9659.000 30 1 1 7.3839938E-03 -7.9461888E+00 -1.4639996E+00 1 1 9.4962698E+03 4.7397145E+01 0.0000000E+00 5.5081952E-01 2.0000000E+00 0.0000000E+00 = E_edge, Z, n_edge, j_edge, Abs_before_edge, VO_interstitial, E_cut, ninit, ninit1, Epsii, UnitCell_Volume, Surface_ref, f0_forward, natomsym_f, abs_u_iso Energy -30.0000 2.1696890E-15 -29.9000 2.3756516E-15 -29.8000 2.6029682E-15 -29.7000 2.8539944E-15 -29.6000 3.1314199E-15 -29.5000 3.4382553E-15 -29.4000 3.7778149E-15 -29.3000 4.1539688E-15 -29.2000 4.5709777E-15 -29.1000 5.0336432E-15 -29.0000 5.5473450E-15 -28.9000 6.1181956E-15 -28.8000 6.7530882E-15 -28.7000 7.4597646E-15 -28.6000 8.2471515E-15 -28.5000 9.1251783E-15 -28.4000 1.0105155E-14 -28.3000 1.1199856E-14 -28.2000 1.2423969E-14 -28.1000 1.3794043E-14 -28.0000 1.5328757E-14 -27.9000 1.7049566E-14 -27.8000 1.8981036E-14 -27.7000 2.1151220E-14 -27.6000 2.3592266E-14 -27.5000 2.6340813E-14 -27.4000 2.9438837E-14 -27.3000 3.2934809E-14 -27.2000 3.6883642E-14 -27.1000 4.1349683E-14 -27.0000 4.6406592E-14 -26.9000 5.2139629E-14 -26.8000 5.8647056E-14 -26.7000 6.6043109E-14 -26.6000 7.4457438E-14 -26.5000 8.4044807E-14 -26.4000 9.4984036E-14 -26.3000 1.0748288E-13 -26.2000 1.2178420E-13 -26.1000 1.3817103E-13 -26.0000 1.5697717E-13 -25.9000 1.7859308E-13 -25.8000 2.0347088E-13 -25.7000 2.3215387E-13 -25.6000 2.6528427E-13 -25.5000 3.0361638E-13 -25.4000 3.4804238E-13 -25.3000 3.9961389E-13 -25.2000 4.5960576E-13 -25.1000 5.2952996E-13 -25.0000 6.1119423E-13 -24.9000 7.0676378E-13 -24.8000 8.1884686E-13 -24.7000 9.5060434E-13 -24.6000 1.1058321E-12 -24.5000 1.2891596E-12 -24.4000 1.5061260E-12 -24.3000 1.7636784E-12 -24.2000 2.0702013E-12 -24.1000 2.4359979E-12 -24.0000 2.8737331E-12 -23.9000 3.3992511E-12 -23.8000 4.0321268E-12 -23.7000 4.7968075E-12 -23.6000 5.7239637E-12 -23.5000 6.8521322E-12 -23.4000 8.2301566E-12 -23.3000 9.9200787E-12 -23.2000 1.2001338E-11 -23.1000 1.4574834E-11 -23.0000 1.7773406E-11 -22.9000 2.1767436E-11 -22.8000 2.6780854E-11 -22.7000 3.3109563E-11 -22.6000 4.1145308E-11 -22.5000 5.1413423E-11 -22.4000 6.4622216E-11 -22.3000 8.1735221E-11 -22.2000 1.0407947E-10 -22.1000 1.3349491E-10 -22.0000 1.7257001E-10 -21.9000 2.2496879E-10 -21.8000 2.9599704E-10 -21.7000 3.9336511E-10 -21.6000 5.2857864E-10 -21.5000 7.1894697E-10 -21.4000 9.9113009E-10 -21.3000 1.3870305E-09 -21.2000 1.9740630E-09 -21.1000 2.8635297E-09 -21.0000 