# 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 = AgCuNi2 # 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 4.088667080e+06 4.088667080e+06 0.88 3.697856808e+06 3.697856808e+06 0.90 3.341575283e+06 3.341575283e+06 0.92 3.016193032e+06 3.016193032e+06 0.94 2.718483693e+06 2.718483693e+06 0.96 2.445612092e+06 2.445612092e+06 0.98 2.195056452e+06 2.195056452e+06 1.00 1.964617133e+06 1.964617133e+06 1.02 1.752343309e+06 1.752343309e+06 1.04 1.556527940e+06 1.556527940e+06 1.06 1.375647194e+06 1.375647194e+06 1.08 1.208346901e+06 1.208346901e+06 1.10 1.053423957e+06 1.053423957e+06 1.12 9.097843537e+05 9.097843537e+05 1.14 7.764464057e+05 7.764464057e+05 1.16 6.525089516e+05 6.525089516e+05 1.18 5.371897866e+05 5.371897866e+05 1.20 4.307562126e+05 4.307562126e+05 1.22 3.389785583e+05 3.389785583e+05 1.24 2.655798214e+05 2.655798214e+05 1.26 2.084504317e+05 2.084504317e+05 1.28 1.638935776e+05 1.638935776e+05 1.30 1.290659538e+05 1.290659538e+05 1.32 1.017880138e+05 1.017880138e+05 1.34 8.038106990e+04 8.038106990e+04 1.36 6.355380025e+04 6.355380025e+04 1.38 5.030636269e+04 5.030636269e+04 1.40 3.986140108e+04 3.986140108e+04 1.42 3.161505549e+04 3.161505549e+04 1.44 2.509490204e+04 2.509490204e+04 1.46 1.993248557e+04 1.993248557e+04 1.48 1.584043693e+04 1.584043693e+04 1.50 1.259372996e+04 1.259372996e+04 1.52 1.001568802e+04 1.001568802e+04 1.54 7.967396124e+03 7.967396124e+03 1.56 6.339052062e+03 6.339052062e+03 1.58 5.043879752e+03 5.043879752e+03 1.60 4.013371590e+03 4.013371590e+03 1.62 3.193226376e+03 3.193226376e+03 1.64 2.540196443e+03 2.540196443e+03 1.66 2.020058498e+03 2.020058498e+03 1.68 1.605660949e+03 1.605660949e+03 1.70 1.275509894e+03 1.275509894e+03 1.72 1.012545250e+03 1.012545250e+03 1.74 8.031234039e+02 8.031234039e+02 1.76 6.363920927e+02 6.363920927e+02 1.78 5.037095654e+02 5.037095654e+02 1.80 3.981796842e+02 3.981796842e+02 1.82 3.143073293e+02 3.143073293e+02 1.84 2.477013555e+02 2.477013555e+02 1.86 1.948533025e+02 1.948533025e+02 1.88 1.529605545e+02 1.529605545e+02 1.90 1.197764279e+02 1.197764279e+02 1.92 9.351421354e+01 9.351421354e+01 1.94 7.275197196e+01 7.275197196e+01 1.96 5.634773074e+01 5.634773074e+01 1.98 4.340503209e+01 4.340503209e+01 2.00 3.320765545e+01 3.320765545e+01 2.02 2.518330636e+01 2.518330636e+01 2.04 1.887888352e+01 1.887888352e+01 2.06 1.393388800e+01 1.393388800e+01 2.08 1.006127629e+01 1.006127629e+01 2.10 7.032877933e+00 7.032877933e+00 2.12 4.667590789e+00 4.667590789e+00 2.14 2.822084608e+00 2.822084608e+00 2.16 1.383182668e+00 1.383182668e+00 2.18 2.616342513e-01 2.616342513e-01 2.20 -6.127184177e-01 -6.127184177e-01 2.22 -1.294853336e+00 -1.294853336e+00 2.24 -1.827717758e+00 -1.827717758e+00 2.26 -2.244779193e+00 -2.244779193e+00 2.28 -2.572012355e+00 -2.572012355e+00 2.30 -2.829541760e+00 -2.829541760e+00 2.32 -3.032892563e+00 -3.032892563e+00 2.34 -3.193990527e+00 -3.193990527e+00 2.36 -3.321956289e+00 -3.321956289e+00 2.38 -3.423734498e+00 -3.423734498e+00 2.40 -3.504590668e+00 -3.504590668e+00 2.42 -3.568502218e+00 -3.568502218e+00 2.44 -3.618450700e+00 -3.618450700e+00 2.46 -3.656651249e+00 -3.656651249e+00 2.48 -3.684793903e+00 -3.684793903e+00 2.50 -3.704160904e+00 -3.704160904e+00 2.52 -3.715711618e+00 -3.715711618e+00 2.54 -3.720195708e+00 -3.720195708e+00 2.56 -3.718122206e+00 -3.718122206e+00 2.58 -3.709960179e+00 -3.709960179e+00 2.60 -3.696130745e+00 -3.696130745e+00 2.62 -3.676953236e+00 -3.676953236e+00 2.64 -3.652705969e+00 -3.652705969e+00 2.66 -3.623704450e+00 -3.623704450e+00 2.68 -3.590251002e+00 -3.590251002e+00 2.70 -3.552640405e+00 -3.552640405e+00 2.72 -3.511163360e+00 -3.511163360e+00 2.74 -3.466108316e+00 -3.466108316e+00 2.76 -3.417762131e+00 -3.417762131e+00 2.78 -3.366409924e+00 -3.366409924e+00 2.80 -3.312334395e+00 -3.312334395e+00 2.82 -3.255814826e+00 -3.255814826e+00 2.84 -3.197112662e+00 -3.197112662e+00 2.86 -3.136483066e+00 -3.136483066e+00 2.88 -3.074187257e+00 -3.074187257e+00 2.90 -3.010478418e+00 -3.010478418e+00 2.92 -2.945600717e+00 -2.945600717e+00 2.94 -2.879788461e+00 -2.879788461e+00 2.96 -2.813240334e+00 -2.813240334e+00 2.98 -2.746089830e+00 -2.746089830e+00 3.00 -2.678457344e+00 -2.678457344e+00 3.02 -2.610516420e+00 -2.610516420e+00 3.04 -2.542441698e+00 -2.542441698e+00 3.06 -2.474386841e+00 -2.474386841e+00 3.08 -2.406449767e+00 -2.406449767e+00 3.10 -2.338762886e+00 -2.338762886e+00 3.12 -2.271456365e+00 -2.271456365e+00 3.14 -2.204650084e+00 -2.204650084e+00 3.16 -2.138453944e+00 -2.138453944e+00 3.18 -2.072968198e+00 -2.072968198e+00 3.20 -2.008283827e+00 -2.008283827e+00 3.22 -1.944482924e+00 -1.944482924e+00 3.24 -1.881639102e+00 -1.881639102e+00 3.26 -1.819817913e+00 -1.819817913e+00 3.28 -1.759077262e+00 -1.759077262e+00 3.30 -1.699467842e+00 -1.699467842e+00 3.32 -1.641033548e+00 -1.641033548e+00 3.34 -1.583811899e+00 -1.583811899e+00 3.36 -1.527834443e+00 -1.527834443e+00 3.38 -1.473127163e+00 -1.473127163e+00 3.40 -1.419710864e+00 -1.419710864e+00 3.42 -1.367601545e+00 -1.367601545e+00 3.44 -1.316810767e+00 -1.316810767e+00 3.46 -1.267343580e+00 -1.267343580e+00 3.48 -1.219168331e+00 -1.219168331e+00 3.50 -1.172274557e+00 -1.172274557e+00 3.52 -1.126660662e+00 -1.126660662e+00 3.54 -1.082322244e+00 -1.082322244e+00 3.56 -1.039252347e+00 -1.039252347e+00 3.58 -9.974417053e-01 -9.974417053e-01 3.60 -9.568789764e-01 -9.568789764e-01 3.62 -9.175509517e-01 -9.175509517e-01 3.64 -8.794427597e-01 -8.794427597e-01 3.66 -8.425380542e-01 -8.425380542e-01 3.68 -8.068191892e-01 -8.068191892e-01 3.70 -7.722673819e-01 -7.722673819e-01 3.72 -7.388628646e-01 -7.388628646e-01 3.74 -7.065850245e-01 -7.065850245e-01 3.76 -6.754125336e-01 -6.754125336e-01 3.78 -6.453234684e-01 -6.453234684e-01 3.80 -6.162954198e-01 -6.162954198e-01 3.82 -5.883055943e-01 -5.883055943e-01 3.84 -5.613309069e-01 -5.613309069e-01 3.86 -5.353480657e-01 -5.353480657e-01 3.88 -5.103336490e-01 -5.103336490e-01 3.90 -4.862641757e-01 -4.862641757e-01 3.92 -4.631161693e-01 -4.631161693e-01 3.94 -4.408662149e-01 -4.408662149e-01 3.96 -4.194910116e-01 -4.194910116e-01 3.98 -3.989674190e-01 -3.989674190e-01 4.00 -3.792724988e-01 -3.792724988e-01 4.02 -3.603835520e-01 -3.603835520e-01 4.04 -3.422781517e-01 -3.422781517e-01 4.06 -3.249341720e-01 -3.249341720e-01 