# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr # implementation = 2004--Zhou-X-W--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr--LAMMPS--ipr1 # composition = AgCo2Cu # 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 2024-04-11 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 nan nan 0.88 nan nan 0.90 nan nan 0.92 nan nan 0.94 nan nan 0.96 nan nan 0.98 nan nan 1.00 nan nan 1.02 nan nan 1.04 nan nan 1.06 nan nan 1.08 nan nan 1.10 nan nan 1.12 nan nan 1.14 nan nan 1.16 nan nan 1.18 nan nan 1.20 nan nan 1.22 nan nan 1.24 nan nan 1.26 nan nan 1.28 1.528319244e+02 1.528319244e+02 1.30 1.405091343e+02 1.405091343e+02 1.32 1.291620658e+02 1.291620658e+02 1.34 1.187084852e+02 1.187084852e+02 1.36 1.090738248e+02 1.090738248e+02 1.38 1.001909769e+02 1.001909769e+02 1.40 9.199935804e+01 9.199935804e+01 1.42 8.444376275e+01 8.444376275e+01 1.44 7.747314102e+01 7.747314102e+01 1.46 7.103980818e+01 7.103980818e+01 1.48 6.509955930e+01 6.509955930e+01 1.50 5.961223966e+01 5.961223966e+01 1.52 5.454187524e+01 5.454187524e+01 1.54 4.985613541e+01 4.985613541e+01 1.56 4.552559699e+01 4.552559699e+01 1.58 4.152322674e+01 4.152322674e+01 1.60 3.782527516e+01 3.782527516e+01 1.62 3.441112044e+01 3.441112044e+01 1.64 3.125998991e+01 3.125998991e+01 1.66 2.835217612e+01 2.835217612e+01 1.68 2.566939829e+01 2.566939829e+01 1.70 2.319473600e+01 2.319473600e+01 1.72 2.091254217e+01 2.091254217e+01 1.74 1.880825505e+01 1.880825505e+01 1.76 1.686822215e+01 1.686822215e+01 1.78 1.507968161e+01 1.507968161e+01 1.80 1.343088970e+01 1.343088970e+01 1.82 1.191123952e+01 1.191123952e+01 1.84 1.051123650e+01 1.051123650e+01 1.86 9.222325397e+00 9.222325397e+00 1.88 8.036650957e+00 8.036650957e+00 1.90 6.946836073e+00 6.946836073e+00 1.92 5.945831746e+00 5.945831746e+00 1.94 5.026867213e+00 5.026867213e+00 1.96 4.183496523e+00 4.183496523e+00 1.98 3.409699495e+00 3.409699495e+00 2.00 2.699977718e+00 2.699977718e+00 2.02 2.049399752e+00 2.049399752e+00 2.04 1.453576764e+00 1.453576764e+00 2.06 9.085794655e-01 9.085794655e-01 2.08 4.108305529e-01 4.108305529e-01 2.10 -4.299081667e-02 -4.299081667e-02 2.12 -4.560126357e-01 -4.560126357e-01 2.14 -8.312003157e-01 -8.312003157e-01 2.16 -1.171361787e+00 -1.171361787e+00 2.18 -1.479138482e+00 -1.479138482e+00 2.20 -1.756993889e+00 -1.756993889e+00 2.22 -2.007209688e+00 -2.007209688e+00 2.24 -2.231894281e+00 -2.231894281e+00 2.26 -2.433002096e+00 -2.433002096e+00 2.28 -2.612357697e+00 -2.612357697e+00 2.30 -2.771676945e+00 -2.771676945e+00 2.32 -2.912578029e+00 -2.912578029e+00 2.34 -3.036578690e+00 -3.036578690e+00 2.36 -3.145099057e+00 -3.145099057e+00 2.38 -3.239506923e+00 -3.239506923e+00 2.40 -3.320855264e+00 -3.320855264e+00 2.42 -3.390067657e+00 -3.390067657e+00 2.44 -3.447997119e+00 -3.447997119e+00 2.46 -3.495446049e+00 -3.495446049e+00 2.48 -3.533184489e+00 -3.533184489e+00 2.50 -3.561962673e+00 -3.561962673e+00 2.52 -3.582560939e+00 -3.582560939e+00 2.54 -3.595746680e+00 -3.595746680e+00 2.56 -3.601824752e+00 -3.601824752e+00 2.58 -3.601146943e+00 -3.601146943e+00 2.60 -3.594146051e+00 -3.594146051e+00 2.62 -3.581307424e+00 -3.581307424e+00 2.64 -3.563134978e+00 -3.563134978e+00 2.66 -3.540120450e+00 -3.540120450e+00 2.68 -3.512780347e+00 -3.512780347e+00 2.70 -3.481648996e+00 -3.481648996e+00 2.72 -3.447019691e+00 -3.447019691e+00 2.74 -3.409155759e+00 -3.409155759e+00 2.76 -3.368309154e+00 -3.368309154e+00 2.78 -3.324717213e+00 -3.324717213e+00 2.80 -3.278598994e+00 -3.278598994e+00 2.82 -3.230153250e+00 -3.230153250e+00 2.84 -3.179561227e+00 -3.179561227e+00 2.86 -3.126995882e+00 -3.126995882e+00 2.88 -3.072620117e+00 -3.072620117e+00 2.90 -3.016591435e+00 -3.016591435e+00 2.92 -2.959069183e+00 -2.959069183e+00 2.94 -2.900221476e+00 -2.900221476e+00 2.96 -2.840231439e+00 -2.840231439e+00 2.98 -2.779302110e+00 -2.779302110e+00 3.00 -2.717658812e+00 -2.717658812e+00 3.02 -2.655547547e+00 -2.655547547e+00 3.04 -2.593228237e+00 -2.593228237e+00 3.06 -2.530962894e+00 -2.530962894e+00 3.08 -2.469000514e+00 -2.469000514e+00 3.10 -2.407561988e+00 -2.407561988e+00 3.12 -2.346828530e+00 -2.346828530e+00 3.14 -2.286935990e+00 -2.286935990e+00 3.16 -2.227975485e+00 -2.227975485e+00 3.18 -2.169999027e+00 -2.169999027e+00 3.20 -2.113027993e+00 -2.113027993e+00 3.22 -2.057062316e+00 -2.057062316e+00 3.24 -2.002088902e+00 -2.002088902e+00 3.26 -1.948088477e+00 -1.948088477e+00 3.28 -1.895040635e+00 -1.895040635e+00 3.30 -1.842927218e+00 -1.842927218e+00 3.32 -1.791734304e+00 -1.791734304e+00 3.34 -1.741453093e+00 -1.741453093e+00 3.36 -1.692079979e+00 -1.692079979e+00 3.38 -1.643616029e+00 -1.643616029e+00 3.40 -1.596066055e+00 -1.596066055e+00 3.42 -1.549437435e+00 -1.549437435e+00 3.44 -1.503738820e+00 -1.503738820e+00 3.46 -1.458978830e+00 -1.458978830e+00 3.48 -1.415164834e+00 -1.415164834e+00 3.50 -1.372301896e+00 -1.372301896e+00 3.52 -1.330391922e+00 -1.330391922e+00 3.54 -1.289433052e+00 -1.289433052e+00 3.56 -1.249419320e+00 -1.249419320e+00 3.58 -1.210340582e+00 -1.210340582e+00 3.60 -1.172182719e+00 -1.172182719e+00 3.62 -1.134928122e+00 -1.134928122e+00 3.64 -1.098556446e+00 -1.098556446e+00 3.66 -1.063045607e+00 -1.063045607e+00 3.68 -1.028372992e+00 -1.028372992e+00 3.70 -9.945168156e-01 -9.945168156e-01 3.72 -9.614575072e-01 -9.614575072e-01 3.74 -9.291790150e-01 -9.291790150e-01 3.76 -8.976698498e-01 -8.976698498e-01 3.78 -8.669237089e-01 -8.669237089e-01 3.80 -8.369395289e-01 -8.369395289e-01 3.82 -8.077208809e-01 -8.077208809e-01 3.84 -7.792747052e-01 -7.792747052e-01 3.86 -7.516094990e-01 -7.516094990e-01 3.88 -7.247331717e-01 -7.247331717e-01 3.90 -6.986508546e-01 -6.986508546e-01 3.92 -6.733629654e-01 -6.733629654e-01 3.94 -6.488637794e-01 -6.488637794e-01 3.96 -6.251406518e-01 -6.251406518e-01 3.98 -6.021739303e-01 -6.021739303e-01 4.00 -5.799374758e-01 -5.799374758e-01 4.02 -5.583996517e-01 -5.583996517e-01 4.04 -5.375246111e-01 -5.375246111e-01 4.06 -5.172737339e-01 -5.172737339e-01 4.08 -4.976070976e-01 -4.976070976e-01 4.10 -4.784849162e-01 -4.784849162e-01 4.12 -4.598689207e-01 -4.598689207e-01 4.14 -4.417236553e-01 -4.417236553e-01 4.16 -4.240177046e-01 -4.240177046e-01 4.18 -4.067248095e-01 -4.067248095e-01 4.20 -3.898248323e-01 -3.898248323e-01 4.22 -3.733044927e-01 -3.733044927e-01 4.24 -3.571577810e-01 -3.571577810e-01 4.26 -3.413859590e-01 -3.413859590e-01 4.28 -3.259970850e-01 -3.259970850e-01 4.30 -3.110050565e-01 -3.110050565e-01 4.32 -2.964282354e-01 -2.964282354e-01 4.34 -2.822877830e-01 -2.822877830e-01 