# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2023--Daw-M-S-Chandross-M--Cu # implementation = 2023--Daw-M-S--Cu--LAMMPS--ipr1 # composition = Cu # NOTE: These values are for static, unrelaxed structures and use the ideal # b/a and c/a ratios for the crystal structure, not the potential-specific # values. # Calculations from the NIST Interatomic Potential Repository Project: # http://www.ctcms.nist.gov/potentials/ # Table generated 2026-08-31 r A1--Cu--fcc A15--beta-W A2--W--bcc A3'--alpha-La--d A3--Mg--hcp A4--C--dc A5--beta-Sn A6--In--bct A7--alpha-As Ah--alpha-Po--sc 0.50 nan nan nan nan nan nan nan nan nan nan 0.52 nan nan nan nan nan nan nan nan nan nan 0.54 nan nan nan nan nan nan nan nan nan nan 0.56 nan nan nan nan nan nan nan nan nan nan 0.58 nan nan nan nan nan nan nan nan nan nan 0.60 nan nan nan nan nan nan nan nan nan nan 0.62 nan nan nan nan nan 1.672767301e+05 nan nan nan nan 0.64 nan nan nan nan nan 1.499166074e+05 nan nan nan nan 0.66 nan nan nan nan nan 1.346175931e+05 nan nan 1.582624903e+05 nan 0.68 nan nan nan nan nan 1.210836771e+05 nan nan 1.426347886e+05 nan 0.70 nan nan nan nan nan 1.090715291e+05 nan nan 1.287601160e+05 nan 0.72 nan 1.633865527e+05 nan nan nan 9.837434907e+04 1.661231566e+05 nan 1.164014274e+05 1.635392509e+05 0.74 nan 1.485562218e+05 nan nan nan 8.881813003e+04 1.510842348e+05 nan 1.053597471e+05 1.487095865e+05 0.76 nan 1.352618735e+05 nan nan nan 8.025623186e+04 1.375985973e+05 nan 9.546290794e+04 1.354158804e+05 0.78 nan 1.233089709e+05 1.674490944e+05 nan nan 7.256258786e+04 1.254733500e+05 1.725253131e+05 8.656757049e+04 1.234663541e+05 0.80 1.691867677e+05 1.125335365e+05 1.533991694e+05 1.691881543e+05 1.691888754e+05 6.563272956e+04 1.145440683e+05 1.581007938e+05 7.855379956e+04 1.126938605e+05 0.82 1.553468513e+05 1.027961755e+05 1.406991290e+05 1.553492939e+05 1.553499218e+05 5.937552091e+04 1.046691085e+05 1.450627006e+05 7.131641668e+04 1.029591147e+05 0.84 1.428061524e+05 9.397651973e+04 1.291932531e+05 1.428070144e+05 1.428071928e+05 5.371532336e+04 9.572400810e+04 1.332484457e+05 6.476526393e+04 9.414138779e+04 0.86 1.314158453e+05 8.596957391e+04 1.187446112e+05 1.314144945e+05 1.314142242e+05 4.858363983e+04 8.760291821e+04 1.225180708e+05 5.882243102e+04 8.613687952e+04 0.88 1.210477819e+05 7.868571723e+04 1.092335341e+05 1.210457411e+05 1.210454680e+05 4.391861141e+04 8.021460426e+04 1.127506722e+05 5.341958153e+04 7.885349727e+04 0.90 1.115897639e+05 7.204612302e+04 1.005568153e+05 1.115894703e+05 1.115900534e+05 3.966887076e+04 7.347938171e+04 1.038417533e+05 4.849647440e+04 7.221301550e+04 0.92 1.029444668e+05 6.598113886e+04 9.262872772e+04 1.029467882e+05 1.029478607e+05 3.579104759e+04 6.732622008e+04 9.570114902e+04 4.400196446e+04 6.614998966e+04 0.94 9.503007160e+04 6.043145611e+04 8.537240027e+04 9.503299226e+04 9.503379174e+04 3.224628772e+04 6.169572369e+04 8.824982363e+04 3.989185773e+04 6.060297741e+04 0.96 8.777352148e+04 5.534448182e+04 7.871941401e+04 8.777469385e+04 8.777515062e+04 2.900100810e+04 5.653473181e+04 8.141687254e+04 3.612677443e+04 5.551812477e+04 0.98 8.110647567e+04 5.067328823e+04 7.260636568e+04 8.110589787e+04 8.110582315e+04 2.602435037e+04 5.179641068e+04 