4.2451130E-09 -20.9000 6.4530506E-09 -20.8000 1.0100824E-08 -20.7000 1.6364266E-08 -20.6000 2.7639036E-08 -20.5000 4.9144869E-08 -20.4000 9.3255948E-08 -20.3000 1.9281373E-07 -20.2000 4.4925602E-07 -20.1000 1.2552928E-06 -20.0000 4.8479187E-06 -19.9000 4.3224587E-05 -19.8000 7.9444934E-03 -19.7000 1.0680820E-04 -19.6000 2.8132574E-04 -19.5000 2.1208878E-04 -19.4000 2.1432804E-02 -19.3000 1.7647088E-02 -19.2000 3.4250734E-01 -19.1000 2.7125566E-04 -19.0000 4.7948271E-04 -18.9000 4.8329334E-04 -18.8000 2.5373022E-03 -18.7000 6.8915706E-05 -18.6000 7.4464919E-06 -18.5000 8.5302914E-07 -18.4000 2.9052477E-07 -18.3000 1.2277938E-07 -18.2000 5.9219739E-08 -18.1000 3.1501111E-08 -18.0000 1.8169446E-08 -17.9000 1.1266533E-08 -17.8000 7.4773484E-09 -17.7000 5.2959522E-09 -17.6000 3.9891677E-09 -17.5000 3.1795258E-09 -17.4000 2.6633276E-09 -17.3000 2.3264496E-09 -17.2000 2.1026577E-09 -17.1000 1.9523857E-09 -17.0000 1.8514252E-09 -16.9000 1.7845255E-09 -16.8000 1.7419544E-09 -16.7000 1.7175394E-09 -16.6000 1.7071335E-09 -16.5000 1.7082261E-09 -16.4000 1.7191413E-09 -16.3000 1.7389114E-09 -16.2000 1.7671338E-09 -16.1000 1.8038268E-09 -16.0000 1.8493106E-09 -15.9000 1.9045222E-09 -15.8000 1.9707816E-09 -15.7000 2.0500928E-09 -15.6000 2.1455605E-09 -15.5000 2.2616511E-09 -15.4000 2.4052603E-09 -15.3000 2.5872476E-09 -15.2000 2.8253942E-09 -15.1000 3.1505800E-09 -15.0000 3.6197631E-09 -14.9000 4.3478442E-09 -14.8000 5.5935691E-09 -14.7000 8.0386980E-09 -14.6000 1.3979359E-08 -14.5000 3.5683701E-08 -14.4000 3.6721971E-07 -14.3000 7.0654122E-07 -14.2000 5.9904399E-08 -14.1000 2.4493107E-08 -14.0000 1.5283473E-08 -13.9000 1.1648094E-08 -13.8000 9.9364996E-09 -13.7000 9.0844623E-09 -13.6000 8.6890862E-09 -13.5000 8.5696113E-09 -13.4000 8.6366065E-09 -13.3000 8.8468261E-09 -13.2000 9.1745352E-09 -13.1000 9.6067838E-09 -13.0000 1.0138506E-08 -12.9000 1.0769622E-08 -12.8000 1.1504519E-08 -12.7000 1.2347154E-08 -12.6000 1.3309579E-08 -12.5000 1.4406726E-08 -12.4000 1.5653130E-08 -12.3000 1.7067143E-08 -12.2000 1.8671169E-08 -12.1000 2.0491280E-08 -12.0000 2.2559559E-08 -11.9000 2.4913632E-08 -11.8000 2.7597596E-08 -11.7000 3.0664119E-08 -11.6000 3.4181042E-08 -11.5000 3.8218078E-08 -11.4000 4.2863402E-08 -11.3000 4.8225521E-08 -11.2000 5.4431893E-08 -11.1000 6.1639041E-08 -11.0000 7.0034673E-08 -10.9000 7.9845707E-08 -10.8000 9.1355648E-08 -10.7000 1.0490970E-07 -10.6000 