# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 1989--Adams-J-B-Foiles-S-M-Wolfer-W-G--Ag-Au-Cu-Ni-Pd-Pt # implementation = 1989--Adams-J-B--Ag-Au-Cu-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 2022-05-24 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 6.079125444e+02 6.079125444e+02 1.00 5.567485259e+02 5.567485259e+02 1.02 5.104731909e+02 5.104731909e+02 1.04 4.685613373e+02 4.685613373e+02 1.06 4.305488828e+02 4.305488828e+02 1.08 3.960234937e+02 3.960234937e+02 1.10 3.646219816e+02 3.646219816e+02 1.12 3.360230052e+02 3.360230052e+02 1.14 3.099404549e+02 3.099404549e+02 1.16 2.861248505e+02 2.861248505e+02 1.18 2.643477967e+02 2.643477967e+02 1.20 2.444093984e+02 2.444093984e+02 1.22 2.261297037e+02 2.261297037e+02 1.24 2.093512128e+02 2.093512128e+02 1.26 1.939306769e+02 1.939306769e+02 1.28 1.797394415e+02 1.797394415e+02 1.30 1.666622914e+02 1.666622914e+02 1.32 1.545991678e+02 1.545991678e+02 1.34 1.434584062e+02 1.434584062e+02 1.36 1.331586636e+02 1.331586636e+02 1.38 1.236267135e+02 1.236267135e+02 1.40 1.147958896e+02 1.147958896e+02 1.42 1.066049168e+02 1.066049168e+02 1.44 9.900215261e+01 9.900215261e+01 1.46 9.193955327e+01 9.193955327e+01 1.48 8.537294144e+01 8.537294144e+01 1.50 7.926315834e+01 7.926315834e+01 1.52 7.357480125e+01 7.357480125e+01 1.54 6.827460160e+01 6.827460160e+01 1.56 6.333311400e+01 6.333311400e+01 1.58 5.872392266e+01 5.872392266e+01 1.60 5.442327451e+01 5.442327451e+01 1.62 5.040729540e+01 5.040729540e+01 1.64 4.665703599e+01 4.665703599e+01 1.66 4.315405153e+01 4.315405153e+01 1.68 3.988126352e+01 3.988126352e+01 1.70 3.682271865e+01 3.682271865e+01 1.72 3.396301982e+01 3.396301982e+01 1.74 3.129005655e+01 3.129005655e+01 1.76 2.879145437e+01 2.879145437e+01 1.78 2.645532927e+01 2.645532927e+01 1.80 2.427139039e+01 2.427139039e+01 1.82 2.223004994e+01 2.223004994e+01 1.84 2.032218096e+01 2.032218096e+01 1.86 1.853919724e+01 1.853919724e+01 1.88 1.684140904e+01 1.684140904e+01 1.90 1.526270609e+01 1.526270609e+01 1.92 1.379545215e+01 1.379545215e+01 1.94 1.241592173e+01 1.241592173e+01 1.96 1.112029634e+01 1.112029634e+01 1.98 9.904368727e+00 9.904368727e+00 2.00 8.764571324e+00 8.764571324e+00 2.02 7.697255254e+00 7.697255254e+00 2.04 6.698889059e+00 6.698889059e+00 2.06 5.765910772e+00 5.765910772e+00 2.08 4.894991403e+00 4.894991403e+00 2.10 4.083161550e+00 4.083161550e+00 2.12 3.327326537e+00 3.327326537e+00 2.14 2.624807693e+00 2.624807693e+00 2.16 1.972841934e+00 1.972841934e+00 2.18 1.369092263e+00 1.369092263e+00 2.20 8.112004839e-01 8.112004839e-01 2.22 2.961946153e-01 2.961946153e-01 2.24 -1.781640495e-01 -1.781640495e-01 2.26 -6.140575344e-01 -6.140575344e-01 2.28 -1.013614383e+00 -1.013614383e+00 2.30 -1.378886691e+00 -1.378886691e+00 2.32 -1.711859928e+00 -1.711859928e+00 2.34 -2.014138711e+00 -2.014138711e+00 2.36 -2.287687190e+00 -2.287687190e+00 2.38 -2.534060207e+00 -2.534060207e+00 2.40 -2.755104281e+00 -2.755104281e+00 2.42 -2.952581178e+00 -2.952581178e+00 2.44 -3.127705007e+00 -3.127705007e+00 2.46 -3.281900553e+00 -3.281900553e+00 2.48 -3.416684780e+00 -3.416684780e+00 2.50 -3.533362482e+00 -3.533362482e+00 2.52 -3.633534453e+00 -3.633534453e+00 2.54 -3.718174125e+00 -3.718174125e+00 2.56 -3.788226502e+00 -3.788226502e+00 2.58 -3.844769399e+00 -3.844769399e+00 2.60 -3.888636364e+00 -3.888636364e+00 2.62 -3.920909826e+00 -3.920909826e+00 2.64 -3.942590389e+00 -3.942590389e+00 2.66 -3.954519125e+00 -3.954519125e+00 2.68 -3.957585080e+00 -3.957585080e+00 2.70 -3.952519029e+00 -3.952519029e+00 2.72 -3.940045772e+00 -3.940045772e+00 2.74 -3.920845460e+00 -3.920845460e+00 2.76 -3.895552646e+00 -3.895552646e+00 2.78 -3.864986264e+00 -3.864986264e+00 2.80 -3.829634175e+00 -3.829634175e+00 2.82 -3.789826300e+00 -3.789826300e+00 2.84 -3.745538094e+00 -3.745538094e+00 2.86 -3.697752073e+00 -3.697752073e+00 2.88 -3.646892075e+00 -3.646892075e+00 2.90 -3.593363070e+00 -3.593363070e+00 2.92 -3.537749204e+00 -3.537749204e+00 2.94 -3.480054896e+00 -3.480054896e+00 2.96 -3.420231702e+00 -3.420231702e+00 2.98 -3.358869782e+00 -3.358869782e+00 3.00 -3.296333541e+00 -3.296333541e+00 3.02 -3.232857645e+00 -3.232857645e+00 3.04 -3.168652541e+00 -3.168652541e+00 3.06 -3.103916955e+00 -3.103916955e+00 3.08 -3.038753971e+00 -3.038753971e+00 3.10 -2.973260179e+00 -2.973260179e+00 3.12 -2.907720456e+00 -2.907720456e+00 3.14 -2.842268271e+00 -2.842268271e+00 3.16 -2.777021634e+00 -2.777021634e+00 3.18 -2.712086807e+00 -2.712086807e+00 3.20 -2.647559497e+00 -2.647559497e+00 3.22 -2.583525663e+00 -2.583525663e+00 3.24 -2.520055750e+00 -2.520055750e+00 3.26 -2.457557585e+00 -2.457557585e+00 3.28 -2.395853251e+00 -2.395853251e+00 3.30 -2.334879792e+00 -2.334879792e+00 3.32 -2.274685759e+00 -2.274685759e+00 3.34 -2.215314265e+00 -2.215314265e+00 3.36 -2.156803420e+00 -2.156803420e+00 3.38 -2.099185497e+00 -2.099185497e+00 3.40 -2.042495681e+00 -2.042495681e+00 3.42 -1.986877164e+00 -1.986877164e+00 3.44 -1.932247514e+00 -1.932247514e+00 3.46 -1.878523181e+00 -1.878523181e+00 3.48 -1.825627999e+00 -1.825627999e+00 3.50 -1.773684928e+00 -1.773684928e+00 3.52 -1.722780742e+00 -1.722780742e+00 3.54 -1.672851535e+00 -1.672851535e+00 3.56 -1.623832135e+00 -1.623832135e+00 3.58 -1.575735870e+00 -1.575735870e+00 3.60 -1.528639044e+00 -1.528639044e+00 3.62 -1.482592502e+00 -1.482592502e+00 3.64 -1.437577652e+00 -1.437577652e+00 3.66 -1.393583050e+00 -1.393583050e+00 3.68 -1.350600880e+00 -1.350600880e+00 3.70 -1.308616401e+00 -1.308616401e+00 3.72 -1.267613192e+00 -1.267613192e+00 3.74 -1.227578882e+00 -1.227578882e+00 3.76 -1.188509905e+00 -1.188509905e+00 3.78 -1.150374603e+00 -1.150374603e+00 3.80 -1.113150104e+00 -1.113150104e+00 3.82 -1.076829946e+00 -1.076829946e+00 3.84 -1.041426127e+00 -1.041426127e+00 3.86 -1.006942209e+00 -1.006942209e+00 3.88 -9.732390763e-01 -9.732390763e-01 3.90 -9.401574697e-01 -9.401574697e-01 3.92 -9.077904814e-01 -9.077904814e-01 3.94 -8.763243091e-01 -8.763243091e-01 3.96 -8.459118400e-01 -8.459118400e-01 3.98 -8.166612533e-01 -8.166612533e-01 4.00 -7.886668574e-01 -7.886668574e-01 4.02 -7.620549713e-01 -7.620549713e-01 4.04 -7.369020506e-01 -7.369020506e-01 4.06 -7.128374293e-01 -7.128374293e-01 4.08 -6.893856564e-01 -6.893856564e-01 4.10 -6.661958123e-01 -6.661958123e-01 