359 4.8359 7.3137 7.3137 7.4687 7.4687 8.1062 8.1062 9.5925 9.5925 9.8342 9.8342 12.2211 12.2211 14.8490 14.8490 15.2163 15.2163 17.6941 17.6941 k = 0.6524 0.1784-0.9054 ( 3002 PWs) bands (ev): -57.1539 -57.1539 -39.8220 -39.8220 -30.0874 -30.0874 -21.6498 -21.6498 -21.2759 -21.2759 -11.9410 -11.9410 -11.7578 -11.7578 -11.6873 -11.6873 -2.9559 -2.9559 -1.5817 -1.5817 4.8587 4.8587 7.3141 7.3141 7.4195 7.4195 8.1379 8.1379 9.5990 9.5990 9.8302 9.8302 12.2191 12.2191 14.8410 14.8410 15.2057 15.2057 17.6695 17.6695 k = 0.6495 0.1776-0.8867 ( 3008 PWs) bands (ev): -57.1541 -57.1541 -39.8221 -39.8221 -30.0865 -30.0865 -21.6462 -21.6462 -21.2758 -21.2758 -11.9402 -11.9402 -11.7574 -11.7574 -11.6874 -11.6874 -2.9521 -2.9521 -1.6016 -1.6016 4.8866 4.8866 7.3118 7.3118 7.3734 7.3734 8.1642 8.1642 9.6053 9.6053 9.8262 9.8262 12.2191 12.2191 14.8325 14.8325 15.1942 15.1942 17.6410 17.6410 k = 0.6466 0.1768-0.8681 ( 3014 PWs) bands (ev): -57.1544 -57.1544 -39.8222 -39.8222 -30.0853 -30.0853 -21.6418 -21.6418 -21.2756 -21.2756 -11.9391 -11.9391 -11.7569 -11.7569 -11.6876 -11.6876 -2.9476 -2.9476 -1.6250 -1.6250 4.9196 4.9196 7.2958 7.2958 7.3420 7.3420 8.1843 8.1843 9.6111 9.6111 9.8230 9.8230 12.2208 12.2208 14.8235 14.8235 15.1817 15.1817 17.6081 17.6081 k = 0.6438 0.1760-0.8494 ( 3010 PWs) bands (ev): -57.1548 -57.1548 -39.8224 -39.8224 -30.0840 -30.0840 -21.6369 -21.6369 -21.2754 -21.2754 -11.9379 -11.9379 -11.7563 -11.7563 -11.6878 -11.6878 -2.9425 -2.9425 -1.6516 -1.6516 4.9572 4.9572 7.2574 7.2574 7.3344 7.3344 8.1975 8.1975 9.6158 9.6158 9.8222 9.8222 12.2241 12.2241 14.8142 14.8142 15.1685 15.1685 17.5703 17.5703 k = 0.6409 0.1752-0.8308 ( 3009 PWs) bands (ev): -57.1552 -57.1552 -39.8226 -39.8226 -30.0825 -30.0825 -21.6313 -21.6313 -21.2751 -21.2751 -11.9365 -11.9365 -11.7557 -11.7557 -11.6880 -11.6880 -2.9369 -2.9369 -1.6812 -1.6812 4.9991 4.9991 7.2131 7.2131 7.3345 7.3345 8.2033 8.2033 9.6184 9.6184 9.8252 9.8252 12.2288 12.2288 14.8046 14.8046 15.1546 15.1546 17.5276 17.5276 k = 0.6380 0.1745-0.8121 ( 3011 PWs) bands (ev): -57.1557 -57.1557 -39.8227 -39.8227 -30.0809 -30.0809 -21.6251 -21.6251 -21.2748 -21.2748 -11.9350 -11.9350 -11.7550 -11.7550 -11.6882 -11.6882 -2.9311 -2.9311 -1.7133 -1.7133 5.0449 5.0449 7.1693 7.1693 7.3364 7.3364 8.2014 8.2014 9.6180 9.6180 9.8334 9.8334 12.2345 12.2345 14.7949 14.7949 15.1403 15.1403 17.4798 17.4798 k = 0.6351 0.1737-0.7935 ( 3010 PWs) bands (ev): -57.1562 -57.1562 -39.8229 -39.8229 -30.0791 -30.0791 -21.6183 -21.6183 -21.2745 -21.2745 -11.9334 -11.9334 -11.7542 -11.7542 -11.6885 -11.6885 -2.9251 -2.9251 -1.7478 -1.7478 5.0941 5.0941 7.1275 7.1275 7.3386 7.3386 8.1920 8.1920 9.6140 9.6140 9.8476 9.8476 12.2412 12.2412 14.7849 14.7849 15.1255 15.1255 17.4271 17.4271 k = 0.6323 0.1729-0.7748 ( 3009 PWs) bands (ev): -57.1567 -57.1567 -39.8232 -39.8232 -30.0772 -30.0772 -21.6110 -21.6110 -21.2741 -21.2741 -11.9317 -11.9317 -11.7533 -11.7533 -11.6887 -11.6887 -2.9192 -2.9192 -1.7840 -1.7840 5.1463 5.1463 7.0887 7.0887 7.3409 7.3409 8.1753 8.1753 9.6065 9.6065 9.8680 9.8680 12.2488 12.2488 14.7746 14.7746 15.1105 15.1105 17.3699 17.3699 k = 0.6294 0.1721-0.7562 ( 3009 PWs) bands (ev): -57.1573 -57.1573 -39.8234 -39.8234 -30.0752 -30.0752 -21.6031 -21.6031 -21.2736 -21.2736 -11.9298 -11.9298 -11.7523 -11.7523 -11.6890 -11.6890 -2.9137 -2.9137 -1.8217 -1.8217 5.2008 5.2008 7.0533 7.0533 7.3428 7.3428 8.1516 8.1516 9.5961 9.5961 9.8936 9.8936 12.2570 12.2570 14.7640 14.7640 15.0954 15.0954 17.3086 17.3086 k = 0.6265 0.1713-0.7376 ( 3009 PWs) bands (ev): -57.1579 -57.1579 -39.8237 -39.8237 -30.0730 -30.0730 -21.5948 -21.5948 -21.2731 -21.2731 -11.9279 -11.9279 -11.7513 -11.7513 -11.6892 -11.6892 -2.9088 -2.9088 -1.8603 -1.8603 5.2570 5.2570 7.0220 7.0220 7.3443 7.3443 8.1218 8.1218 9.5837 9.5837 9.9234 9.9234 12.2659 12.2659 14.7529 14.7529 15.0805 15.0805 17.2439 17.2439 k = 0.6236 0.1705-0.7189 ( 3008 PWs) bands (ev): -57.1586 -57.1586 -39.8239 -39.8239 -30.0706 -30.0706 -21.5859 -21.5859 -21.2725 -21.2725 -11.9258 -11.9258 -11.7502 -11.7502 -11.6895 -11.6895 -2.9050 -2.9050 -1.8992 -1.8992 5.3142 5.3142 6.9952 6.9952 7.3451 7.3451 8.0866 8.0866 9.5702 9.5702 9.9561 9.9561 12.2755 12.2755 14.7410 14.7410 15.0660 15.0660 17.1765 17.1765 k = 0.6208 0.1697-0.7003 ( 3004 PWs) bands (ev): -57.1592 -57.1592 -39.8242 -39.8242 -30.0682 -30.0682 -21.5767 -21.5767 -21.2717 -21.2717 -11.9237 -11.9237 -11.7490 -11.7490 -11.6897 -11.6897 -2.9026 -2.9026 -1.9379 -1.9379 5.3716 5.3716 6.9736 6.9736 7.3451 7.3451 8.0469 8.0469 9.5563 9.5563 9.9904 9.9904 12.2857 12.2857 14.7279 14.7279 15.0521 15.0521 17.1072 17.1072 k = 0.6179 0.1690-0.6816 ( 2994 PWs) bands (ev): -57.1600 -57.1600 -39.8245 -39.8245 -30.0656 -30.0656 -21.5670 -21.5670 -21.2709 -21.2709 -11.9214 -11.9214 -11.7477 -11.7477 -11.6899 -11.6899 -2.9022 -2.9022 -1.9756 -1.9756 5.4284 5.4284 6.9575 6.9575 7.3440 7.3440 8.0037 8.0037 9.5427 9.5427 10.0253 10.0253 12.2966 12.2966 14.7135 14.7135 15.0393 15.0393 17.0369 17.0369 k = 0.6150 0.1682-0.6630 ( 2994 PWs) bands (ev): -57.1607 -57.1607 -39.8248 -39.8248 -30.0629 -30.0629 -21.5569 -21.5569 -21.2700 -21.2700 -11.9191 -11.9191 -11.7464 -11.7464 -11.6902 -11.6902 -2.9043 -2.9043 -2.0117 -2.0117 5.4837 5.4837 6.9474 6.9474 7.3417 7.3417 7.9580 7.9580 9.5299 9.5299 10.0595 10.0595 12.3084 12.3084 14.6972 14.6972 15.0277 15.0277 16.9663 16.9663 k = 0.6121 0.1674-0.6443 ( 2993 PWs) bands (ev): -57.1615 -57.1615 -39.8251 -39.8251 -30.0601 -30.0601 -21.5466 -21.5466 -21.2689 -21.2689 -11.9169 -11.9169 -11.7450 -11.7450 -11.6904 -11.6904 -2.9094 -2.9094 -2.0453 -2.0453 5.5366 5.5366 6.9436 6.9436 7.3381 7.3381 7.9110 7.9110 9.5184 9.5184 10.0922 10.0922 12.3211 12.3211 14.6786 14.6786 15.0177 15.0177 16.8963 16.8963 k = 0.6093 0.1666-0.6257 ( 2990 PWs) bands (ev): -57.1623 -57.1623 -39.8254 -39.8254 -30.0573 -30.0573 -21.5360 -21.5360 -21.2677 -21.2677 -11.9145 -11.9145 -11.7435 -11.7435 -11.6907 -11.6907 -2.9183 -2.9183 -2.0759 -2.0759 5.5864 5.5864 6.9460 6.9460 7.3331 7.3331 7.8640 7.8640 9.5088 9.5088 10.1222 10.1222 12.3349 12.3349 14.6575 14.6575 15.0094 15.0094 16.8277 16.8277 k = 0.6064 0.1658-0.6070 ( 2994 PWs) bands (ev): -57.1631 -57.1631 -39.8258 -39.8258 -30.0543 -30.0543 -21.5251 -21.5251 -21.2663 -21.2663 -11.9122 -11.9122 -11.7420 -11.7420 -11.6909 -11.6909 -2.9313 -2.9313 -2.1027 -2.1027 5.6323 5.6323 6.9540 6.9540 7.3266 7.3266 7.8186 7.8186 9.5013 9.5013 10.1488 10.1488 12.3500 12.3500 14.6335 14.6335 15.0031 15.0031 16.7612 16.7612 k = 0.6035 0.1650-0.5884 ( 2993 PWs) bands (ev): -57.1640 -57.1640 -39.8261 -39.8261 -30.0513 -30.0513 -21.5141 -21.5141 -21.2646 -21.2646 -11.9098 -11.9098 -11.7405 -11.7405 -11.6911 -11.6911 -2.9489 -2.9489 -2.1251 -2.1251 5.6739 5.6739 6.9664 6.9664 7.3186 7.3186 7.7768 7.7768 9.4964 9.4964 10.1712 10.1712 12.3665 12.3665 14.6065 14.6065 14.9986 14.9986 16.6975 16.6975 k = 0.6006 0.1642-0.5697 ( 3003 PWs) bands (ev): -57.1648 -57.1648 -39.8265 -39.8265 -30.0483 -30.0483 -21.5031 -21.5031 -21.2628 -21.2628 -11.9076 -11.9076 -11.7389 -11.7389 -11.6913 -11.6913 -2.9713 -2.9713 -2.1427 -2.1427 5.7108 5.7108 6.9811 6.9811 7.3092 7.3092 7.7413 7.7413 9.4942 9.4942 10.1887 10.1887 12.3843 12.3843 14.5763 14.5763 14.9959 14.9959 16.6374 16.6374 k = 0.5978 0.1634-0.5511 ( 3003 PWs) bands (ev): -57.1657 -57.1657 -39.8268 -39.8268 -30.0452 -30.0452 -21.4919 -21.4919 -21.2607 -21.2607 -11.9052 -11.9052 -11.7372 -11.7372 -11.6915 -11.6915 -2.9986 -2.9986 -2.1555 -2.1555 5.7433 5.7433 6.9948 6.9948 7.2984 7.2984 7.7153 7.7153 9.4952 9.4952 10.2008 10.2008 12.4037 12.4037 14.5429 14.5429 14.9948 14.9948 16.5814 16.5814 k = 0.5949 0.1627-0.5324 ( 2995 PWs) bands (ev): -57.1666 -57.1666 -39.8272 -39.8272 -30.0420 -30.0420 -21.4808 -21.4808 -21.2583 -21.2583 -11.9029 -11.9029 -11.7353 -11.7353 -11.6916 -11.6916 -3.0306 -3.0306 -2.1635 -2.1635 5.7716 5.7716 7.0038 7.0038 7.2861 7.2861 7.7029 7.7029 9.4993 9.4993 10.2070 10.2070 12.4246 12.4246 14.5064 14.5064 14.9951 14.9951 16.5301 16.5301 k = 0.5920 0.1619-0.5138 ( 2997 PWs) bands (ev): -57.1675 -57.1675 -39.8276 -39.8276 -30.0388 -30.0388 -21.4698 -21.4698 -21.2555 -21.2555 -11.9006 -11.9006 -11.7335 -11.7335 -11.6916 -11.6916 -3.0668 -3.0668 -2.1670 -2.1670 5.7961 5.7961 7.0042 7.0042 7.2719 7.2719 7.7079 7.7079 9.5069 9.5069 10.2070 10.2070 12.4470 12.4470 14.4669 14.4669 14.9963 14.9963 16.4842 16.4842 k = 0.5891 0.1611-0.4952 ( 2999 PWs) bands (ev): -57.1684 -57.1684 -39.8280 -39.8280 -30.0355 -30.0355 -21.4590 -21.4590 -21.2524 -21.2524 -11.8984 -11.8984 -11.7317 -11.7317 -11.6917 -11.6917 -3.1069 -3.1069 -2.1663 -2.1663 5.8175 5.8175 6.9940 6.9940 7.2550 7.2550 7.7327 7.7327 9.5179 9.5179 10.2005 10.2005 12.4706 12.4706 14.4243 14.4243 14.9982 14.9982 16.4440 16.4440 k = 0.5863 0.1603-0.4765 ( 2998 PWs) bands (ev): -57.1694 -57.1694 -39.8283 -39.8283 -30.0323 -30.0323 -21.4485 -21.4485 -21.2489 -21.2489 -11.8962 -11.8962 -11.7298 -11.7298 -11.6916 -11.6916 -3.1501 -3.1501 -2.1621 -2.1621 5.8366 5.8366 6.9729 6.9729 7.2352 7.2352 7.7773 7.7773 9.5324 9.5324 10.1876 10.1876 12.4954 12.4954 14.3789 14.3789 15.0004 15.0004 16.4101 16.4101 k = 0.5834 0.1595-0.4579 ( 3004 PWs) bands (ev): -57.1703 -57.1703 -39.8287 -39.8287 -30.0291 -30.0291 -21.4383 -21.4383 -21.2449 -21.2449 -11.8942 -11.8942 -11.7279 -11.7279 -11.6916 -11.6916 -3.1959 -3.1959 -2.1547 -2.1547 5.8539 5.8539 6.9426 6.9426 7.2127 7.2127 7.8394 7.8394 9.5504 9.5504 10.1681 10.1681 12.5212 12.5212 14.3306 14.3306 15.0025 15.0025 16.3827 16.3827 k = 0.5805 0.1587-0.4392 ( 3006 PWs) bands (ev): -57.1712 -57.1712 -39.8291 -39.8291 -30.0258 -30.0258 -21.4286 -21.4286 -21.2404 -21.2404 -11.8922 -11.8922 -11.7261 -11.7261 -11.6914 -11.6914 -3.2437 -3.2437 -2.1447 -2.1447 5.8702 5.8702 6.9052 6.9052 7.1880 7.1880 7.9161 7.9161 9.5719 9.5719 10.1423 10.1423 12.5475 12.5475 14.2798 14.2798 15.0040 15.0040 16.3623 16.3623 k = 0.5776 0.1579-0.4206 ( 3006 PWs) bands (ev): -57.1721 -57.1721 -39.8295 -39.8295 -30.0226 -30.0226 -21.4194 -21.4194 -21.2354 -21.2354 -11.8902 -11.8902 -11.7241 -11.7241 -11.6912 -11.6912 -3.2930 -3.2930 -2.1325 -2.1325 5.8860 5.8860 6.8627 6.8627 7.1615 7.1615 8.0043 8.0043 9.5966 9.5966 10.1105 10.1105 12.5742 12.5742 14.2263 14.2263 15.0047 15.0047 16.3490 16.3490 k = 0.5748 0.1572-0.4019 ( 3010 PWs) bands (ev): -57.1730 -57.1730 -39.8299 -39.8299 -30.0194 -30.0194 -21.4107 -21.4107 -21.2298 -21.2298 -11.8884 -11.8884 -11.7223 -11.7223 -11.6909 -11.6909 -3.3433 -3.3433 -2.1187 -2.1187 5.9018 5.9018 6.8169 6.8169 7.1336 7.1336 8.1017 8.1017 9.6243 9.6243 10.0729 10.0729 12.6010 12.6010 14.1705 14.1705 15.0041 15.0041 16.3430 16.3430 k = 0.5719 0.1564-0.3833 ( 3010 PWs) bands (ev): -57.1740 -57.1740 -39.8302 -39.8302 -30.0162 -30.0162 -21.4026 -21.4026 -21.2237 -21.2237 -11.8866 -11.8866 -11.7204 -11.7204 -11.6905 -11.6905 -3.3941 -3.3941 -2.1034 -2.1034 5.9181 5.9181 6.7690 6.7690 7.1047 7.1047 8.2063 8.2063 9.6548 9.6548 10.0303 10.0303 12.6275 12.6275 14.1124 14.1124 15.0020 15.0020 16.3443 16.3443 k = 