# 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 = CoFeNi2 # 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 2.062766139e+02 2.062766139e+02 1.10 1.899400543e+02 1.899400543e+02 1.12 1.746566500e+02 1.746566500e+02 1.14 1.605403897e+02 1.605403897e+02 1.16 1.477323251e+02 1.477323251e+02 1.18 1.358699557e+02 1.358699557e+02 1.20 1.253038101e+02 1.253038101e+02 1.22 1.152148335e+02 1.152148335e+02 1.24 1.058311463e+02 1.058311463e+02 1.26 9.734434997e+01 9.734433825e+01 1.28 8.947087654e+01 8.947087654e+01 1.30 8.220970944e+01 8.220970944e+01 1.32 7.538327995e+01 7.538327995e+01 1.34 6.932836337e+01 6.932836337e+01 1.36 6.348265500e+01 6.348265500e+01 1.38 5.810533268e+01 5.810533268e+01 1.40 5.311775360e+01 5.311775360e+01 1.42 4.851000284e+01 4.851000284e+01 1.44 4.448994326e+01 4.448994326e+01 1.46 4.070431522e+01 4.070431522e+01 1.48 3.702351418e+01 3.702351418e+01 1.50 3.362239385e+01 3.362239385e+01 1.52 3.056510662e+01 3.056510662e+01 1.54 2.781811585e+01 2.781811585e+01 1.56 2.510849231e+01 2.510849231e+01 1.58 2.263442252e+01 2.263442252e+01 1.60 2.031955458e+01 2.031955458e+01 1.62 1.818181089e+01 1.818181089e+01 1.64 1.620802016e+01 1.620802016e+01 1.66 1.446836801e+01 1.446836801e+01 1.68 1.286097309e+01 1.286097309e+01 1.70 1.129466082e+01 1.129466082e+01 1.72 9.850643748e+00 9.850643748e+00 1.74 8.602916504e+00 8.602916504e+00 1.76 7.369544016e+00 7.369544016e+00 1.78 6.234356398e+00 6.234356398e+00 1.80 5.190218807e+00 5.190218807e+00 1.82 4.341025216e+00 4.341025216e+00 1.84 3.449776179e+00 3.449776179e+00 1.86 2.797789754e+00 2.797789754e+00 1.88 2.033680434e+00 2.033680434e+00 1.90 1.334142320e+00 1.334142320e+00 1.92 6.944816722e-01 6.944816722e-01 1.94 1.528101255e-01 1.528101255e-01 1.96 -3.834322427e-01 -3.834322427e-01 1.98 -8.716358997e-01 -8.716358997e-01 2.00 -1.315306766e+00 -1.315306766e+00 2.02 -1.717700564e+00 -1.717700564e+00 2.04 -2.081841511e+00 -2.081841511e+00 2.06 -2.410539503e+00 -2.410539503e+00 2.08 -2.706405921e+00 -2.706405921e+00 2.10 -2.897279103e+00 -2.897278821e+00 2.12 -3.099733873e+00 -3.099733873e+00 2.14 -3.319536623e+00 -3.319536623e+00 2.16 -3.514578982e+00 -3.514578982e+00 2.18 -3.686727695e+00 -3.686727695e+00 2.20 -3.837719007e+00 -3.837719007e+00 2.22 -3.969167928e+00 -3.969167928e+00 2.24 -3.997608137e+00 -3.997608137e+00 2.26 -4.100633132e+00 -4.100633132e+00 2.28 -4.187856480e+00 -4.187856480e+00 2.30 -4.260521242e+00 -4.260521242e+00 2.32 -4.319783758e+00 -4.319783758e+00 2.34 -4.366719654e+00 -4.366719654e+00 2.36 -4.402329417e+00 -4.402329417e+00 2.38 -4.427543567e+00 -4.427543567e+00 2.40 -4.443227456e+00 -4.443227456e+00 2.42 -4.450185737e+00 -4.450185737e+00 2.44 -4.360215424e+00 -4.360215424e+00 2.46 -4.357918864e+00 -4.357918864e+00 2.48 -4.348582639e+00 -4.348582639e+00 2.50 -4.332834183e+00 -4.332834183e+00 2.52 -4.227129827e+00 -4.227129827e+00 2.54 -4.205803622e+00 -4.205803622e+00 2.56 -4.179329141e+00 -4.179329141e+00 2.58 -4.148196868e+00 -4.148196868e+00 2.60 -4.112862141e+00 -4.112862141e+00 2.62 -4.073747509e+00 -4.073747509e+00 2.64 -4.031244926e+00 -4.031244926e+00 2.66 -3.985717810e+00 -3.985717810e+00 2.68 -3.937502950e+00 -3.937502950e+00 2.70 -3.886912299e+00 -3.886912299e+00 