1.2093368E-07 -10.5000 1.3995673E-07 -10.4000 1.6263749E-07 -10.3000 1.8980165E-07 -10.2000 2.2250966E-07 -10.1000 2.6209107E-07 -10.0000 3.1025965E-07 -9.90000 3.6920945E-07 -9.80000 4.4181932E-07 -9.70000 5.3193564E-07 -9.60000 6.4467432E-07 -9.50000 7.8697941E-07 -9.40000 9.6851067E-07 -9.30000 1.2029301E-06 -9.20000 1.5101794E-06 -9.10000 1.9200180E-06 -9.00000 2.4781067E-06 -8.90000 3.2561154E-06 -8.80000 4.3684894E-06 -8.70000 6.0003929E-06 -8.60000 8.4531389E-06 -8.50000 1.2218168E-05 -8.40000 1.8098158E-05 -8.30000 2.7392005E-05 -8.20000 4.2152983E-05 -8.10000 6.5536325E-05 -8.00000 1.0277814E-04 -7.90000 1.7134483E-04 -7.80000 1.4716304E-03 -7.70000 6.4672194E-04 -7.60000 1.5485495E-03 -7.50000 1.3825493E-02 -7.40000 3.0449349E-02 -7.30000 6.1757621E-02 -7.20000 6.7117241E-02 -7.10000 2.2797953E-02 -7.00000 1.8884689E-02 -6.90000 2.7434007E-02 -6.80000 1.0211350E-02 -6.70000 2.1953769E-02 -6.60000 2.8417486E-02 -6.50000 3.1229235E-02 -6.40000 9.2618452E-02 -6.30000 2.6993004E-02 -6.20000 4.7541122E-02 -6.10000 1.5306221E-02 -6.00000 2.9217537E-02 -5.90000 1.0705096E-02 -5.80000 2.3204907E-02 -5.70000 3.6881117E-02 -5.60000 9.4179955E-02 -5.50000 3.8029322E-02 -5.40000 1.3180055E-02 -5.30000 5.6335257E-03 -5.20000 3.2666869E-03 -5.10000 3.1275363E-03 -5.00000 2.0640330E-03 -4.90000 5.2579264E-03 -4.80000 5.2635219E-03 -4.70000 7.7732464E-03 -4.60000 1.5916162E-02 -4.50000 2.0074912E-02 -4.40000 2.3528325E-02 -4.30000 1.9760218E-02 -4.20000 1.5082155E-02 -4.10000 1.5997230E-02 -4.00000 2.4121983E-02 -3.90000 2.9678580E-02 -3.80000 3.3406917E-02 -3.70000 3.6613065E-02 -3.60000 3.4163980E-02 -3.50000 2.9631362E-02 -3.40000 3.2505254E-02 -3.30000 3.0981012E-02 -3.20000 2.9563649E-02 -3.10000 3.1060981E-02 -3.00000 3.5405036E-02 -2.90000 2.8977155E-02 -2.80000 4.5308202E-02 -2.70000 4.3071222E-02 -2.60000 2.6772926E-02 -2.50000 1.6401837E-02 -2.40000 1.6134179E-02 -2.30000 9.9941849E-03 -2.20000 6.8796078E-03 -2.10000 6.1688570E-03 -2.00000 4.1781812E-03 -1.90000 3.3189223E-03 -1.80000 2.1332537E-03 -1.70000 1.3072750E-03 -1.60000 1.0013371E-03 -1.50000 7.8026005E-04 -1.40000 6.4828383E-04 -1.30000 5.6816582E-04 -1.20000 5.1220813E-04 -1.10000 4.7024191E-04 -1.00000 4.3778511E-04 -0.90000 4.1238872E-04 -0.80000 3.9252250E-04 -0.70000 3.7715841E-04 -0.60000 3.6559194E-04 -0.50000 3.5732912E-04 -0.40000 3.5203321E-04 -0.30000 3.4948387E-04 -0.20000 