7.513914638e+04 3.267268890e+04 5.085042673e+04 1.00 7.497046205e+04 4.637824205e+04 6.698190909e+04 7.496815315e+04 7.496773902e+04 2.329012426e+04 4.743977200e+04 6.936146088e+04 2.949912566e+04 4.655687763e+04 1.02 6.931303533e+04 4.242206216e+04 6.179790781e+04 6.931095288e+04 6.931061615e+04 2.077492210e+04 4.342791252e+04 6.403508017e+04 2.657894625e+04 4.260053175e+04 1.04 6.408981218e+04 3.877264072e+04 5.701242808e+04 6.408972891e+04 6.408980815e+04 1.845699290e+04 3.972661664e+04 5.911872923e+04 2.388803173e+04 3.894992074e+04 1.06 5.926114350e+04 3.540101980e+04 5.258925915e+04 5.926287910e+04 5.926343699e+04 1.631829237e+04 3.630587866e+04 5.457509441e+04 2.140473396e+04 3.557801774e+04 1.08 5.479147466e+04 3.228319552e+04 4.849420908e+04 5.479404265e+04 5.479517980e+04 1.434289297e+04 3.314095238e+04 5.036970256e+04 1.911000448e+04 3.246035966e+04 1.10 5.064921782e+04 2.939596241e+04 4.469920077e+04 5.065151780e+04 5.065275286e+04 1.251659837e+04 3.020959176e+04 4.647258295e+04 1.698693084e+04 2.957399956e+04 1.12 4.680522620e+04 2.671889086e+04 4.117940308e+04 4.680659652e+04 4.680745174e+04 1.082683161e+04 2.749169144e+04 4.285671024e+04 1.502008034e+04 2.689762230e+04 1.14 4.323420646e+04 2.423371840e+04 3.791090766e+04 4.323415585e+04 4.323447756e+04 9.261579286e+03 2.496885509e+04 3.949787984e+04 1.319571776e+04 2.441304002e+04 1.16 3.991252962e+04 2.192327628e+04 3.487091615e+04 3.991126403e+04 3.991117271e+04 7.809301901e+03 2.262400256e+04 3.637343654e+04 1.150105112e+04 2.210412800e+04 1.18 3.681822096e+04 1.977330206e+04 3.203959249e+04 3.681675780e+04 3.681641488e+04 6.459095108e+03 2.044256189e+04 3.346336202e+04 9.925270575e+03 1.995620019e+04 1.20 3.393268181e+04 1.777135838e+04 2.940040431e+04 3.393153668e+04 3.393102257e+04 5.202574816e+03 1.841137097e+04 3.075009696e+04 8.459045200e+03 1.795543731e+04 1.22 3.123933016e+04 1.590491842e+04 2.693753399e+04 3.123842130e+04 3.123786326e+04 4.035183534e+03 1.651801711e+04 2.821754637e+04 7.093565750e+03 1.608977635e+04 1.24 2.872210994e+04 1.416279418e+04 2.463571573e+04 2.872194397e+04 2.872167117e+04 3.078123532e+03 1.475129084e+04 2.585132614e+04 5.820992091e+03 1.434737282e+04 1.26 2.636782156e+04 1.253572209e+04 2.248293174e+04 2.636855473e+04 2.636887107e+04 2.349871847e+03 1.310044608e+04 2.363865140e+04 4.634060207e+03 1.271896606e+04 1.28 2.416432537e+04 1.101480031e+04 2.046819303e+04 2.416580427e+04 2.416664493e+04 1.795143246e+03 1.155605556e+04 2.156827288e+04 3.565235613e+03 1.119613217e+04 1.30 2.210030631e+04 9.591114819e+03 1.858165984e+04 2.210212368e+04 2.210327816e+04 1.372295316e+03 1.011008472e+04 1.962926980e+04 2.734243000e+03 9.771323134e+03 1.32 2.016447389e+04 8.257580511e+03 1.681375562e+04 2.016671966e+04 2.016806123e+04 1.049766916e+03 8.755498293e+03 1.781165501e+04 2.097834443e+03 8.437605483e+03 1.34 1.834790204e+04 7.007941279e+03 1.515501269e+04 1.835014062e+04 1.835143771e+04 8.035178952e+02 7.485898242e+03 1.610670151e+04 1.610040549e+03 7.188386031e+03 1.36 1.664244848e+04 5.836401730e+03 1.359769209e+04 1.664412130e+04 1.664517118e+04 6.153920790e+02 6.294945566e+03 1.450613731e+04 1.235802540e+03 6.016330053e+03 1.38 1.504059872e+04 4.736858580e+03 