4.12 -6.430267813e-01 -6.430267813e-01 4.14 -6.197260453e-01 -6.197260453e-01 4.16 -5.962787765e-01 -5.962787765e-01 4.18 -5.730931770e-01 -5.730931770e-01 4.20 -5.496449628e-01 -5.496449628e-01 4.22 -5.259712732e-01 -5.259712732e-01 4.24 -5.020961573e-01 -5.020961573e-01 4.26 -4.780295542e-01 -4.780295542e-01 4.28 -4.538674723e-01 -4.538674723e-01 4.30 -4.298680452e-01 -4.298680452e-01 4.32 -4.062460226e-01 -4.062460226e-01 4.34 -3.831661473e-01 -3.831661473e-01 4.36 -3.607520451e-01 -3.607520451e-01 4.38 -3.390936814e-01 -3.390936814e-01 4.40 -3.182535999e-01 -3.182535999e-01 4.42 -2.982721357e-01 -2.982721357e-01 4.44 -2.791717542e-01 -2.791717542e-01 4.46 -2.609606622e-01 -2.609606622e-01 4.48 -2.436358032e-01 -2.436358032e-01 4.50 -2.271853299e-01 -2.271853299e-01 4.52 -2.115906405e-01 -2.115906405e-01 4.54 -1.968280507e-01 -1.968280507e-01 4.56 -1.828700622e-01 -1.828700622e-01 4.58 -1.696780622e-01 -1.696780622e-01 4.60 -1.574650018e-01 -1.574650018e-01 4.62 -1.461707291e-01 -1.461707291e-01 4.64 -1.355150687e-01 -1.355150687e-01 4.66 -1.254750732e-01 -1.254750732e-01 4.68 -1.160197662e-01 -1.160197662e-01 4.70 -1.071188035e-01 -1.071188035e-01 4.72 -9.874268616e-02 -9.874268616e-02 4.74 -9.086289207e-02 -9.086289207e-02 4.76 -8.345196765e-02 -8.345196765e-02 4.78 -7.648762728e-02 -7.648762728e-02 4.80 -6.994233554e-02 -6.994233554e-02 4.82 -6.493874280e-02 -6.493874280e-02 4.84 -6.031376358e-02 -6.031376358e-02 4.86 -5.596000643e-02 -5.596000643e-02 4.88 -5.186210624e-02 -5.186210624e-02 4.90 -4.800543500e-02 -4.800543500e-02 4.92 -4.437614910e-02 -4.437614910e-02 4.94 -4.096115673e-02 -4.096115673e-02 4.96 -3.774808417e-02 -3.774808417e-02 4.98 -3.472524235e-02 -3.472524235e-02 5.00 -3.188159381e-02 -3.188159381e-02 5.02 -2.920672066e-02 -2.920672066e-02 5.04 -2.669079331e-02 -2.669079331e-02 5.06 -2.432453926e-02 -2.432453926e-02 5.08 -2.209921376e-02 -2.209921376e-02 5.10 -2.000657156e-02 -2.000657156e-02 5.12 -1.803883997e-02 -1.803883997e-02 5.14 -1.618869276e-02 -1.618869276e-02 5.16 -1.444922537e-02 -1.444922537e-02 5.18 -1.281393137e-02 -1.281393137e-02 5.20 -1.127668017e-02 -1.127668017e-02 5.22 -9.831696006e-03 -9.831696006e-03 5.24 -8.473537554e-03 -8.473537554e-03 5.26 -7.197064186e-03 -7.197064186e-03 5.28 -5.998411679e-03 -5.998411679e-03 5.30 -4.893979224e-03 -4.893979224e-03 5.32 -4.323010053e-03 -4.323010053e-03 5.34 -3.802806573e-03 -3.802806573e-03 5.36 -3.318760732e-03 -3.318760732e-03 5.38 -2.865123299e-03 -2.865123299e-03 5.40 -2.440020445e-03 -2.440020445e-03 5.42 -2.041691822e-03 -2.041691822e-03 5.44 -1.668483747e-03 -1.668483747e-03 5.46 -1.318842832e-03 -1.318842832e-03 5.48 -9.913100051e-04 -9.913100051e-04 5.50 -6.845148883e-04 -6.845148883e-04 5.52 -3.971704408e-04 -3.971704408e-04 5.54 -1.263465717e-04 -1.263465717e-04 5.56 0.000000000e+00 0.000000000e+00 5.58 0.000000000e+00 0.000000000e+00 5.60 0.000000000e+00 0.000000000e+00 5.62 0.000000000e+00 0.000000000e+00 5.64 0.000000000e+00 0.000000000e+00 5.66 0.000000000e+00 0.000000000e+00 5.68 0.000000000e+00 0.000000000e+00 5.70 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