2.72 -3.834234636e+00 -3.834234636e+00 2.74 -3.758266295e+00 -3.758266295e+00 2.76 -3.703496130e+00 -3.703496130e+00 2.78 -3.647302880e+00 -3.647302880e+00 2.80 -3.589901911e+00 -3.589901911e+00 2.82 -3.531491961e+00 -3.531491961e+00 2.84 -3.472256259e+00 -3.472256259e+00 2.86 -3.412363580e+00 -3.412363580e+00 2.88 -3.351969219e+00 -3.351969219e+00 2.90 -3.291215907e+00 -3.291215907e+00 2.92 -3.230234670e+00 -3.230234670e+00 2.94 -3.169145630e+00 -3.169145630e+00 2.96 -3.108058744e+00 -3.108058744e+00 2.98 -3.047074514e+00 -3.047074514e+00 3.00 -2.986284633e+00 -2.986284633e+00 3.02 -2.925772595e+00 -2.925772595e+00 3.04 -2.865614273e+00 -2.865614273e+00 3.06 -2.805878444e+00 -2.805878444e+00 3.08 -2.746627292e+00 -2.746627292e+00 3.10 -2.687916875e+00 -2.687916875e+00 3.12 -2.629797557e+00 -2.629797557e+00 3.14 -2.572314420e+00 -2.572314420e+00 3.16 -2.486646997e+00 -2.486646997e+00 3.18 -2.432073268e+00 -2.432073268e+00 3.20 -2.378163074e+00 -2.378163074e+00 3.22 -2.324948083e+00 -2.324948083e+00 3.24 -2.272456129e+00 -2.272456129e+00 3.26 -2.220711501e+00 -2.220711501e+00 3.28 -2.169735201e+00 -2.169735201e+00 3.30 -2.032778053e+00 -2.032778053e+00 3.32 -1.987771010e+00 -1.987771010e+00 3.34 -1.943357563e+00 -1.943357563e+00 3.36 -1.899558881e+00 -1.899558881e+00 3.38 -1.856393384e+00 -1.856393384e+00 3.40 -1.813876946e+00 -1.813876946e+00 3.42 -1.772023080e+00 -1.772023080e+00 3.44 -1.730843117e+00 -1.730843117e+00 3.46 -1.690346368e+00 -1.690346368e+00 3.48 -1.650540280e+00 -1.650540280e+00 3.50 -1.611430577e+00 -1.611430577e+00 3.52 -1.573021398e+00 -1.573021398e+00 3.54 -1.535315421e+00 -1.535315421e+00 3.56 -1.498313981e+00 -1.498313981e+00 3.58 -1.462017181e+00 -1.462017181e+00 3.60 -1.426423994e+00 -1.426423994e+00 3.62 -1.391532358e+00 -1.391532358e+00 3.64 -1.357339267e+00 -1.357339267e+00 3.66 -1.323840856e+00 -1.323840856e+00 3.68 -1.291032474e+00 -1.291032474e+00 3.70 -1.258908761e+00 -1.258908761e+00 3.72 -1.227463718e+00 -1.227463718e+00 3.74 -1.196690761e+00 -1.196690761e+00 3.76 -1.166582790e+00 -1.166582790e+00 3.78 -1.137132238e+00 -1.137132238e+00 3.80 -1.108331122e+00 -1.108331122e+00 3.82 -1.080171093e+00 -1.080171093e+00 3.84 -1.052643478e+00 -1.052643478e+00 3.86 -9.813569169e-01 -9.813569169e-01 3.88 -9.569844282e-01 -9.569844282e-01 3.90 -9.331342722e-01 -9.331342722e-01 3.92 -9.098003826e-01 -9.098003826e-01 3.94 -8.869763979e-01 -8.869763979e-01 3.96 -8.646556947e-01 -8.646556947e-01 3.98 -8.428314194e-01 -8.428314194e-01 4.00 -8.214965174e-01 -8.214965174e-01 4.02 -8.006437600e-01 -8.006437600e-01 4.04 -7.802657699e-01 -7.802657699e-01 4.06 -7.603550447e-01 -7.603550447e-01 4.08 -7.409039779e-01 -7.409039779e-01 4.10 -7.219048797e-01 -7.219048797e-01 4.12 -7.033499953e-01 -7.033499953e-01 4.14 -6.852315219e-01 -6.852315219e-01 4.16 -6.675416245e-01 -6.675416245e-01 4.18 -6.502724508e-01 -6.502724508e-01 4.20 -6.334161445e-01 -6.334161445e-01 4.22 -6.169648574e-01 -6.169648574e-01 4.24 -6.009107610e-01 -6.009107610e-01 4.26 -5.852460567e-01 -5.852460567e-01 4.28 -5.699629855e-01 -5.699629855e-01 4.30 -5.550538364e-01 -5.550538364e-01 4.32 -5.405109543e-01 -5.405109543e-01 4.34 -5.263267473e-01 -5.263267473e-01 4.36 -5.124936932e-01 -5.124936932e-01 4.38 -4.990043450e-01 -4.990043450e-01 4.40 -4.858513366e-01 -4.858513366e-01 4.42 -4.730273871e-01 -4.730273871e-01 4.44 -4.605253051e-01 -4.605253051e-01 4.46 -4.483379927e-01 -4.483379927e-01 4.48 -4.364584484e-01 -4.364584484e-01 4.50 -4.248797699e-01 -4.248797699e-01 4.52 -4.135951569e-01 -4.135951569e-01 4.54 -4.025979131e-01 -4.025979131e-01 4.56 -3.918814477e-01 -3.918814477e-01 4.58 -3.814392773e-01 -3.814392773e-01 4.60 -3.712650268e-01 -3.712650268e-01 4.62 -3.613524304e-01 -3.613524304e-01 4.64 -3.516953323e-01 -3.516953323e-01 4.66 -3.422876871e-01 -3.422876871e-01 4.68 -3.331235602e-01 -3.331235602e-01 4.70 -3.241971278e-01 -3.241971278e-01 4.72 -3.155026766e-01 -3.155026766e-01 4.74 -3.070346038e-01 -3.070346038e-01 4.76 -2.987874167e-01 -2.987874167e-01 4.78 -2.907557317e-01 -2.907557317e-01 4.80 -2.829342743e-01 -2.829342743e-01 4.82 -2.753178777e-01 -2.753178777e-01 4.84 -2.679014823e-01 -2.679014823e-01 4.86 -2.606801346e-01 -2.606801346e-01 4.88 -2.536489861e-01 -2.536489861e-01 4.90 -2.468032923e-01 -2.468032923e-01 4.92 -2.401384114e-01 -2.401384114e-01 4.94 -2.336498029e-01 -2.336498029e-01 4.96 -2.273330265e-01 -2.273330265e-01 4.98 -2.211837407e-01 -2.211837407e-01 5.00 -2.151977015e-01 -2.151977015e-01 5.02 -2.093707606e-01 -2.093707606e-01 5.04 -2.036988644e-01 -2.036988644e-01 5.06 -1.981780521e-01 -1.981780521e-01 5.08 -1.928044544e-01 -1.928044544e-01 5.10 -1.875742921e-01 -1.875742921e-01 5.12 -1.824838743e-01 -1.824838743e-01 5.14 -1.775295969e-01 -1.775295969e-01 5.16 -1.727079413e-01 -1.727079413e-01 5.18 -1.680154723e-01 -1.680154723e-01 5.20 -1.634488373e-01 -1.634488373e-01 5.22 -1.590047639e-01 -1.590047639e-01 5.24 -1.546800591e-01 -1.546800591e-01 5.26 -1.504716071e-01 -1.504716071e-01 5.28 -1.463763684e-01 -1.463763684e-01 5.30 -1.423913776e-01 -1.423913776e-01 5.32 -1.385137424e-01 -1.385137424e-01 5.34 -1.347406419e-01 -1.347406419e-01 5.36 -1.310693249e-01 -1.310693249e-01 5.38 -1.274971089e-01 -1.274971089e-01 5.40 -1.240213782e-01 -1.240213782e-01 5.42 -1.206395826e-01 -1.206395826e-01 5.44 -1.173492360e-01 -1.173492360e-01 5.46 -9.204850862e-02 -9.204850862e-02 5.48 -8.961389687e-02 -8.961389687e-02 5.50 -8.724280591e-02 -8.724280591e-02 5.52 -8.493362536e-02 -8.493362536e-02 5.54 -8.268478308e-02 -8.268478308e-02 5.56 -8.049474447e-02 -8.049474447e-02 5.58 -7.836201165e-02 -7.836201165e-02 5.60 -7.628512276e-02 -7.628512276e-02 5.62 -7.426265117e-02 -7.426265117e-02 5.64 -7.229320478e-02 -7.229320478e-02 5.66 -7.037542526e-02 -7.037542526e-02 5.68 -6.850798738e-02 -6.850798738e-02 5.70 -6.668959822e-02 -6.668959822e-02 5.72 -6.491899655e-02 -6.491899655e-02 5.74 -6.319495211e-02 -6.319495211e-02 5.76 -6.151626493e-02 -6.151626493e-02 5.78 -5.988176463e-02 -5.988176463e-02 5.80 -5.829030984e-02 -5.829030984e-02 5.82 -5.674078745e-02 -5.674078745e-02 5.84 -5.523211206e-02 -5.523211206e-02 5.86 -5.376322531e-02 -5.376322531e-02 5.88 -5.233309527e-02 -5.233309527e-02 5.90 -5.094071583e-02 -5.094071583e-02 5.92 -4.958510610e-02 -4.958510610e-02 5.94 -4.826530986e-02 -4.826530986e-02 5.96 -4.698039495e-02 -4.698039495e-02 5.98 -4.572945272e-02 -4.572945272e-02 6.00 -4.451159748e-02 -4.451159748e-02