# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2025--Kushnerov-O-I-Ryabtsev-S-I-Bashev-V-F--Co-Cr-Fe-Ni-Mn-Al # implementation = 2025--Kushnerov-O-I--Co-Cr-Fe-Ni-Mn-Al--LAMMPS--ipr1 # composition = Co2CrNi # 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 2025-07-01 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 2.262058748e+02 2.262058748e+02 1.10 2.082467077e+02 2.082467077e+02 1.12 1.914994291e+02 1.914994291e+02 1.14 1.760474679e+02 1.760474679e+02 1.16 1.620003086e+02 1.620003086e+02 1.18 1.490066625e+02 1.490066625e+02 1.20 1.373728993e+02 1.373728993e+02 1.22 1.263306106e+02 1.263306106e+02 1.24 1.160772318e+02 1.160772318e+02 1.26 1.067771038e+02 1.067771106e+02 1.28 9.815819728e+01 9.815819728e+01 1.30 9.021008450e+01 9.021008450e+01 1.32 8.276089016e+01 8.276089016e+01 1.34 7.611190324e+01 7.611190324e+01 1.36 6.973878089e+01 6.973878089e+01 1.38 6.387331623e+01 6.387331623e+01 1.40 5.843708747e+01 5.843708747e+01 1.42 5.341534616e+01 5.341534616e+01 1.44 4.899369296e+01 4.899369296e+01 1.46 4.484288592e+01 4.484288592e+01 1.48 4.083947500e+01 4.083947500e+01 1.50 3.714050430e+01 3.714050430e+01 1.52 3.380129648e+01 3.380129648e+01 1.54 3.078743700e+01 3.078743700e+01 1.56 2.784506265e+01 2.784506265e+01 1.58 2.515372164e+01 2.515372164e+01 1.60 2.264061074e+01 2.264061074e+01 1.62 2.031983142e+01 2.031983142e+01 1.64 1.817705871e+01 1.817705871e+01 1.66 1.627471627e+01 1.627471627e+01 1.68 1.451718304e+01 1.451718304e+01 1.70 1.281901727e+01 1.281901727e+01 1.72 1.125333805e+01 1.125333805e+01 1.74 9.886554514e+00 9.886554514e+00 1.76 8.550179977e+00 8.550179977e+00 1.78 7.320014142e+00 7.320014142e+00 1.80 6.188319000e+00 6.188319000e+00 1.82 5.249566004e+00 5.249566004e+00 1.84 4.284611216e+00 4.284611216e+00 1.86 3.551255827e+00 3.551255827e+00 1.88 2.725620233e+00 2.725620233e+00 1.90 1.969472409e+00 1.969472409e+00 1.92 1.277746129e+00 1.277746129e+00 1.94 6.847336463e-01 6.847336463e-01 1.96 1.047429483e-01 1.047429483e-01 1.98 -4.236392306e-01 -4.236392306e-01 2.00 -9.041914618e-01 -9.041914618e-01 2.02 -1.340421901e+00 -1.340421901e+00 2.04 -1.735588503e+00 -1.735588503e+00 2.06 -2.092717604e+00 -2.092717604e+00 2.08 -2.414621018e+00 -2.414621018e+00 2.10 -2.635307539e+00 -2.635307704e+00 2.12 -2.862495592e+00 -2.862495592e+00 2.14 -3.101649004e+00 -3.101649004e+00 2.16 -3.314345126e+00 -3.314345126e+00 2.18 -3.502585494e+00 -3.502585494e+00 2.20 -3.668231083e+00 -3.668231083e+00 2.22 -3.813012308e+00 -3.813012308e+00 2.24 -3.860521479e+00 -3.860521479e+00 2.26 -3.974133586e+00 -3.974133586e+00 2.28 -4.070941782e+00 -4.070941782e+00 2.30 -4.152272503e+00 -4.152272503e+00 2.32 -4.219359121e+00 -4.219359121e+00 2.34 -4.273348412e+00 -4.273348412e+00 2.36 -4.315306568e+00 -4.315306568e+00 2.38 -4.346224761e+00 -4.346224761e+00 2.40 -4.367024327e+00 -4.367024327e+00 2.42 -4.378561558e+00 -4.378561558e+00 2.44 -4.299808391e+00 -4.299808391e+00 2.46 -4.300768662e+00 -4.300768662e+00 2.48 -4.294304104e+00 -4.294304104e+00 2.50 -4.281078576e+00 -4.281078576e+00 2.52 -4.184409497e+00 -4.184409497e+00 2.54 -4.164643514e+00 -4.164643514e+00 2.56 -4.139490937e+00 -4.139490937e+00 2.58 -4.109467420e+00 -4.109467420e+00 2.60 -4.075051340e+00 -4.075051340e+00 2.62 -4.036686317e+00 -4.036686317e+00 2.64 -3.994783562e+00 -3.994783562e+00 2.66 -3.949724071e+00 -3.949724071e+00 2.68 -3.901860667e+00 -3.901860667e+00 2.70 -3.851519908e+00 -3.851519908e+00 2.72 -3.799003865e+00 -3.799003865e+00 2.74 -3.724873855e+00 -3.724873855e+00 2.76 -3.670038354e+00 -3.670038354e+00 2.78 -3.613728330e+00 -3.613728330e+00 2.80 -3.556167983e+00 -3.556167983e+00 2.82 -3.497564017e+00 -3.497564017e+00 2.84 -3.438106830e+00 -3.438106830e+00 2.86 -3.377971631e+00 -3.377971631e+00 2.88 -3.317319479e+00 -3.317319479e+00 2.90 -3.256298251e+00 -3.256298251e+00 2.92 -3.195043554e+00 -3.195043554e+00 2.94 -3.133679571e+00 -3.133679571e+00 2.96 -3.072319849e+00 -3.072319849e+00 2.98 -3.011068045e+00 -3.011068045e+00 3.00 -2.950018611e+00 -2.950018611e+00 3.02 -2.889257443e+00 -2.889257443e+00 3.04 -2.828862479e+00 -2.828862479e+00 3.06 -2.768904271e+00 -2.768904271e+00 3.08 -2.709446500e+00 -2.709446500e+00 3.10 -2.650546474e+00 -2.650546474e+00 3.12 -2.592255588e+00 -2.592255588e+00 3.14 -2.534619746e+00 -2.534619746e+00 3.16 -2.451144163e+00 -2.451144163e+00 3.18 -2.396358491e+00 -2.396358491e+00 3.20 -2.342260558e+00 -2.342260558e+00 3.22 -2.288882094e+00 -2.288882094e+00 3.24 -2.236250888e+00 -2.236250888e+00 3.26 -2.184391075e+00 -2.184391075e+00 3.28 -2.133323414e+00 -2.133323414e+00 3.30 -2.003296852e+00 -2.003296852e+00 3.32 -1.957960814e+00 -1.957960814e+00 3.34 -1.913251708e+00 -1.913251708e+00 3.36 -1.869189856e+00 -1.869189856e+00 3.38 -1.825792790e+00 -1.825792790e+00 3.40 -1.783075466e+00 -1.783075466e+00 3.42 -1.741050454e+00 -1.741050454e+00 3.44 -1.699728121e+00 -1.699728121e+00 3.46 -1.659116802e+00 -1.659116802e+00 3.48 -1.619222959e+00 -1.619222959e+00 3.50 -1.580051326e+00 -1.580051326e+00 3.52 -1.541605052e+00 -1.541605052e+00 3.54 -1.503885826e+00 -1.503885826e+00 3.56 -1.466894002e+00 -1.466894002e+00 3.58 -1.430628708e+00 -1.430628708e+00 3.60 -1.395087956e+00 -1.395087956e+00 3.62 -1.360268733e+00 -1.360268733e+00 3.64 -1.326167099e+00 -1.326167099e+00 3.66 -1.292778269e+00 -1.292778269e+00 3.68 -1.260096693e+00 -1.260096693e+00 3.70 -1.228116131e+00 -1.228116131e+00 3.72 -1.196829718e+00 -1.196829718e+00 3.74 -1.166230033e+00 -1.166230033e+00 3.76 -1.136309156e+00 -1.136309156e+00 3.78 -1.107058722e+00 -1.107058722e+00 3.80 -1.078469975e+00 -1.078469975e+00 3.82 -1.050533812e+00 -1.050533812e+00 3.84 -1.023240831e+00 -1.023240831e+00 3.86 -9.557983893e-01 -9.557983893e-01 3.88 -9.315552225e-01 -9.315552225e-01 3.90 -9.078470995e-01 -9.078470995e-01 3.92 -8.846672093e-01 -8.846672093e-01 3.94 -8.620084693e-01 -8.620084693e-01 3.96 -8.398635596e-01 -8.398635596e-01 3.98 -8.182249540e-01 -8.182249540e-01 4.00 -7.970849487e-01 -7.970849487e-01 4.02 -7.764356894e-01 -7.764356894e-01 4.04 -7.562691962e-01 -7.562691962e-01 4.06 -7.365773865e-01 -7.365773865e-01 4.08 -7.173520962e-01 -7.173520962e-01 4.10 -6.985850995e-01 -6.985850995e-01 4.12 -6.802681268e-01 -6.802681268e-01 4.14 -6.623928815e-01 -6.623928815e-01 4.16 -6.449510555e-01 -6.449510555e-01 4.18 -6.279343428e-01 -6.279343428e-01 4.20 -6.113344531e-01 -6.113344531e-01 4.22 -5.951431229e-01 -5.951431229e-01 4.24 -5.793521270e-01 -5.793521270e-01 4.26 -5.639532877e-01 -5.639532877e-01 4.28 -5.489384845e-01 -5.489384845e-01 4.30 -5.342996614e-01 -5.342996614e-01 4.32 -5.200288349e-01 -5.200288349e-01 4.34 -5.061181004e-01 -5.061181004e-01 4.36 -4.925596382e-01 -4.925596382e-01 4.38 -4.793457186e-01 -4.793457186e-01 4.40 -4.664687072e-01 -4.664687072e-01 4.42 -4.539210685e-01 -4.539210685e-01 4.44 -4.416953700e-01 -4.416953700e-01 4.46 -4.297842853e-01 -4.297842853e-01 4.48 -4.181805968e-01 -4.181805968e-01 4.50 -4.068771984e-01 -4.068771984e-01 4.52 -3.958670971e-01 -3.958670971e-01 4.54 -3.851434152e-01 -3.851434152e-01 4.56 -3.746993911e-01 -3.746993911e-01 4.58 -3.645283806e-01 -3.645283806e-01 4.60 -3.546238581e-01 -3.546238581e-01 4.62 -3.449794162e-01 -3.449794162e-01 4.64 -3.355887670e-01 -3.355887670e-01 4.66 -3.264457416e-01 -3.264457416e-01 4.68 -3.175442900e-01 -3.175442900e-01 4.70 -3.088784811e-01 -3.088784811e-01 4.72 -3.004425022e-01 -3.004425022e-01 4.74 -2.922306579e-01 -2.922306579e-01 4.76 -2.842373703e-01 -2.842373703e-01 4.78 -2.764571772e-01 -2.764571772e-01 4.80 -2.688847318e-01 -2.688847318e-01 4.82 -2.615148013e-01 -2.615148013e-01 4.84 -2.543422657e-01 -2.543422657e-01 4.86 -2.473621168e-01 -2.473621168e-01 4.88 -2.405694567e-01 -2.405694567e-01 4.90 -2.339594963e-01 -2.339594963e-01 4.92 -2.275275543e-01 -2.275275543e-01 4.94 -2.212690552e-01 -2.212690552e-01 4.96 -2.151795282e-01 -2.151795282e-01 4.98 -2.092546050e-01 -2.092546050e-01 5.00 -2.034900191e-01 -2.034900191e-01 5.02 -1.978816033e-01 -1.978816033e-01 5.04 -1.924252886e-01 -1.924252886e-01 5.06 -1.871171022e-01 -1.871171022e-01 5.08 -1.819531661e-01 -1.819531661e-01 5.10 -1.769296952e-01 -1.769296952e-01 5.12 -1.720429955e-01 -1.720429955e-01 5.14 -1.672894626e-01 -1.672894626e-01 5.16 -1.626655802e-01 -1.626655802e-01 5.18 -1.581679176e-01 -1.581679176e-01 5.20 -1.537931290e-01 -1.537931290e-01 5.22 -1.495379510e-01 -1.495379510e-01 5.24 -1.453992015e-01 -1.453992015e-01 5.26 -1.413737775e-01 -1.413737775e-01 5.28 -1.374586539e-01 -1.374586539e-01 5.30 -1.336508816e-01 -1.336508816e-01 5.32 -1.299475859e-01 -1.299475859e-01 5.34 -1.263459649e-01 -1.263459649e-01 5.36 -1.228432881e-01 -1.228432881e-01 5.38 -1.194368944e-01 -1.194368944e-01 5.40 -1.161241910e-01 -1.161241910e-01 5.42 -1.129026514e-01 -1.129026514e-01 5.44 -1.097698145e-01 -1.097698145e-01 5.46 -8.639683474e-02 -8.639683474e-02 5.48 -8.407053970e-02 -8.407053970e-02 5.50 -8.180609679e-02 -8.180609679e-02 5.52 -7.960190435e-02 -7.960190435e-02 5.54 -7.745639984e-02 -7.745639984e-02 5.56 -7.536805898e-02 -7.536805898e-02 5.58 -7.333539499e-02 -7.333539499e-02 5.60 -7.135695774e-02 -7.135695774e-02 5.62 -6.943133301e-02 -6.943133301e-02 5.64 -6.755714164e-02 -6.755714164e-02 5.66 -6.573303882e-02 -6.573303882e-02 5.68 -6.395771331e-02 -6.395771331e-02 5.70 -6.222988669e-02 -6.222988669e-02 5.72 -6.054831262e-02 -6.054831262e-02 5.74 -5.891177611e-02 -5.891177611e-02 5.76 -5.731909283e-02 -5.731909283e-02 5.78 -5.576910837e-02 -5.576910837e-02 5.80 -5.426069760e-02 -5.426069760e-02 5.82 -5.279276395e-02 -5.279276395e-02 5.84 -5.136423875e-02 -5.136423875e-02 5.86 -4.997408060e-02 -4.997408060e-02 5.88 -4.862127471e-02 -4.862127471e-02 5.90 -4.730483226e-02 -4.730483226e-02 5.92 -4.602378982e-02 -4.602378982e-02 5.94 -4.477720870e-02 -4.477720870e-02 5.96 -4.356417438e-02 -4.356417438e-02 5.98 -4.238379593e-02 -4.238379593e-02 6.00 -4.123520543e-02 -4.123520543e-02