3.4955951E-04 -0.10000 3.5222188E-04 -0.00000 3.5738827E-04 0.10000 3.6546687E-04 0.20000 3.7649878E-04 0.30000 3.9077839E-04 0.40000 4.0870337E-04 0.50000 4.3079674E-04 0.60000 4.5774178E-04 0.70000 4.8503179E-04 0.80000 5.2467261E-04 0.90000 5.7265620E-04 1.00000 6.3089650E-04 1.10000 7.0190546E-04 1.20000 7.8902475E-04 1.30000 8.9674765E-04 1.40000 1.0319892E-03 1.50000 1.2012969E-03 1.60000 1.4158717E-03 1.70000 1.6897528E-03 1.80000 2.0413099E-03 1.90000 2.4936278E-03 2.00000 3.0734988E-03 2.10000 3.8069625E-03 2.20000 4.7085648E-03 2.30000 5.7623564E-03 2.40000 6.8997597E-03 2.50000 7.9947584E-03 2.60000 8.9020359E-03 2.70000 9.5308539E-03 2.80000 9.8956011E-03 2.90000 1.0098524E-02 3.00000 1.0251477E-02 3.10000 1.0516374E-02 3.20000 1.0970236E-02 3.30000 1.1681961E-02 3.40000 1.2695839E-02 3.50000 1.4033263E-02 3.60000 1.5710315E-02 3.70000 1.7786792E-02 3.80000 2.0437469E-02 3.90000 2.4007940E-02 4.00000 2.9013820E-02 4.10000 3.6015445E-02 4.20000 4.5190136E-02 4.30000 5.5646161E-02 4.40000 6.5468348E-02 4.50000 7.2639052E-02 4.60000 7.5307070E-02 4.70000 7.2630656E-02 4.80000 6.6128963E-02 4.90000 5.8441715E-02 5.00000 5.1337867E-02 5.10000 4.5426405E-02 5.20000 4.0738126E-02 5.30000 3.7178276E-02 5.40000 3.4781021E-02 5.50000 3.3892463E-02 5.60000 3.5270097E-02 5.70000 3.9498942E-02 5.80000 4.4081450E-02 5.90000 4.3137710E-02 6.00000 3.7573386E-02 6.10000 3.2386222E-02 6.20000 2.9288779E-02 6.30000 2.8209100E-02 6.40000 2.8905265E-02 6.50000 3.1269091E-02 6.60000 3.5271861E-02 6.70000 4.0665936E-02 6.80000 4.7259738E-02 6.90000 5.5512932E-02 7.00000 6.5177899E-02 7.10000 6.2480388E-02 7.20000 5.7333889E-02 7.30000 5.1296452E-02 7.40000 4.7892983E-02 7.50000 4.7718308E-02 7.60000 5.0327068E-02 7.70000 5.2646539E-02 7.80000 5.2690707E-02 7.90000 5.2051911E-02 8.00000 5.2035466E-02 8.10000 5.3418154E-02 8.20000 5.6664366E-02 8.30000 6.1742997E-02 8.40000 6.7607029E-02 8.50000 7.2262824E-02 8.60000 7.3515467E-02 8.70000 7.1324357E-02 8.80000 6.7611242E-02 8.90000 6.4232555E-02 9.00000 6.2048561E-02 9.10000 6.1213821E-02 9.20000 6.1593946E-02 9.30000 6.2968927E-02 9.40000 6.5109213E-02 9.50000 6.7841799E-02 9.60000 7.1143217E-02 9.70000 7.5204854E-02 9.80000 8.0387388E-02 9.90000 8.7053530E-02 10.0000 9.5322103E-02 10.1000 1.0485233E-01 10.2000 1.1480279E-01 10.3000 1.2404729E-01 10.4000 1.3171170E-01 10.5000 1.3700184E-01 10.6000 1.3986949E-01 