1.213463679e+04 1.504086629e+04 1.504149149e+04 4.715592380e+02 5.177011077e+03 1.300233635e+04 9.485348636e+02 4.915940296e+03 1.40 1.353416365e+04 3.724539328e+03 1.075895607e+04 1.353298958e+04 1.353313887e+04 3.614725733e+02 4.127367723e+03 1.158790265e+04 7.279785727e+02 3.890755932e+03 1.42 1.211536928e+04 2.912209905e+03 9.464898310e+03 1.211360264e+04 1.211335750e+04 2.772112291e+02 3.235449739e+03 1.025629430e+04 5.585413286e+02 3.050567539e+03 1.44 1.077858406e+04 2.277209783e+03 8.247146300e+03 1.077671953e+04 1.077615452e+04 2.127162100e+02 2.536947123e+03 9.001959779e+03 4.283471646e+02 2.392350932e+03 1.46 9.518070029e+03 1.780587749e+03 7.100117442e+03 9.516629891e+03 9.515941233e+03 1.633485182e+02 1.989410280e+03 7.819622963e+03 3.283186993e+02 1.876393179e+03 1.48 8.328724605e+03 1.392034995e+03 6.017930290e+03 8.327958636e+03 8.327276455e+03 1.255245653e+02 1.559759607e+03 6.704582770e+03 2.514596108e+02 1.471777274e+03 1.50 7.206140701e+03 1.087833089e+03 4.995924292e+03 7.205913684e+03 7.205271336e+03 9.652935697e+01 1.222571681e+03 5.652205383e+03 1.924030488e+02 1.154405936e+03 1.52 6.145876121e+03 8.495367987e+02 4.032740529e+03 6.146103303e+03 6.145572949e+03 7.430377555e+01 9.579535725e+02 4.658338912e+03 1.470571992e+02 9.053191673e+02 1.54 5.143711586e+03 6.628946494e+02 3.216858953e+03 5.144462932e+03 5.144163514e+03 5.726173124e+01 7.503041743e+02 3.738857699e+03 1.122632760e+02 7.097067845e+02 1.56 4.196171059e+03 5.167716028e+02 2.565915292e+03 4.197410612e+03 4.197448057e+03 4.418371473e+01 5.873728930e+02 2.988593124e+03 8.557528680e+01 5.561123383e+02 1.58 3.368664395e+03 4.024280658e+02 2.046467375e+03 3.369877797e+03 3.370275479e+03 3.414268950e+01 4.595134179e+02 2.389074959e+03 6.511276913e+01 4.355312420e+02 1.60 2.704551304e+03 3.130033608e+02 1.631901709e+03 2.705677502e+03 2.706384308e+03 2.642636863e+01 3.591885803e+02 1.909660574e+03 4.943384122e+01 3.408197618e+02 1.62 2.171312054e+03 2.431099955e+02 1.301018944e+03 2.172287999e+03 2.173155506e+03 2.048772138e+01 2.804942296e+02 1.526165288e+03 3.742863094e+01 2.664408494e+02 1.64 1.743078634e+03 1.884881559e+02 1.036923024e+03 1.743775806e+03 1.744602489e+03 1.590710568e+01 2.187579646e+02 1.219315876e+03 2.824342868e+01 2.080648096e+02 1.66 1.399127175e+03 1.458197304e+02 8.261408721e+02 1.399495245e+03 1.400169447e+03 1.236301225e+01 1.703510520e+02 9.737887042e+02 2.121942734e+01 1.622781393e+02 1.68 1.122664225e+03 1.125141285e+02 6.578169911e+02 1.122792981e+03 1.123293373e+03 9.608321387e+00 1.324204866e+02 7.772419580e+02 1.584850891e+01 1.263624228e+02 1.70 9.003178968e+02 8.654294050e+01 5.233470748e+02 9.003505013e+02 9.007023630e+02 7.455392890e+00 1.027128241e+02 6.199033564e+02 1.173936874e+01 9.819260498e+01 1.72 7.215418985e+02 6.631723418e+01 4.159700909e+02 7.215645762e+02 7.217926397e+02 5.762274065e+00 7.946332092e+01 4.939994684e+02 8.592914738e+00 7.612227027e+01 1.74 5.778438080e+02 5.058689265e+01 3.302704216e+02 5.778853486e+02 5.780126445e+02 4.420519582e+00 6.128033003e+01 3.932940314e+02 6.179294915e+00 5.884972982e+01 1.76 4.623836647e+02 3.836918191e+01 2.619099079e+02 4.624194315e+02 4.624666773e+02 3.347461374e+00 4.707121575e+01 3.127834430e+02 