# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2023--Daw-M-S-Chandross-M--Cu-Ag-Au-Ni-Pd-Pt # implementation = 2023--Daw-M-S--Cu-Ag-Au-Ni-Pd-Pt--LAMMPS--ipr1 # composition = Ag2NiPt # 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 L2_1--AlCu2Mn--h L2_1--AlCu2Mn--h 0.50 nan nan 0.52 nan nan 0.54 nan nan 0.56 nan nan 0.58 nan nan 0.60 nan nan 0.62 nan nan 0.64 nan nan 0.66 nan nan 0.68 nan nan 0.70 nan nan 0.72 nan nan 0.74 nan nan 0.76 nan nan 0.78 nan nan 0.80 nan nan 0.82 nan nan 0.84 nan nan 0.86 6.515788067e+06 6.515788067e+06 0.88 5.939517704e+06 5.939517704e+06 0.90 5.414163241e+06 5.414163241e+06 0.92 4.934328342e+06 4.934328342e+06 0.94 4.495231547e+06 4.495231547e+06 0.96 4.092723760e+06 4.092723760e+06 0.98 3.723112100e+06 3.723112100e+06 1.00 3.383149769e+06 3.383149769e+06 1.02 3.069983505e+06 3.069983505e+06 1.04 2.781112522e+06 2.781112522e+06 1.06 2.514277160e+06 2.514277160e+06 1.08 2.267492896e+06 2.267492896e+06 1.10 2.038936473e+06 2.038936473e+06 1.12 1.826991148e+06 1.826991148e+06 1.14 1.630225944e+06 1.630225944e+06 1.16 1.447332436e+06 1.447332436e+06 1.18 1.277152333e+06 1.277152333e+06 1.20 1.118637143e+06 1.118637143e+06 1.22 9.708304342e+05 9.708304342e+05 1.24 8.328878045e+05 8.328878045e+05 1.26 7.045167601e+05 7.045167601e+05 1.28 5.876566509e+05 5.876566509e+05 1.30 4.814403534e+05 4.814403534e+05 1.32 3.872732230e+05 3.872732230e+05 1.34 3.073893283e+05 3.073893283e+05 1.36 2.442730906e+05 2.442730906e+05 1.38 1.943747024e+05 1.943747024e+05 1.40 1.548592582e+05 1.548592582e+05 1.42 1.235202754e+05 1.235202754e+05 1.44 9.862735567e+04 9.862735567e+04 1.46 7.882677977e+04 7.882677977e+04 1.48 6.305823017e+04 6.305823017e+04 1.50 5.048461549e+04 5.048461549e+04 1.52 4.044706586e+04 4.044706586e+04 1.54 3.242661601e+04 3.242661601e+04 1.56 2.601197772e+04 2.601197772e+04 1.58 2.087665856e+04 2.087665856e+04 1.60 1.676227446e+04 1.676227446e+04 1.62 1.346344227e+04 1.346344227e+04 1.64 1.081657673e+04 1.081657673e+04 1.66 8.691124589e+03 8.691124589e+03 1.68 6.983428141e+03 6.983428141e+03 1.70 5.610979824e+03 5.610979824e+03 1.72 4.507757009e+03 4.507757009e+03 1.74 3.620752220e+03 3.620752220e+03 1.76 2.907452662e+03 2.907452662e+03 1.78 2.333851976e+03 2.333851976e+03 1.80 1.872630881e+03 1.872630881e+03 1.82 1.501807066e+03 1.501807066e+03 1.84 1.203698442e+03 1.203698442e+03 1.86 9.641152309e+02 9.641152309e+02 1.88 7.716343785e+02 7.716343785e+02 1.90 6.170397456e+02 6.170397456e+02 1.92 4.929205704e+02 4.929205704e+02 1.94 3.933192965e+02 3.933192965e+02 1.96 3.134300768e+02 3.134300768e+02 1.98 