10.7000 1.4023572E-01 10.8000 1.3792193E-01 10.9000 1.3285805E-01 11.0000 1.2545307E-01 11.1000 1.1665540E-01 11.2000 1.0758543E-01 11.3000 9.9110554E-02 11.4000 9.1680567E-02 11.5000 8.5411963E-02 11.6000 8.0248458E-02 11.7000 7.6086632E-02 11.8000 7.2842561E-02 11.9000 7.0478433E-02 12.0000 6.8997875E-02 12.1000 6.8426768E-02 12.2000 6.8783757E-02 12.3000 7.0041220E-02 12.4000 7.2064377E-02 12.5000 7.4537997E-02 12.6000 7.6910658E-02 12.7000 7.8528823E-02 12.8000 7.8926919E-02 12.9000 7.8119146E-02 13.0000 7.6542542E-02 13.1000 7.4717830E-02 13.2000 7.2971568E-02 13.3000 7.1384793E-02 13.4000 6.9876548E-02 13.5000 6.8307815E-02 13.6000 6.6559424E-02 13.7000 6.4567955E-02 13.8000 6.2330647E-02 13.9000 5.9892290E-02 14.0000 5.7323909E-02 14.1000 5.4703623E-02 14.2000 5.2104479E-02 14.3000 4.9587062E-02 14.4000 4.7197350E-02 14.5000 4.4967478E-02 14.6000 4.2918001E-02 14.7000 4.1050073E-02 14.8000 3.9386918E-02 14.9000 3.7915781E-02 15.0000 3.6629311E-02 15.1000 3.5517300E-02 15.2000 3.4567390E-02 15.3000 3.3765779E-02 15.4000 3.3098365E-02 15.5000 3.2551589E-02 15.6000 3.2112842E-02 15.7000 3.1770839E-02 15.8000 3.1515913E-02 15.9000 3.1339807E-02 16.0000 3.1235731E-02 16.1000 3.1197916E-02 16.2000 3.1221557E-02 16.3000 3.1302538E-02 16.4000 3.1437283E-02 16.5000 3.1622416E-02 16.6000 3.1854679E-02 16.7000 3.2130998E-02 16.8000 3.2448684E-02 16.9000 3.2804821E-02 17.0000 3.3196533E-02 17.1000 3.3618088E-02 17.2000 3.4072893E-02 17.3000 3.4556647E-02 17.4000 3.5068473E-02 17.5000 3.5607965E-02 17.6000 3.6175675E-02 17.7000 3.6772782E-02 17.8000 3.7418515E-02 17.9000 3.8076770E-02 18.0000 3.8770944E-02 18.1000 3.9503435E-02 18.2000 4.0276020E-02 18.3000 4.1089058E-02 18.4000 4.1942941E-02 18.5000 4.2836916E-02 18.6000 4.3769488E-02 18.7000 4.4738465E-02 18.8000 4.5740173E-02 18.9000 4.6771072E-02 19.0000 4.7828679E-02 19.1000 4.8911933E-02 19.2000 5.0019254E-02 19.3000 5.1149032E-02 19.4000 5.2299506E-02 19.5000 5.3468902E-02 19.6000 5.4650625E-02 19.7000 5.5836720E-02 19.8000 5.7016791E-02 19.9000 5.8181040E-02 20.0000 5.9318993E-02 20.1000 6.0424058E-02 20.2000 6.1491428E-02 20.3000 6.2516883E-02 20.4000 6.3491985E-02 20.5000 6.4394061E-02 20.6000 6.5178962E-02 20.7000 6.5776060E-02 20.8000 6.6096545E-02 20.9000 6.6058268E-02 21.0000 6.5619979E-02 21.1000 6.4802267E-02 21.2000 6.3684172E-02 21.3000 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