4.322949772e+00 4.534660564e+01 1.78 3.696408692e+02 2.888938244e+01 2.073860793e+02 3.696616827e+02 3.696523990e+02 2.480115194e+00 3.597616036e+01 2.484476694e+02 2.890054925e+00 3.479790520e+01 1.80 2.951725448e+02 2.154146120e+01 1.639061090e+02 2.951796684e+02 2.951367935e+02 1.771135171e+00 2.732396415e+01 1.970635513e+02 1.778505220e+00 2.656281103e+01 1.82 2.354119262e+02 1.585395898e+01 1.292656570e+02 2.354072599e+02 2.353465573e+02 1.184849863e+00 2.058555127e+01 1.560482334e+02 9.106228061e-01 2.014033325e+01 1.84 1.874838033e+02 1.145565612e+01 1.016950333e+02 1.874694858e+02 1.874015168e+02 6.941358000e-01 1.534348959e+01 1.233149902e+02 2.274970597e-01 1.513557278e+01 1.86 1.490707025e+02 8.057168324e+00 7.977408778e+01 1.490431744e+02 1.489747739e+02 2.784228866e-01 1.126895647e+01 9.720897035e+01 -3.153876564e-01 1.123771045e+01 1.88 1.183050431e+02 5.432470161e+00 6.236376496e+01 1.182600778e+02 1.181954437e+02 -7.785233517e-02 8.104382859e+00 7.639583023e+01 -7.514515884e-01 8.202503297e+00 1.90 9.366023141e+01 3.407563270e+00 4.855102240e+01 9.360588341e+01 9.355012516e+01 -3.864434325e-01 5.647610774e+00 5.981073785e+01 -1.105645168e+00 5.838367782e+00 1.92 7.391017365e+01 1.846704672e+00 3.760449790e+01 7.386220959e+01 7.382096749e+01 -6.562174719e-01 3.740255360e+00 4.660990329e+01 -1.396682699e+00 3.995321050e+00 1.94 5.810292382e+01 6.439770662e-01 2.893713528e+01 5.806870470e+01 5.804308709e+01 -8.938652596e-01 2.258496281e+00 3.611756307e+01 -1.638548828e+00 2.556198949e+00 1.96 4.546824090e+01 -2.830255376e-01 2.207566951e+01 4.544768147e+01 4.543408358e+01 -1.104445684e+00 1.105679921e+00 2.778986911e+01 -1.841616364e+00 1.429687493e+00 1.98 3.538313450e+01 -9.982151401e-01 1.665029338e+01 3.537460787e+01 3.536971495e+01 -1.291800713e+00 2.067853718e-01 2.118960058e+01 -2.013665895e+00 5.447982815e-01 2.00 2.734418144e+01 -1.550991178e+00 1.236301695e+01 2.734425599e+01 2.734545011e+01 -1.458705456e+00 -4.963310687e-01 1.596550048e+01 -2.160492061e+00 -1.535067726e-01 2.02 2.094499595e+01 -1.979395212e+00 8.978063964e+00 2.095009485e+01 2.095533182e+01 -1.607312058e+00 -1.048458748e+00 1.183491141e+01 -2.286407412e+00 -7.077763464e-01 2.04 1.585777606e+01 -2.312606334e+00 6.309444679e+00 1.586548117e+01 1.587318628e+01 -1.739426880e+00 -1.484185046e+00 8.573044289e+00 -2.394626901e+00 -1.150797671e+00 2.06 1.181756897e+01 -2.572911329e+00 4.208305069e+00 1.182654833e+01 1.183552769e+01 -1.856505168e+00 -1.830135675e+00 6.000315599e+00 -2.487473847e+00 -1.507586939e+00 2.08 8.612726825e+00 -2.777256828e+00 2.555750373e+00 8.622093423e+00 8.631460022e+00 -1.959747748e+00 -2.106728516e+00 3.973195592e+00 -2.566704266e+00 -1.797181162e+00 2.10 6.073516227e+00 -2.938469182e+00 1.257021669e+00 6.082571439e+00 6.091626651e+00 -2.050172563e+00 -2.329558326e+00 2.377188167e+00 -2.633630924e+00 -2.034192859e+00 2.12 4.063690931e+00 -3.066210610e+00 2.367742542e-01 4.071576612e+00 4.079462292e+00 -2.128667006e+00 -2.510487497e+00 1.121111824e+00 -2.689366298e+00 -2.229804718e+00 2.14 2.474084915e+00 -3.167686626e+00 -5.647470699e-01 2.480363655e+00 2.486642395e+00 -2.196025678e+00 -2.658503004e+00 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