2.493968924e+02 2.493968924e+02 2.00 1.981112793e+02 1.981112793e+02 2.02 1.570553755e+02 1.570553755e+02 2.04 1.242153175e+02 1.242153175e+02 2.06 9.797309004e+01 9.797309004e+01 2.08 7.702470129e+01 7.702470129e+01 2.10 6.031983603e+01 6.031983603e+01 2.12 4.701242882e+01 4.701242882e+01 2.14 3.642277717e+01 3.642277717e+01 2.16 2.800483815e+01 2.800483815e+01 2.18 2.131947895e+01 2.131947895e+01 2.20 1.601459813e+01 1.601459813e+01 2.22 1.180777848e+01 1.180777848e+01 2.24 8.475116859e+00 8.475116859e+00 2.26 5.837285655e+00 5.837285655e+00 2.28 3.751015156e+00 3.751015156e+00 2.30 2.102077385e+00 2.102077385e+00 2.32 7.994047644e-01 7.994047644e-01 2.34 -2.294633151e-01 -2.294633151e-01 2.36 -1.042060759e+00 -1.042060759e+00 2.38 -1.683967101e+00 -1.683967101e+00 2.40 -2.191210707e+00 -2.191210707e+00 2.42 -2.592201582e+00 -2.592201582e+00 2.44 -2.909283057e+00 -2.909283057e+00 2.46 -3.159982797e+00 -3.159982797e+00 2.48 -3.358011448e+00 -3.358011448e+00 2.50 -3.514063958e+00 -3.514063958e+00 2.52 -3.636477457e+00 -3.636477457e+00 2.54 -3.731736788e+00 -3.731736788e+00 2.56 -3.804853259e+00 -3.804853259e+00 2.58 -3.859722023e+00 -3.859722023e+00 2.60 -3.899378428e+00 -3.899378428e+00 2.62 -3.926189664e+00 -3.926189664e+00 2.64 -3.942009404e+00 -3.942009404e+00 2.66 -3.948298948e+00 -3.948298948e+00 2.68 -3.946221651e+00 -3.946221651e+00 2.70 -3.936716100e+00 -3.936716100e+00 2.72 -3.920548646e+00 -3.920548646e+00 2.74 -3.898354937e+00 -3.898354937e+00 2.76 -3.870686769e+00 -3.870686769e+00 2.78 -3.838027849e+00 -3.838027849e+00 2.80 -3.800811519e+00 -3.800811519e+00 2.82 -3.759433994e+00 -3.759433994e+00 2.84 -3.714232729e+00 -3.714232729e+00 2.86 -3.665506626e+00 -3.665506626e+00 2.88 -3.613583758e+00 -3.613583758e+00 2.90 -3.558779759e+00 -3.558779759e+00 2.92 -3.501398290e+00 -3.501398290e+00 2.94 -3.441732080e+00 -3.441732080e+00 2.96 -3.380016655e+00 -3.380016655e+00 2.98 -3.316393196e+00 -3.316393196e+00 3.00 -3.251079329e+00 -3.251079329e+00 3.02 -3.184313744e+00 -3.184313744e+00 3.04 -3.116329963e+00 -3.116329963e+00 3.06 -3.047351059e+00 -3.047351059e+00 3.08 -2.977589430e+00 -2.977589430e+00 3.10 -2.907246613e+00 -2.907246613e+00 3.12 -2.836513142e+00 -2.836513142e+00 3.14 -2.765568471e+00 -2.765568471e+00 3.16 -2.694580958e+00 -2.694580958e+00 3.18 -2.623707918e+00 -2.623707918e+00 3.20 -2.553095739e+00 -2.553095739e+00 3.22 -2.482880054e+00 -2.482880054e+00 3.24 -2.413185972e+00 -2.413185972e+00 3.26 -2.344128348e+00 -2.344128348e+00 3.28 -2.275812100e+00 -2.275812100e+00 3.30 -2.208332558e+00 -2.208332558e+00 3.32 -2.141773401e+00 -2.141773401e+00 