# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2026--Park-J-H-Jo-H-J-Ahn-H-H-et-al--Fe-Cu-Pb # implementation = 2026--Park-J-H--Fe-Cu-Pb--LAMMPS--ipr1 # composition = CuPb3 # 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 2026-06-16 r A15--Cr3Si D0_3--BiF3 L1_2--AuCu3 0.50 nan nan nan 0.52 nan nan nan 0.54 nan nan nan 0.56 nan nan nan 0.58 nan nan nan 0.60 nan nan nan 0.62 nan nan nan 0.64 nan nan nan 0.66 nan nan nan 0.68 nan nan nan 0.70 nan nan nan 0.72 nan nan nan 0.74 nan nan nan 0.76 nan nan nan 0.78 8.248645561e+02 nan nan 0.80 7.781364911e+02 nan nan 0.82 7.339714897e+02 nan nan 0.84 6.922319858e+02 1.133332583e+03 nan 0.86 6.527876600e+02 1.071988417e+03 8.448061725e+02 0.88 6.155150654e+02 1.013856079e+03 7.995514910e+02 0.90 5.802972722e+02 9.587714869e+02 7.566203208e+02 0.92 5.470235302e+02 9.065787671e+02 7.158971496e+02 0.94 5.155889489e+02 8.571298557e+02 6.772720527e+02 0.96 4.858941929e+02 8.102841124e+02 6.406404297e+02 0.98 4.578451939e+02 7.659079554e+02 6.059027524e+02 1.00 4.313528762e+02 7.238745136e+02 5.729643249e+02 1.02 4.063328973e+02 6.840632958e+02 5.417350547e+02 1.04 3.827054004e+02 6.463598758e+02 5.121292342e+02 1.06 3.603947811e+02 6.106555925e+02 4.840653329e+02 1.08 3.393294644e+02 5.768472654e+02 4.574657982e+02 1.10 3.194416944e+02 5.448369232e+02 4.322568669e+02 1.12 3.006673336e+02 5.145315455e+02 4.083683839e+02 1.14 2.829456740e+02 4.858428181e+02 3.857336310e+02 1.16 2.662192561e+02 4.586868987e+02 3.642891620e+02 1.18 2.504336987e+02 4.329841956e+02 3.439746468e+02 1.20 2.355375364e+02 4.086591559e+02 3.247327221e+02 1.22 2.214820664e+02 3.856400648e+02 3.065088495e+02 1.24 2.082212023e+02 3.638588546e+02 2.892511798e+02 1.26 1.957113360e+02 3.432509227e+02 2.729104239e+02 1.28 1.839112069e+02 3.237549589e+02 2.574397298e+02 1.30 1.727817771e+02 3.053127809e+02 2.427945654e+02 1.32 1.622861139e+02 2.878691782e+02 2.289326065e+02 1.34 1.523892783e+02 2.713717632e+02 2.158136305e+02 1.36 1.430582183e+02 2.557708299e+02 2.033994147e+02 1.38 1.342616695e+02 2.410192196e+02 1.916536396e+02 1.40 1.259700593e+02 2.270721931e+02 1.805417971e+02 1.42 1.181554167e+02 2.138873089e+02 1.700311022e+02 1.44 1.107912875e+02 2.014243082e+02 1.600904097e+02 1.46 1.038526526e+02 1.896450047e+02 1.506901342e+02 1.48 9.731585173e+01 1.785131801e+02 1.418021745e+02 1.50 9.115851051e+01 1.679944855e+02 1.333998413e+02 1.52 8.535947182e+01 1.580563463e+02 1.254577879e+02 1.54 7.989873044e+01 1.486678731e+02 1.179519452e+02 1.56 7.475737132e+01 1.397997760e+02 1.108594586e+02 1.58 6.991751104e+01 1.314242843e+02 1.041586290e+02 1.60 6.536224245e+01 1.235150686e+02 9.782885603e+01 1.62 6.107558213e+01 1.160471685e+02 9.185058383e+01 1.64 5.704242077e+01 1.089969226e+02 8.620524994e+01 1.66 5.324847605e+01 1.023419027e+02 8.087523634e+01 1.68 4.968024817e+01 9.606085081e+01 7.584382281e+01 1.70 4.632497763e+01 9.013361968e+01 7.109514263e+01 1.72 4.317060531e+01 8.454111607e+01 6.661414042e+01 1.74 4.020573471e+01 7.926524696e+01 6.238653185e+01 1.76 3.741959612e+01 7.428886840e+01 5.839876554e+01 1.78 3.480201280e+01 6.959573693e+01 5.463798655e+01 1.80 3.234336894e+01 6.517046344e+01 5.109200181e+01 1.82 3.003457926e+01 6.099846934e+01 