4.08 -3.083298137e-01 -3.083298137e-01 4.10 -2.924436259e-01 -2.924436259e-01 4.12 -2.772545251e-01 -2.772545251e-01 4.14 -2.627418114e-01 -2.627418114e-01 4.16 -2.488851819e-01 -2.488851819e-01 4.18 -2.356647421e-01 -2.356647421e-01 4.20 -2.230610151e-01 -2.230610151e-01 4.22 -2.110301724e-01 -2.110301724e-01 4.24 -1.995290540e-01 -1.995290540e-01 4.26 -1.885414790e-01 -1.885414790e-01 4.28 -1.780516436e-01 -1.780516436e-01 4.30 -1.680441179e-01 -1.680441179e-01 4.32 -1.585019097e-01 -1.585019097e-01 4.34 -1.493888074e-01 -1.493888074e-01 4.36 -1.406853922e-01 -1.406853922e-01 4.38 -1.323788014e-01 -1.323788014e-01 4.40 -1.244565065e-01 -1.244565065e-01 4.42 -1.169063102e-01 -1.169063102e-01 4.44 -1.097163428e-01 -1.097163428e-01 4.46 -1.028749067e-01 -1.028749067e-01 4.48 -9.637072944e-02 -9.637072944e-02 4.50 -9.019301999e-02 -9.019301999e-02 4.52 -8.433125520e-02 -8.433125520e-02 4.54 -7.877518294e-02 -7.877518294e-02 4.56 -7.351462143e-02 -7.351462143e-02 4.58 -6.853987242e-02 -6.853987242e-02 4.60 -6.384167391e-02 -6.384167391e-02 4.62 -5.941096998e-02 -5.941096998e-02 4.64 -5.523892489e-02 -5.523892489e-02 4.66 -5.131693320e-02 -5.131693320e-02 4.68 -4.763662638e-02 -4.763662638e-02 4.70 -4.418987667e-02 -4.418987667e-02 4.72 -4.096879854e-02 -4.096879854e-02 4.74 -3.796574822e-02 -3.796574822e-02 4.76 -3.517332175e-02 -3.517332175e-02 4.78 -3.258435175e-02 -3.258435175e-02 4.80 -3.019190329e-02 -3.019190329e-02 4.82 -2.798926965e-02 -2.798926965e-02 4.84 -2.596996435e-02 -2.596996435e-02 4.86 -2.412250303e-02 -2.412250303e-02 4.88 -2.241019751e-02 -2.241019751e-02 4.90 -2.081909445e-02 -2.081909445e-02 4.92 -1.933551654e-02 -1.933551654e-02 4.94 -1.795572754e-02 -1.795572754e-02 4.96 -1.667644862e-02 -1.667644862e-02 4.98 -1.549449623e-02 -1.549449623e-02 5.00 -1.438742384e-02 -1.438742384e-02 5.02 -1.333378460e-02 -1.333378460e-02 5.04 -1.233202840e-02 -1.233202840e-02 5.06 -1.138063137e-02 -1.138063137e-02 5.08 -1.047809766e-02 -1.047809766e-02 5.10 -9.622961380e-03 -9.622961380e-03 5.12 -8.813788030e-03 -8.813788030e-03 5.14 -8.049175698e-03 -8.049175698e-03 5.16 -7.327755885e-03 -7.327755885e-03 5.18 -6.648194104e-03 -6.648194104e-03 5.20 -6.009190233e-03 -6.009190233e-03 5.22 -5.409478691e-03 -5.409478691e-03 5.24 -4.847828426e-03 -4.847828426e-03 5.26 -4.323042774e-03 -4.323042774e-03 5.28 -3.833959186e-03 -3.833959186e-03 5.30 -3.379448853e-03 -3.379448853e-03 5.32 -2.958416245e-03 -2.958416245e-03 5.34 -2.569798575e-03 -2.569798575e-03 5.36 -2.212565206e-03 -2.212565206e-03 5.38 -1.885717002e-03 -1.885717002e-03 5.40 -1.588285649e-03 -1.588285649e-03 5.42 -1.319332944e-03 -1.319332944e-03 5.44 -1.077950054e-03 -1.077950054e-03 5.46 -8.632567710e-04 -8.632567710e-04 5.48 -6.744007447e-04 -6.744007447e-04 5.50 -5.105567198e-04 -5.105567198e-04 5.52 -3.709257660e-04 -3.709257660e-04 5.54 -2.547345130e-04 -2.547345130e-04 5.56 -1.612343906e-04 -1.612343906e-04 5.58 -8.970087644e-05 -8.970087644e-05 5.60 -3.943275508e-05 -3.943275508e-05 5.62 -9.751388405e-06 -9.751388405e-06 5.64 2.514131763e-11 2.514131763e-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