3.34 -2.076183710e+00 -2.076183710e+00 3.36 -2.011624980e+00 -2.011624980e+00 3.38 -1.948159018e+00 -1.948159018e+00 3.40 -1.885840134e+00 -1.885840134e+00 3.42 -1.824715558e+00 -1.824715558e+00 3.44 -1.764825865e+00 -1.764825865e+00 3.46 -1.706201086e+00 -1.706201086e+00 3.48 -1.648806533e+00 -1.648806533e+00 3.50 -1.592645189e+00 -1.592645189e+00 3.52 -1.537736354e+00 -1.537736354e+00 3.54 -1.484094831e+00 -1.484094831e+00 3.56 -1.431731267e+00 -1.431731267e+00 3.58 -1.380652476e+00 -1.380652476e+00 3.60 -1.330861747e+00 -1.330861747e+00 3.62 -1.282359146e+00 -1.282359146e+00 3.64 -1.235141789e+00 -1.235141789e+00 3.66 -1.189204112e+00 -1.189204112e+00 3.68 -1.144538119e+00 -1.144538119e+00 3.70 -1.101133620e+00 -1.101133620e+00 3.72 -1.058978452e+00 -1.058978452e+00 3.74 -1.018058687e+00 -1.018058687e+00 3.76 -9.783588282e-01 -9.783588282e-01 3.78 -9.398619880e-01 -9.398619880e-01 3.80 -9.025500606e-01 -9.025500606e-01 3.82 -8.664038776e-01 -8.664038776e-01 3.84 -8.314033538e-01 -8.314033538e-01 3.86 -7.975276226e-01 -7.975276226e-01 3.88 -7.647551601e-01 -7.647551601e-01 3.90 -7.330638999e-01 -7.330638999e-01 3.92 -7.024313387e-01 -7.024313387e-01 3.94 -6.728346332e-01 -6.728346332e-01 3.96 -6.442506884e-01 -6.442506884e-01 3.98 -6.166562384e-01 -6.166562384e-01 4.00 -5.900279202e-01 -5.900279202e-01 4.02 -5.643423404e-01 -5.643423404e-01 4.04 -5.395761359e-01 -5.395761359e-01 4.06 -5.157060278e-01 -5.157060278e-01 4.08 -4.927088714e-01 -4.927088714e-01 4.10 -4.705616996e-01 -4.705616996e-01 4.12 -4.492417623e-01 -4.492417623e-01 4.14 -4.287265611e-01 -4.287265611e-01 4.16 -4.089938802e-01 -4.089938802e-01 4.18 -3.900218137e-01 -3.900218137e-01 4.20 -3.717887886e-01 -3.717887886e-01 4.22 -3.542595462e-01 -3.542595462e-01 4.24 -3.373993085e-01 -3.373993085e-01 4.26 -3.211887158e-01 -3.211887158e-01 4.28 -3.056087759e-01 -3.056087759e-01 4.30 -2.906408725e-01 -2.906408725e-01 4.32 -2.762667732e-01 -2.762667732e-01 4.34 -2.624686357e-01 -2.624686357e-01 4.36 -2.492290128e-01 -2.492290128e-01 4.38 -2.365308557e-01 -2.365308557e-01 4.40 -2.243575158e-01 -2.243575158e-01 4.42 -2.126927453e-01 -2.126927453e-01 4.44 -2.015206971e-01 -2.015206971e-01 4.46 -1.908259234e-01 -1.908259234e-01 4.48 -1.805933735e-01 -1.805933735e-01 4.50 -1.708083906e-01 -1.708083906e-01 4.52 -1.614567086e-01 -1.614567086e-01 4.54 -1.525244472e-01 -1.525244472e-01 4.56 -1.439981076e-01 -1.439981076e-01 4.58 -1.358645667e-01 -1.358645667e-01 4.60 -1.281110729e-01 -1.281110729e-01 4.62 -1.207252380e-01 -1.207252380e-01 4.64 -1.136950302e-01 -1.136950302e-01 4.66 -1.070087690e-01 -1.070087690e-01 4.68 -1.006551187e-01 -1.006551187e-01 4.70 -9.461957442e-02 -9.461957442e-02 4.72 -8.888290372e-02 -8.888290372e-02 4.74 -8.343478145e-02 -8.343478145e-02 4.76 -7.826548859e-02 -7.826548859e-02 4.78 -7.336602687e-02 -7.336602687e-02 4.80 -6.872762952e-02 -6.872762952e-02 4.82 -6.434174222e-02 -6.434174222e-02 4.84 -6.020003322e-02 -6.020003322e-02 4.86 -5.629178640e-02 -5.629178640e-02 4.88 -5.259377579e-02 -5.259377579e-02 4.90 -4.908750872e-02 -4.908750872e-02 4.92 -4.574703573e-02 -4.574703573e-02 4.94 -4.256632113e-02 -4.256632113e-02 4.96 -3.954021155e-02 -3.954021155e-02 4.98 -3.666370961e-02 -3.666370961e-02 5.00 -3.393197102e-02 -3.393197102e-02 5.02 -3.134029960e-02 -3.134029960e-02 5.04 -2.888414286e-02 -2.888414286e-02 5.06 -2.655908964e-02 -2.655908964e-02 5.08 -2.436086629e-02 -2.436086629e-02 5.10 -2.228533296e-02 -2.228533296e-02 5.12 -2.032847984e-02 -2.032847984e-02 5.14 -1.848642358e-02 -1.848642358e-02 5.16 -1.675530514e-02 -1.675530514e-02 5.18 -1.513114693e-02 -1.513114693e-02 5.20 -1.361058689e-02 -1.361058689e-02 5.22 -1.219038066e-02 -1.219038066e-02 5.24 -1.086734572e-02 -1.086734572e-02 5.26 -9.638367087e-03 -9.638367087e-03 5.28 -8.500401747e-03 -8.500401747e-03 5.30 -7.450482037e-03 -7.450482037e-03 5.32 -6.485718089e-03 -6.485718089e-03 5.34 -5.603299471e-03 -5.603299471e-03 5.36 -4.800496153e-03 -4.800496153e-03 5.38 -4.074658882e-03 -4.074658882e-03 5.40 -3.423219063e-03 -3.423219063e-03 5.42 -2.842409348e-03 -2.842409348e-03 5.44 -2.322314129e-03 -2.322314129e-03 5.46 -1.859739692e-03 -1.859739692e-03 5.48 -1.452847903e-03 -1.452847903e-03 5.50 -1.099857598e-03 -1.099857598e-03 5.52 -7.990436028e-04 -7.990436028e-04 5.54 -5.487356035e-04 -5.487356035e-04 5.56 -3.473168974e-04 -3.473168974e-04 5.58 -1.932230441e-04 -1.932230441e-04 5.60 -8.494044715e-05 -8.494044715e-05 5.62 -2.100488394e-05 -2.100488394e-05 5.64 5.415511751e-11 5.415511751e-11 5.66 0.000000000e+00 0.000000000e+00 5.68 0.000000000e+00 0.000000000e+00 5.70 0.000000000e+00 0.000000000e+00 5.72 0.000000000e+00 0.000000000e+00 5.74 0.000000000e+00 0.000000000e+00 5.76 0.000000000e+00 0.000000000e+00 5.78 0.000000000e+00 0.000000000e+00 5.80 0.000000000e+00 0.000000000e+00 5.82 0.000000000e+00 0.000000000e+00 5.84 0.000000000e+00 0.000000000e+00 5.86 0.000000000e+00 0.000000000e+00 5.88 0.000000000e+00 0.000000000e+00 5.90 0.000000000e+00 0.000000000e+00 5.92 0.000000000e+00 0.000000000e+00 5.94 0.000000000e+00 0.000000000e+00 5.96 0.000000000e+00 0.000000000e+00 5.98 0.000000000e+00 0.000000000e+00 6.00 0.000000000e+00 0.000000000e+00