0.5690 0.1556-0.3646 ( 3010 PWs) bands (ev): -57.1748 -57.1748 -39.8306 -39.8306 -30.0131 -30.0131 -21.3952 -21.3952 -21.2170 -21.2170 -11.8850 -11.8850 -11.7186 -11.7186 -11.6900 -11.6900 -3.4451 -3.4451 -2.0871 -2.0871 5.9352 5.9352 6.7202 6.7202 7.0750 7.0750 8.3167 8.3167 9.6872 9.6872 9.9836 9.9836 12.6535 12.6535 14.0521 14.0521 14.9982 14.9982 16.3526 16.3526 k = 0.5661 0.1548-0.3460 ( 3014 PWs) bands (ev): -57.1757 -57.1757 -39.8310 -39.8310 -30.0100 -30.0100 -21.3885 -21.3885 -21.2099 -21.2099 -11.8834 -11.8834 -11.7169 -11.7169 -11.6895 -11.6895 -3.4959 -3.4959 -2.0700 -2.0700 5.9534 5.9534 6.6711 6.6711 7.0447 7.0447 8.4314 8.4314 9.7199 9.7199 9.9346 9.9346 12.6786 12.6786 13.9899 13.9899 14.9923 14.9923 16.3679 16.3679 k = 0.5633 0.1540-0.3273 ( 3008 PWs) bands (ev): -57.1766 -57.1766 -39.8313 -39.8313 -30.0069 -30.0069 -21.3823 -21.3823 -21.2022 -21.2022 -11.8819 -11.8819 -11.7152 -11.7152 -11.6887 -11.6887 -3.5463 -3.5463 -2.0524 -2.0524 5.9729 5.9729 6.6223 6.6223 7.0142 7.0142 8.5497 8.5497 9.7474 9.7474 9.8895 9.8895 12.7027 12.7027 13.9258 13.9258 14.9844 14.9844 16.3897 16.3897 k = 0.5604 0.1532-0.3087 ( 3005 PWs) bands (ev): -57.1774 -57.1774 -39.8317 -39.8317 -30.0040 -30.0040 -21.3768 -21.3768 -21.1942 -21.1942 -11.8805 -11.8805 -11.7136 -11.7136 -11.6879 -11.6879 -3.5959 -3.5959 -2.0345 -2.0345 5.9938 5.9938 6.5744 6.5744 6.9835 6.9835 8.6705 8.6705 9.7494 9.7494 9.8687 9.8687 12.7254 12.7254 13.8602 13.8602 14.9743 14.9743 16.4175 16.4175 k = 0.5575 0.1524-0.2900 ( 3005 PWs) bands (ev): -57.1783 -57.1783 -39.8320 -39.8320 -30.0011 -30.0011 -21.3720 -21.3720 -21.1859 -21.1859 -11.8792 -11.8792 -11.7122 -11.7122 -11.6870 -11.6870 -3.6444 -3.6444 -2.0166 -2.0166 6.0162 6.0162 6.5277 6.5277 6.9530 6.9530 8.7930 8.7930 9.7101 9.7101 9.8885 9.8885 12.7466 12.7466 13.7931 13.7931 14.9621 14.9621 16.4508 16.4508 k = 0.5546 0.1517-0.2714 ( 3006 PWs) bands (ev): -57.1791 -57.1791 -39.8323 -39.8323 -29.9983 -29.9983 -21.3676 -21.3676 -21.1773 -21.1773 -11.8780 -11.8780 -11.7108 -11.7108 -11.6859 -11.6859 -3.6918 -3.6918 -1.9986 -1.9986 6.0401 6.0401 6.4826 6.4826 6.9228 6.9228 8.9161 8.9161 9.6517 9.6517 9.9274 9.9274 12.7660 12.7660 13.7248 13.7248 14.9477 14.9477 16.4888 16.4888 k = 0.5518 0.1509-0.2528 ( 3008 PWs) bands (ev): -57.1798 -57.1798 -39.8326 -39.8326 -29.9956 -29.9956 -21.3638 -21.3638 -21.1686 -21.1686 -11.8769 -11.8769 -11.7096 -11.7096 -11.6848 -11.6848 -3.7378 -3.7378 -1.9809 -1.9809 6.0653 6.0653 6.4394 6.4394 6.8931 6.8931 9.0381 9.0381 9.5880 9.5880 9.9729 9.9729 12.7834 12.7834 13.6557 13.6557 14.9314 14.9314 16.5308 16.5308 k = 0.5489 0.1501-0.2341 ( 3006 PWs) bands (ev): -57.1806 -57.1806 -39.8329 -39.8329 -29.9930 -29.9930 -21.3604 -21.3604 -21.1598 -21.1598 -11.8759 -11.8759 -11.7085 -11.7085 -11.6835 -11.6835 -3.7821 -3.7821 -1.9635 -1.9635 6.0915 6.0915 6.3986 6.3986 6.8640 6.8640 9.1555 9.1555 9.5257 9.5257 10.0218 10.0218 12.7986 12.7986 13.5858 13.5858 14.9133 14.9133 16.5760 16.5760 k = 0.5460 0.1493-0.2155 ( 3008 PWs) bands (ev): -57.1813 -57.1813 -39.8332 -39.8332 -29.9905 -29.9905 -21.3575 -21.3575 -21.1510 -21.1510 -11.8750 -11.8750 -11.7076 -11.7076 -11.6822 -11.6822 -3.8248 -3.8248 -1.9466 -1.9466 6.1182 6.1182 6.3608 6.3608 6.8359 6.8359 9.2545 9.2545 9.4792 9.4792 10.0728 10.0728 12.8114 12.8114 13.5156 13.5156 14.8936 14.8936 16.6234 16.6234 k = 0.5431 0.1485-0.1968 ( 3004 PWs) bands (ev): -57.1820 -57.1820 -39.8335 -39.8335 -29.9881 -29.9881 -21.3549 -21.3549 -21.1424 -21.1424 -11.8742 -11.8742 -11.7067 -11.7067 -11.6809 -11.6809 -3.8655 -3.8655 -1.9302 -1.9302 6.1442 6.1442 6.3271 6.3271 6.8088 6.8088 9.2863 9.2863 9.4980 9.4980 10.1252 10.1252 