4.774924710e+01 1.84 2.786706038e+01 5.706594495e+01 4.459875573e+01 1.86 2.583270357e+01 5.335980992e+01 4.163012868e+01 1.88 2.392384910e+01 4.986767574e+01 3.883350616e+01 1.90 2.213326186e+01 4.657781004e+01 3.619954065e+01 1.92 2.045410836e+01 4.347910273e+01 3.371937113e+01 1.94 1.887993491e+01 4.056103389e+01 3.138459868e+01 1.96 1.740464702e+01 3.781364317e+01 2.918726317e+01 1.98 1.602248985e+01 3.522750091e+01 2.711982120e+01 2.00 1.472802979e+01 3.279368051e+01 2.517512496e+01 2.02 1.351613694e+01 3.050373238e+01 2.334640232e+01 2.04 1.238196861e+01 2.834965912e+01 2.162723772e+01 2.06 1.132095365e+01 2.632389199e+01 2.001155412e+01 2.08 1.032877764e+01 2.441926855e+01 1.849359577e+01 2.10 9.401368906e+00 2.262901146e+01 1.706791184e+01 2.12 8.534885229e+00 2.094670839e+01 1.572934091e+01 2.14 7.725701327e+00 1.936629287e+01 1.447299612e+01 2.16 6.970396977e+00 1.788202619e+01 1.329425120e+01 2.18 6.265745777e+00 1.648848021e+01 1.218872702e+01 2.20 5.608704530e+00 1.518052103e+01 1.115227897e+01 2.22 4.996403177e+00 1.395329354e+01 1.018098484e+01 2.24 4.426135292e+00 1.280220668e+01 9.271133393e+00 2.26 3.895349073e+00 1.172291955e+01 8.419213458e+00 2.28 3.401638829e+00 1.071132819e+01 7.621903578e+00 2.30 2.942736913e+00 9.763553036e+00 6.876062175e+00 2.32 2.516506107e+00 8.875927017e+00 6.178718218e+00 2.34 2.120932400e+00 8.044984312e+00 5.527062344e+00 2.36 1.754118163e+00 7.267449631e+00 4.918438434e+00 2.38 1.414275697e+00 6.540228091e+00 4.350335609e+00 2.40 1.099721118e+00 5.860395589e+00 3.820380628e+00 2.42 8.088685807e-01 5.225189697e+00 3.326330678e+00 2.44 5.402248128e-01 4.632001009e+00 2.866066510e+00 2.46 2.923839417e-01 4.078364962e+00 2.437585951e+00 2.48 6.402260397e-02 3.561954054e+00 2.038997712e+00 2.50 -1.461046805e-01 3.080570495e+00 1.668515538e+00 2.52 -3.391698848e-01 2.632139224e+00 1.324452637e+00 2.54 -5.162756124e-01 2.214701299e+00 1.005216408e+00 2.56 -6.784590104e-01 1.826407626e+00 7.093034228e-01 2.58 -8.266954703e-01 1.465513028e+00 4.352946781e-01 2.60 -9.619021258e-01 1.130370616e+00 1.818510828e-01 2.62 -1.084941162e+00 8.194264570e-01 -5.229082269e-02 2.64 -1.196622941e+00 5.312145260e-01 -2.683229210e-01 2.66 -1.297708959e+00 2.643519214e-01 -4.673693724e-01 2.68 -1.388914641e+00 1.753433612e-02 -6.504902611e-01 2.70 -1.470911981e+00 -2.104682375e-01 -8.186850620e-01 2.72 -1.544332036e+00 -4.208155686e-01 -9.728959196e-01 2.74 -1.609767288e+00 -6.146010396e-01 -1.114010764e+00 2.76 -1.667773870e+00 -7.928552886e-01 -1.242866257e+00 2.78 -1.718873670e+00 -9.565496615e-01 -1.360249938e+00 2.80 -1.763556321e+00 -1.106599479e+00 -1.466861519e+00 2.82 -1.802281080e+00 -1.243867126e+00 -1.563254826e+00 2.84 -1.835478599e+00 -1.369164988e+00 -1.650336747e+00 2.86 -1.863552602e+00 -1.483258208e+00 -1.728734577e+00 2.88 -1.886881466e+00 -1.586867325e+00 -1.798975324e+00 2.90 -1.905819713e+00 -1.680670741e+00 -1.861606383e+00 2.92 -1.920699421e+00 -1.765307080e+00 -1.917142639e+00 2.94 -1.931831550e+00 -1.841377403e+00 -1.966068278e+00 2.96 -1.939507202e+00 -1.909447316e+00 -2.008838496e+00 2.98 -1.943998801e+00 -1.970048952e+00 -2.045881123e+00 3.00 -1.945561213e+00 -2.023682856e+00 -2.077598158e+00 3.02 -1.944432795e+00 -2.070819764e+00 -2.104367227e+00 3.04 -1.940836394e+00 -2.111902283e+00 -2.126542951e+00 3.06 -1.934980280e+00 -2.147346485e+00 -2.144458258e+00 3.08 -1.927059031e+00 -2.177543406e+00 -2.158425606e+00 3.10 -1.917254364e+00 -2.202860476e+00 -2.168738155e+00 3.12 -1.905735922e+00 -2.223642854e+00 -2.175670868e+00 3.14 -1.892662008e+00 -2.240214708e+00 -2.179481554e+00 3.16 -1.878180290e+00 -2.252880407e+00 -2.180411854e+00 3.18 -1.862428448e+00 -2.261925664e+00 -2.178688175e+00 3.20 -1.845534797e+00 -2.267618603e+00 -2.174522571e+00 3.22 -1.827618868e+00 -2.270210774e+00 -2.168113579e+00 3.24 -1.808791952e+00 -2.269938111e+00 -2.159647004e+00 3.26 -1.789157621e+00 -2.267021837e+00 -2.149296663e+00 3.28 -1.768812209e+00 -2.261669314e+00 -2.137225094e+00 3.30 -1.747845268e+00 -2.254074854e+00 -2.123584215e+00 3.32 -1.726339998e+00 -2.244420479e+00 -2.108515956e+00 3.34 -1.704373650e+00 -2.232876639e+00 -2.092152848e+00 3.36 -1.682017905e+00 -2.219602893e+00 -2.074618587e+00 3.38 -1.659339230e+00 -2.204748447e+00 -2.056028559e+00 3.40 -1.636399212e+00 -2.187755813e+00 -2.036490343e+00 3.42 -1.613254874e+00 -2.161570727e+00 -2.016104178e+00 3.44 -1.589958967e+00 -2.108286911e+00 -1.994963410e+00 3.46 -1.566560250e+00 -2.028080723e+00 -1.973154911e+00 3.48 -1.543103745e+00 -2.001281277e+00 -1.950759472e+00 3.50 -1.519344878e+00 -1.977910600e+00 -1.927852179e+00 3.52 -1.480869273e+00 -1.953947103e+00 -1.904502763e+00 3.54 -1.363879548e+00 -1.929467116e+00 -1.880775934e+00 3.56 -1.053619940e+00 -1.904541660e+00 -1.856731689e+00 3.58 -6.860749599e-01 -1.879236760e+00 -1.832425611e+00 3.60 -6.740143911e-01 -1.853613751e+00 -1.807909142e+00 3.62 -6.619432398e-01 -1.827729560e+00 -1.783229849e+00 3.64 -6.498792585e-01 -1.801636974e+00 -1.758431668e+00 3.66 -6.378388438e-01 -1.775384898e+00 -1.733555133e+00 3.68 -6.258371145e-01 -1.749018589e+00 -1.708637599e+00 3.70 -6.138879863e-01 -1.722579883e+00 -1.683713445e+00 3.72 -6.020042422e-01 -1.696107411e+00 -1.658814265e+00 3.74 -5.901975993e-01 -1.669636794e+00 -1.633969055e+00 3.76 -5.784787728e-01 -1.643200838e+00 -1.609204379e+00 3.78 -5.668575355e-01 -1.616829706e+00 -1.584544530e+00 3.80 -5.553427755e-01 -1.590551093e+00 -1.560011684e+00 3.82 -5.439425502e-01 -1.564390376e+00 -1.535626041e+00 3.84 -5.326641372e-01 -1.538370773e+00 -1.511405956e+00 3.86 -5.215140834e-01 -1.512513473e+00 -1.487368067e+00 3.88 -5.104982508e-01 -1.486837776e+00 -1.463527411e+00 3.90 -4.996218599e-01 -1.461361213e+00 -1.439897534e+00 3.92 -4.878618376e-01 -1.433448304e+00 -1.413892029e+00 3.94 -4.621209910e-01 -1.368835755e+00 -1.351874951e+00 3.96 -3.874760091e-01 -1.170973562e+00 -1.158659625e+00 3.98 -2.153005506e-01 -6.796190892e-01 -6.745590806e-01 4.00 -1.694792699e-22 -3.896178687e-22 -2.907160389e-22 4.02 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.04 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.06 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.08 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.10 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.12 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.14 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.16 0.000000000e+00 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