4.36 -2.686058757e-01 -2.686058757e-01 4.38 -2.554039739e-01 -2.554039739e-01 4.40 -2.427012818e-01 -2.427012818e-01 4.42 -2.305134814e-01 -2.305134814e-01 4.44 -2.188517650e-01 -2.188517650e-01 4.46 -2.077221550e-01 -2.077221550e-01 4.48 -1.971250807e-01 -1.971250807e-01 4.50 -1.870551884e-01 -1.870551884e-01 4.52 -1.775013746e-01 -1.775013746e-01 4.54 -1.684470339e-01 -1.684470339e-01 4.56 -1.598705186e-01 -1.598705186e-01 4.58 -1.517457875e-01 -1.517457875e-01 4.60 -1.440432116e-01 -1.440432116e-01 4.62 -1.367304857e-01 -1.367304857e-01 4.64 -1.297735952e-01 -1.297735952e-01 4.66 -1.231377835e-01 -1.231377835e-01 4.68 -1.167884833e-01 -1.167884833e-01 4.70 -1.106921839e-01 -1.106921839e-01 4.72 -1.048172232e-01 -1.048172232e-01 4.74 -9.913450538e-02 -9.913450538e-02 4.76 -9.361814778e-02 -9.361814778e-02 4.78 -8.824606162e-02 -8.824606162e-02 4.80 -8.300046346e-02 -8.300046346e-02 4.82 -7.786830714e-02 -7.786830714e-02 4.84 -7.284159858e-02 -7.284159858e-02 4.86 -6.791756788e-02 -6.791756788e-02 4.88 -6.309864097e-02 -6.309864097e-02 4.90 -5.839216963e-02 -5.839216963e-02 4.92 -5.380988654e-02 -5.380988654e-02 4.94 -4.936707786e-02 -4.936707786e-02 4.96 -4.508149993e-02 -4.508149993e-02 4.98 -4.097210511e-02 -4.097210511e-02 5.00 -3.705767794e-02 -3.705767794e-02 5.02 -3.335550299e-02 -3.335550299e-02 5.04 -2.988018506e-02 -2.988018506e-02 5.06 -2.664272705e-02 -2.664272705e-02 5.08 -2.364967638e-02 -2.364967638e-02 5.10 -2.090303518e-02 -2.090303518e-02 5.12 -1.840118517e-02 -1.840118517e-02 5.14 -1.613842584e-02 -1.613842584e-02 5.16 -1.410551494e-02 -1.410551494e-02 5.18 -1.229039266e-02 -1.229039266e-02 5.20 -1.067894260e-02 -1.067894260e-02 5.22 -9.255725208e-03 -9.255725208e-03 5.24 -8.004637985e-03 -8.004637985e-03 5.26 -6.909475507e-03 -6.909475507e-03 5.28 -5.954377880e-03 -5.954377880e-03 5.30 -5.124168608e-03 -5.124168608e-03 5.32 -4.404590902e-03 -4.404590902e-03 5.34 -3.782456207e-03 -3.782456207e-03 5.36 -3.245720609e-03 -3.245720609e-03 5.38 -2.783504809e-03 -2.783504809e-03 5.40 -2.386072050e-03 -2.386072050e-03 5.42 -2.044776484e-03 -2.044776484e-03 5.44 -1.751992277e-03 -1.751992277e-03 5.46 -1.501031598e-03 -1.501031598e-03 5.48 -1.286057702e-03 -1.286057702e-03 5.50 -1.101997633e-03 -1.101997633e-03 5.52 -9.444576870e-04 -9.444576870e-04 5.54 -8.096436957e-04 -8.096436957e-04 5.56 -6.942873399e-04 -6.942873399e-04 5.58 -5.955790974e-04 -5.955790974e-04 5.60 -5.111079763e-04 -5.111079763e-04 5.62 -4.388078874e-04 -4.388078874e-04 5.64 -3.769103120e-04 -3.769103120e-04 5.66 -3.239028055e-04 -3.239028055e-04 5.68 -2.784928173e-04 -2.784928173e-04 5.70 -2.395762922e-04 -2.395762922e-04 5.72 -2.062105230e-04 -2.062105230e-04 5.74 -1.775907543e-04 -1.775907543e-04 5.76 -1.530300714e-04 -1.530300714e-04 5.78 -1.319421496e-04 -1.319421496e-04 5.80 -1.138264852e-04 -1.138264852e-04 5.82 -9.825576625e-05 -9.825576625e-05 5.84 -8.486508909e-05 -8.486508909e-05 5.86 -7.334275622e-05 -7.334275622e-05 5.88 -6.342243095e-05 -6.342243095e-05 5.90 -5.487645157e-05 -5.487645157e-05 5.92 -4.751013597e-05 -4.751013597e-05 5.94 -4.115693093e-05 -4.115693093e-05 5.96 -3.567428149e-05 -3.567428149e-05 5.98 -3.094011343e-05 -3.094011343e-05 6.00 -2.684983774e-05 -2.684983774e-05