12.8217 12.8217 13.4454 13.4454 14.8725 14.8725 16.6721 16.6721 k = 0.5403 0.1477-0.1782 ( 3008 PWs) bands (ev): -57.1827 -57.1827 -39.8338 -39.8338 -29.9858 -29.9858 -21.3526 -21.3526 -21.1340 -21.1340 -11.8735 -11.8735 -11.7060 -11.7060 -11.6795 -11.6795 -3.9042 -3.9042 -1.9145 -1.9145 6.1664 6.1664 6.3006 6.3006 6.7830 6.7830 9.2434 9.2434 9.5896 9.5896 10.1785 10.1785 12.8292 12.8292 13.3755 13.3755 14.8504 14.8504 16.7213 16.7213 k = 0.5374 0.1469-0.1595 ( 3010 PWs) bands (ev): -57.1833 -57.1833 -39.8340 -39.8340 -29.9837 -29.9837 -21.3506 -21.3506 -21.1258 -21.1258 -11.8728 -11.8728 -11.7053 -11.7053 -11.6781 -11.6781 -3.9407 -3.9407 -1.8995 -1.8995 6.1779 6.1779 6.2880 6.2880 6.7586 6.7586 9.1785 9.1785 9.7013 9.7013 10.2324 10.2324 12.8338 12.8338 13.3063 13.3063 14.8275 14.8275 16.7697 16.7697 k = 0.5345 0.1462-0.1409 ( 3012 PWs) bands (ev): -57.1838 -57.1838 -39.8343 -39.8343 -29.9817 -29.9817 -21.3489 -21.3489 -21.1181 -21.1181 -11.8722 -11.8722 -11.7047 -11.7047 -11.6767 -11.6767 -3.9750 -3.9750 -1.8854 -1.8854 6.1721 6.1721 6.2956 6.2956 6.7358 6.7358 9.1086 9.1086 9.8161 9.8161 10.2864 10.2864 12.8355 12.8355 13.2384 13.2384 14.8042 14.8042 16.8167 16.8167 k = 0.5316 0.1454-0.1222 ( 3008 PWs) bands (ev): -57.1844 -57.1844 -39.8345 -39.8345 -29.9798 -29.9798 -21.3473 -21.3473 -21.1107 -21.1107 -11.8716 -11.8716 -11.7042 -11.7042 -11.6754 -11.6754 -4.0069 -4.0069 -1.8722 -1.8722 6.1545 6.1545 6.3176 6.3176 6.7148 6.7148 9.0380 9.0380 9.9294 9.9294 10.3401 10.3401 12.8341 12.8341 13.1721 13.1721 14.7810 14.7810 16.8610 16.8610 k = 0.5288 0.1446-0.1036 ( 3002 PWs) bands (ev): -57.1849 -57.1849 -39.8347 -39.8347 -29.9781 -29.9781 -21.3460 -21.3460 -21.1037 -21.1037 -11.8711 -11.8711 -11.7037 -11.7037 -11.6741 -11.6741 -4.0363 -4.0363 -1.8599 -1.8599 6.1332 6.1332 6.3456 6.3456 6.6957 6.6957 8.9687 8.9687 10.0393 10.0393 10.3930 10.3930 12.8297 12.8297 13.1080 13.1080 14.7582 14.7582 16.9021 16.9021 k = 0.5259 0.1438-0.0849 ( 3002 PWs) bands (ev): -57.1853 -57.1853 -39.8349 -39.8349 -29.9765 -29.9765 -21.3449 -21.3449 -21.0973 -21.0973 -11.8707 -11.8707 -11.7033 -11.7033 -11.6729 -11.6729 -4.0631 -4.0631 -1.8487 -1.8487 6.1116 6.1116 6.3752 6.3752 6.6789 6.6789 8.9017 8.9017 10.1441 10.1441 10.4448 10.4448 12.8224 12.8224 13.0468 13.0468 14.7363 14.7363 16.9390 16.9390 k = 0.5230 0.1430-0.0663 ( 3004 PWs) bands (ev): -57.1857 -57.1857 -39.8351 -39.8351 -29.9751 -29.9751 -21.3439 -21.3439 -21.0915 -21.0915 -11.8703 -11.8703 -11.7030 -11.7030 -11.6717 -11.6717 -4.0874 -4.0874 -1.8385 -1.8385 6.0913 6.0913 6.4045 6.4045 6.6646 6.6646 8.8382 8.8382 10.2423 10.2423 10.4951 10.4951 12.8124 12.8124 12.9893 12.9893 14.7155 14.7155 16.9714 16.9714 k = 0.5201 0.1422-0.0477 ( 3006 PWs) bands (ev): -57.1861 -57.1861 -39.8352 -39.8352 -29.9739 -29.9739 -21.3430 -21.3430 -21.0862 -21.0862 -11.8701 -11.8701 -11.7027 -11.7027 -11.6707 -11.6707 -4.1089 -4.1089 -1.8294 -1.8294 6.0729 6.0729 6.4319 6.4319 6.6532 6.6532 8.7790 8.7790 10.3325 10.3325 10.5434 10.5434 12.8000 12.8000 12.9363 12.9363 14.6964 14.6964 16.9989 16.9989 k = 0.5173 0.1414-0.0290 ( 3004 PWs) bands (ev): -57.1864 -57.1864 -39.8353 -39.8353 -29.9728 -29.9728 -21.3423 -21.3423 -21.0816 -21.0816 -11.8698 -11.8698 -11.7025 -11.7025 -11.6698 -11.6698 -4.1277 -4.1277 -1.8214 -1.8214 6.0566 6.0566 6.4563 6.4563 6.6451 6.6451 8.7252 8.7252 10.4129 10.4129 10.5896 10.5896 12.7856 12.7856 12.8888 12.8888 14.6792 14.6792 17.0217 17.0217 k = 0.5144 0.1406-0.0104 ( 3000 PWs) bands (ev): -57.1867 -57.1867 -39.8354 -39.8354 -29.9718 -29.9718 -21.3418 -21.3418 -21.0776 -21.0776 -11.8695 -11.8695 -11.7022 -11.7022 -11.6690 -11.6690 -4.1437 -4.1437 -1.8147 -1.8147 6.0427 6.0427 6.4764 6.4764 6.6404 6.6404 8.6775 8.6775 10.4817 10.4817 10.6331 10.6331 12.7695 12.7695 12.8481 12.8481 14.6642 14.6642 17.0398 17.0398 k = 0.5115 0.1399 0.0083 ( 2996 PWs) bands (ev): -57.1869 -57.1869 -39.8355 -39.8355 -29.9710 -29.9710 -21.3413 -21.3413 -21.0743 -21.0743 -11.8693 -11.8693 -11.7021 -11.7021 -11.6683 -11.6683 -4.1569 -4.1569 -1.8091 -1.8091 6.0312 6.0312 6.4916 6.4916 6.6393 6.6393 8.6370 8.6370 10.5376 10.5376 10.6731 10.6731 12.7523 12.7523 12.8154 12.8154 14.6517 14.6517 17.0536 17.0536 k = 0.5086 0.1391 0.0269 ( 2997 PWs) bands (ev): -57.1871 -57.1871 -39.8356 -39.8356 -29.9704 -29.9704 -21.3409 -21.3409 -21.0717 -21.0717 -11.8692 -11.8692 -11.7019 -11.7019 -11.6678 -11.6678 -4.1671 -4.1671 -1.8047 -1.8047 6.0222 6.0222 6.5019 6.5019 6.6407 6.6407 8.6044 8.6044 10.5800 10.5800 10.7081 10.7081 12.7351 12.7351 12.7913 12.7913 14.6418 14.6418 17.0637 17.0637 k = 0.5058 0.1383 0.0456 ( 2993 PWs) bands (ev): -57.1872 -57.1872 -39.8356 -39.8356 -29.9700 -29.9700 -21.3407 -21.3407 -21.0699 -21.0699 -11.8691 -11.8691 -11.7018 -11.7018 -11.6674 -11.6674 -4.1745 -4.1745 -1.8016 -1.8016 6.0158 6.0158 6.5081 6.5081 6.6435 6.6435 8.5806 8.5806 10.6094 10.6094 10.7357 10.7357 12.7202 12.7202 12.7752 12.7752 14.6346 14.6346 17.0705 17.0705 k = 0.5029 0.1375 0.0642 ( 2989 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9697 -29.9697 -21.3405 -21.3405 -21.0688 -21.0688 -11.8690 -11.8690 -11.7018 -11.7018 -11.6672 -11.6672 -4.1789 -4.1789 -1.7997 -1.7997 6.0119 6.0119 6.5113 6.5113 6.6459 6.6459 8.5660 8.5660 10.6266 10.6266 10.7533 10.7533 12.7102 12.7102 12.7660 12.7660 14.6303 14.6303 17.0745 17.0745 k = 0.5000 0.1367 0.0829 ( 2986 PWs) bands (ev): -57.1873 -57.1873 -39.8357 -39.8357 -29.9696 -29.9696 -21.3405 -21.3405 -21.0684 -21.0684 -11.8690 -11.8690 -11.7017 -11.7017 -11.6671 -11.6671 -4.1803 -4.1803 -1.7991 -1.7991 6.0106 6.0106 6.5123 6.5123 6.6469 6.6469 8.5611 8.5611 10.6323 10.6323 10.7594 10.7594 12.7067 12.7067 12.7630 12.7630 14.6288 14.6288 17.0757 17.0757 k = 0.5000-0.8459-0.5128 ( 3010 PWs) bands (ev): -57.1532 -57.1532 -39.8218 -39.8218 -30.0896 -30.0896 -21.6580 -21.6580 -21.2761 -21.2761 -11.9446 -11.9446 -11.7593 -11.7593 -11.6880 -11.6880 -2.9517 -2.9517 -1.5537 -1.5537 4.9382 4.9382 7.3035 7.3035 7.6226 7.6226 7.7799 7.7799 9.4014 9.4014 9.8305 9.8305 12.5774 12.5774 14.8561 14.8561 15.2323 15.2323 18.6835 18.6835 k = 0.5166-0.8387-0.5084 ( 3010 PWs) bands (ev): -57.1532 -57.1532 -39.8218 -39.8218 -30.0896 -30.0896 -21.6580 -21.6580 -21.2761 -21.2761 -11.9446 -11.9446 -11.7593 -11.7593 -11.6880 -11.6880 -2.9517 -2.9517 -1.5537 -1.5537 4.9376 4.9376 7.3035 7.3035 7.6206 7.6206 7.7828 7.7828 9.4022 9.4022 9.8305 9.8305 12.5759 12.5759 14.8561 14.8561 15.2323 15.2323 18.6567 18.6567 k = 0.5333-0.8316-0.5040 ( 3009 PWs) bands (ev): -57.1532 -57.1532 -39.8218 -39.8218 -30.0896 -30.0896 -21.6580 -21.6580 -21.2761 -21.2761 -11.9445 -11.9445 -11.7593 -11.7593 -11.6879 -11.6879 -2.9519 -2.9519 -1.5535 -1.5535 4.9359 4.9359 7.3036 7.3036 7.6150 7.6150 7.7910 7.7910 9.4045 9.4045 9.8304 9.8304 12.5715 12.5715 14.8561 14.8561 15.2322 15.2322 18.5971 18.5971 k = 0.5499-0.8244-0.4997 ( 3007 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0896 -30.0896 -21.6580 -21.6580 -21.2761 -21.2761 -11.9445 -11.9445 -11.7593 -11.7593 -11.6879 -11.6879 -2.9522 -2.9522 -1.5533 -1.5533 4.9331 4.9331 7.3037 7.3037 7.6069 7.6069 7.8034 7.8034 9.4082 9.4082 9.8302 9.8302 12.5641 12.5641 14.8560 14.8560 15.2320 15.2320 18.5272 18.5272 k = 0.5666-0.8172-0.4953 ( 3006 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0896 -30.0896 -21.6579 -21.6579 -21.2761 -21.2761 -11.9444 -11.9444 -11.7593 -11.7593 -11.6879 -11.6879 -2.9525 -2.9525 -1.5531 -1.5531 4.9292 4.9292 7.3039 7.3039 7.5973 7.5973 7.8189 7.8189 9.4134 9.4134 9.8301 9.8301 12.5539 12.5539 14.8559 14.8559 15.2318 15.2318 18.4551 18.4551 k = 0.5832-0.8100-0.4910 ( 3002 PWs) bands (ev): -57.1533 -57.1533 -39.8217 -39.8217 -30.0895 -30.0895 -21.6578 -21.6578 -21.2761 -21.2761 -11.9443 -11.9443 -11.7592 -11.7592 -11.6878 -11.6878 -2.9530 -2.9530 -1.5527 -1.5527 4.9244 4.9244 7.3042 7.3042 7.5872 7.5872 7.8366 7.8366 9.4200 9.4200 9.8298 9.8298 12.5410 12.5410 14.8559 14.8559 15.2316 15.2316 18.3838 18.3838 k = 0.5999-0.8028-0.4866 ( 3004 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0895 -30.0895 -21.6578 -21.6578 -21.2761 -21.2761 -11.9443 -11.9443 -11.7592 -11.7592 -11.6878 -11.6878 -2.9535 -2.9535 -1.5523 -1.5523 4.9186 4.9186 7.3045 7.3045 7.5771 7.5771 7.8555 7.8555 9.4279 9.4279 9.8296 9.8296 12.5256 12.5256 14.8558 14.8558 15.2313 15.2313 18.3146 18.3146 k = 0.6165-0.7956-0.4822 ( 3004 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0895 -30.0895 -21.6577 -21.6577 -21.2761 -21.2761 -11.9442 -11.9442 -11.7592 -11.7592 -11.6877 -11.6877 -2.9541 -2.9541 -1.5519 -1.5519 4.9121 4.9121 7.3049 7.3049 7.5674 7.5674 7.8753 7.8753 9.4370 9.4370 9.8294 9.8294 12.5079 12.5079 14.8556 14.8556 15.2309 15.2309 18.2482 18.2482 k = 0.6332-0.7884-0.4779 ( 3012 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0895 -30.0895 -21.6576 -21.6576 -21.2761 -21.2761 -11.9441 -11.9441 -11.7592 -11.7592 -11.6878 -11.6878 -2.9548 -2.9548 -1.5515 -1.5515 4.9048 4.9048 7.3053 7.3053 7.5582 7.5582 7.8955 7.8955 9.4473 9.4473 9.8292 9.8292 12.4882 12.4882 14.8555 14.8555 15.2305 15.2305 18.1848 18.1848 k = 0.6498-0.7812-0.4735 ( 3010 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0894 -30.0894 -21.6574 -21.6574 -21.2761 -21.2761 -11.9440 -11.9440 -11.7591 -11.7591 -11.6877 -11.6877 -2.9555 -2.9555 -1.5511 -1.5511 4.8970 4.8970 7.3058 7.3058 7.5499 7.5499 7.9158 7.9158 9.4586 9.4586 9.8291 9.8291 12.4666 12.4666 14.8554 14.8554 15.2301 15.2301 18.1247 18.1247 k = 0.6665-0.7740-0.4691 ( 3013 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0894 -30.0894 -21.6573 -21.6573 -21.2761 -21.2761 -11.9439 -11.9439 -11.7591 -11.7591 -11.6877 -11.6877 -2.9562 -2.9562 -1.5507 -1.5507 4.8888 4.8888 7.3063 7.3063 7.5425 7.5425 7.9358 7.9358 9.4708 9.4708 9.8290 9.8290 12.4435 12.4435 14.8553 14.8553 15.2296 15.2296 18.0681 18.0681 k = 0.6831-0.7668-0.4648 ( 3014 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0894 -30.0894 -21.6571 -21.6571 -21.2761 -21.2761 -11.9437 -11.9437 -11.7590 -11.7590 -11.6876 -11.6876 -2.9569 -2.9569 -1.5504 -1.5504 4.8803 4.8803 7.3069 7.3069 7.5361 7.5361 7.9553 7.9553 9.4837 9.4837 9.8291 9.8291 12.4193 12.4193 14.8553 14.8553 15.2292 15.2292 18.0149 18.0149 k = 0.6998-0.7596-0.4604 ( 3015 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0893 -30.0893 -21.6569 -21.6569 -21.2761 -21.2761 -11.9436 -11.9436 -11.7589 -11.7589 -11.6876 -11.6876 -2.9577 -2.9577 -1.5502 -1.5502 4.8716 4.8716 7.3076 7.3076 7.5306 7.5306 7.9741 7.9741 9.4971 9.4971 9.8293 9.8293 12.3942 12.3942 14.8552 14.8552 15.2287 15.2287 17.9653 17.9653 k = 0.7164-0.7524-0.4561 ( 3011 PWs) bands (ev): -57.1533 -57.1533 -39.8218 -39.8218 -30.0893 -30.0893 -21.6567 -21.6567 -21.2761 -21.2761 -11.9434 -11.9434 -11.7589 -11.7589 -11.6875 -11.6875 -2.9584 -2.9584 -1.5501 -1.5501 4.8630 4.8630 7.3083 7.3083 7.5261 7.5261 7.9919 7.9919 9.5108 9.5108 9.8297 9.8297 12.3685 12.3685 14.8552 14.8552 15.2282 15.2282 17.9191 17.9191 k = 0.7331-0.7452-0.4517 ( 3006 PWs) bands (ev): -57.1534 -57.1534 -39.8218 -39.8218 -30.0892 -30.0892 -21.6565 -21.6565 -21.2761 -21.2761 -11.9432 -11.9432 -11.7587 -11.7587 -11.6874 -11.6874 -2.9590 -2.9590 -1.5501 -1.5501 4.8545 4.8545 7.3090 7.3090 7.5226 7.5226 8.0087 8.0087 9.5245 9.5245 9.8304 9.8304 12.3428 12.3428 14.8552 14.8552 15.2277 15.2277 17.8765 17.8765 k = 0.7497-0.7380-0.4473 ( 3004 PWs) bands (ev): -57.1534 -57.1534 -39.8218 -39.8218 -30.0891 -30.0891 -21.6563 -21.6563 -21.2761 -21.2761 -11.9430 -11.9430 -11.7587 -11.7587 -11.6873 -11.6873 -2.9596 -2.9596 -1.5503 -1.5503 4.8462 4.8462 7.3097 7.3097 7.5199 7.5199 8.0241 8.0241 9.5381 9.5381 9.8313 9.8313 12.3173 12.3173 14.8553 14.8553 15.2272 15.2272 17.8374 17.8374 k = 0.7664-0.7308-0.4430 ( 3003 PWs) bands (ev): -57.1534 -57.1534 -39.8218 -39.8218 -30.0890 -30.0890 -21.6560 -21.6560 -21.2761 -21.2761 -11.9428 -11.9428 -11.7586 -11.7586 -11.6873 -11.6873 -2.9602 -2.9602 -1.5507 -1.5507 4.8384 4.8384 7.3105 7.3105 7.5182 7.5182 8.0381 8.0381 9.5513 9.5513 9.8325 9.8325 12.2924 12.2924 14.8554 14.8554 15.2268 15.2268 17.8018 17.8018 k = 0.7830-0.7236-0.4386 ( 2999 PWs) bands (ev): -57.1534 -57.1534 -39.8218 -39.8218 -30.0890 -30.0890 -21.6558 -21.6558 -21.2761 -21.2761 -11.9427 -11.9427 -11.7585 -11.7585 -11.6872 -11.6872 -2.9606 -2.9606 -1.5513 -1.5513 4.8311 4.8311 7.3113 7.3113 7.5174 7.5174 8.0505 8.0505 9.5638 9.5638 9.8339 9.8339 12.2685 12.2685 14.8556 14.8556 15.2263 15.2263 17.7695 17.7695 k = 0.7996-0.7164-0.4343 ( 3001 PWs) bands (ev): -57.1534 -57.1534 -39.8218 -39.8218 -30.0889 -30.0889 -21.6555 -21.6555 -21.2761 -21.2761 -11.9425 -11.9425 -11.7584 -11.7584 -11.6871 -11.6871 -2.9610 -2.9610 -1.5521 -1.5521 4.8245 4.8245 7.3121 7.3121 7.5173 7.5173 8.0613 8.0613 9.5754 9.5754 9.8355 9.8355 12.2460 12.2460 14.8559 14.8559 15.2260 15.2260 17.7407 17.7407 k = 0.8163-0.7092-0.4299 ( 3000 PWs) bands (ev): -57.1535 -57.1535 -39.8218 -39.8218 -30.0888 -30.0888 -21.6552 -21.6552 -21.2761 -21.2761 -11.9423 -11.9423 -11.7584 -11.7584 -11.6871 -11.6871 -2.9612 -2.9612 -1.5532 -1.5532 4.8186 4.8186 7.3129 7.3129 7.5180 7.5180 8.0702 8.0702 9.5859 9.5859 9.8374 9.8374 12.2252 12.2252 14.8562 14.8562 15.2257 15.2257 17.7152 17.7152 Writing output data file NaTaN2.save init_run : 0.25s CPU 0.40s WALL ( 1 calls) electrons : 129.80s CPU 131.59s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.03s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 129.78s CPU 131.58s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.02s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.04s WALL ( 382 calls) cegterg : 115.96s CPU 117.21s WALL ( 432 calls) Called by sum_band: Called by *egterg: h_psi : 93.79s CPU 94.62s WALL ( 6728 calls) s_psi : 1.18s CPU 1.32s WALL ( 6728 calls) g_psi : 0.10s CPU 0.12s WALL ( 5914 calls) cdiaghg : 26.66s CPU 27.10s WALL ( 6296 calls) cegterg:over : 2.46s CPU 2.49s WALL ( 5914 calls) cegterg:upda : 1.85s CPU 1.84s WALL ( 5914 calls) cegterg:last : 1.34s CPU 1.31s WALL ( 1182 calls) cdiaghg:chol : 1.49s CPU 1.46s WALL ( 6296 calls) cdiaghg:inve : 0.74s CPU 0.69s WALL ( 6296 calls) cdiaghg:para : 1.70s CPU 1.64s WALL ( 12592 calls) Called by h_psi: h_psi:vloc : 90.38s CPU 91.00s WALL ( 6728 calls) h_psi:vnl : 3.30s CPU 3.53s WALL ( 6728 calls) add_vuspsi : 1.53s CPU 1.68s WALL ( 6728 calls) General routines calbec : 1.76s CPU 1.83s WALL ( 6728 calls) fft : 0.01s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 84.80s CPU 85.28s WALL ( 557744 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.14s CPU 0.15s WALL ( 764 calls) Parallel routines fft_scatter : 21.38s CPU 21.26s WALL ( 557767 calls) PWSCF : 2m23.28s CPU 2m50.38s WALL This run was terminated on: 21: 4:11 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=