# 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 = CoNi2W # 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 1.737188679e+02 1.737188679e+02 1.30 1.591583921e+02 1.591583921e+02 1.32 1.457837538e+02 1.457837538e+02 1.34 1.334911794e+02 1.334911794e+02 1.36 1.221859749e+02 1.221859749e+02 1.38 1.117827615e+02 1.117827615e+02 1.40 1.022046665e+02 1.022046665e+02 1.42 9.338246475e+01 9.338246475e+01 1.44 8.525378768e+01 8.525378768e+01 1.46 7.776224800e+01 7.776224800e+01 1.48 7.085665370e+01 7.085665370e+01 1.50 6.449045481e+01 6.449045481e+01 1.52 5.862141835e+01 5.862141835e+01 1.54 5.321143213e+01 5.321143213e+01 1.56 4.822617016e+01 4.822617016e+01 1.58 4.363447269e+01 4.363447269e+01 1.60 3.940768966e+01 3.940768966e+01 1.62 3.551928497e+01 3.551928497e+01 1.64 3.194464946e+01 3.194464946e+01 1.66 2.866088979e+01 2.866088979e+01 1.68 2.564668844e+01 2.564668844e+01 1.70 2.288228751e+01 2.288228751e+01 1.72 2.034816635e+01 2.034816635e+01 1.74 1.802547848e+01 1.802547848e+01 1.76 1.589677305e+01 1.589677305e+01 1.78 1.394489967e+01 1.394489967e+01 1.80 1.215385115e+01 1.215385115e+01 1.82 1.050929113e+01 1.050929113e+01 1.84 8.998700521e+00 8.998700521e+00 1.86 7.611304088e+00 7.611304088e+00 1.88 6.337822117e+00 6.337822117e+00 1.90 5.170136470e+00 5.170136470e+00 1.92 4.100959895e+00 4.100959895e+00 1.94 3.123575511e+00 3.123575511e+00 1.96 2.231677690e+00 2.231677690e+00 1.98 1.419301337e+00 1.419301337e+00 2.00 6.807960691e-01 6.807960691e-01 2.02 1.080229103e-02 1.080229103e-02 2.04 -5.957909750e-01 -5.957909750e-01 2.06 -1.143899129e+00 -1.143899129e+00 2.08 -1.638281918e+00 -1.638281918e+00 2.10 -2.083548389e+00 -2.083548389e+00 2.12 -2.484120539e+00 -2.484120539e+00 2.14 -2.844166451e+00 -2.844166451e+00 2.16 -3.167524889e+00 -3.167524889e+00 2.18 -3.457646178e+00 -3.457646178e+00 2.20 -3.717568421e+00 -3.717568421e+00 2.22 -3.949899863e+00 -3.949899863e+00 2.24 -4.156846320e+00 -4.156846320e+00 2.26 -4.340617197e+00 -4.340617197e+00 2.28 -4.503200651e+00 -4.503200651e+00 2.30 -4.646407133e+00 -4.646407133e+00 2.32 -4.771933151e+00 -4.771933151e+00 2.34 -4.881379491e+00 -4.881379491e+00 2.36 -4.975966792e+00 -4.975966792e+00 2.38 -5.056613184e+00 -5.056613184e+00 2.40 -5.124241659e+00 -5.124241659e+00 2.42 -5.179725789e+00 -5.179725789e+00 2.44 -5.223857089e+00 -5.223857089e+00 2.46 -5.257346516e+00 -5.257346516e+00 2.48 -5.280844165e+00 -5.280844165e+00 2.50 -5.294961313e+00 -5.294961313e+00 2.52 -5.300285860e+00 -5.300285860e+00 2.54 -5.297399996e+00 -5.297399996e+00 2.56 -5.286904243e+00 -5.286904243e+00 2.58 -5.269297008e+00 -5.269297008e+00 2.60 -5.245059137e+00 -5.245059137e+00 2.62 -5.214657690e+00 -5.214657690e+00 2.64 -5.178544890e+00 -5.178544890e+00 2.66 -5.137157457e+00 -5.137157457e+00 2.68 -5.090919140e+00 -5.090919140e+00 2.70 -5.040221229e+00 -5.040221229e+00 2.72 -4.985378288e+00 -4.985378288e+00 2.74 -4.926702429e+00 -4.926702429e+00 2.76 -4.864368941e+00 -4.864368941e+00 2.78 -4.798387080e+00 -4.798387080e+00 2.80 -4.728808933e+00 -4.728808933e+00 2.82 -4.655725931e+00 -4.655725931e+00 2.84 -4.579254587e+00 -4.579254587e+00 2.86 -4.499530467e+00 -4.499530467e+00 2.88 -4.416709246e+00 -4.416709246e+00 2.90 -4.330972274e+00 -4.330972274e+00 2.92 -4.242533682e+00 -4.242533682e+00 2.94 -4.151646409e+00 -4.151646409e+00 2.96 -4.058605130e+00 -4.058605130e+00 2.98 -3.963744707e+00 -3.963744707e+00 3.00 -3.867433348e+00 -3.867433348e+00 3.02 -3.770060337e+00 -3.770060337e+00 3.04 -3.672019033e+00 -3.672019033e+00 3.06 -3.573686934e+00 -3.573686934e+00 3.08 -3.475405571e+00 -3.475405571e+00 3.10 -3.377463479e+00 -3.377463479e+00 3.12 -3.280085027e+00 -3.280085027e+00 3.14 -3.183426553e+00 -3.183426553e+00 3.16 -3.087579606e+00 -3.087579606e+00 3.18 -2.992579764e+00 -2.992579764e+00 3.20 -2.898418927e+00 -2.898418927e+00 3.22 -2.805059125e+00 -2.805059125e+00 3.24 -2.712446387e+00 -2.712446387e+00 3.26 -2.620523829e+00 -2.620523829e+00 3.28 -2.529243540e+00 -2.529243540e+00 3.30 -2.438577095e+00 -2.438577095e+00 3.32 -2.348524538e+00 -2.348524538e+00 3.34 -2.259121630e+00 -2.259121630e+00 3.36 -2.170445028e+00 -2.170445028e+00 3.38 -2.082614964e+00 -2.082614964e+00 3.40 -1.995794998e+00 -1.995794998e+00 3.42 -1.910188522e+00 -1.910188522e+00 3.44 -1.826031932e+00 -1.826031932e+00 3.46 -1.743584699e+00 -1.743584699e+00 3.48 -1.663117002e+00 -1.663117002e+00 3.50 -1.584895876e+00 -1.584895876e+00 3.52 -1.509171133e+00 -1.509171133e+00 3.54 -1.436162346e+00 -1.436162346e+00 3.56 -1.366048090e+00 -1.366048090e+00 3.58 -1.298958314e+00 -1.298958314e+00 3.60 -1.234970352e+00 -1.234970352e+00 3.62 -1.174108617e+00 -1.174108617e+00 3.64 -1.116347650e+00 -1.116347650e+00 3.66 -1.061617906e+00 -1.061617906e+00 3.68 -1.009813526e+00 -1.009813526e+00 3.70 -9.608012635e-01 -9.608012635e-01 3.72 -9.144298310e-01 -9.144298310e-01 3.74 -8.705389832e-01 -8.705389832e-01 3.76 -8.289678086e-01 -8.289678086e-01 3.78 -7.895617777e-01 -7.895617777e-01 3.80 -7.521781994e-01 -7.521781994e-01 3.82 -7.166898247e-01 -7.166898247e-01 3.84 -6.829864466e-01 -6.829864466e-01 3.86 -6.509744958e-01 -6.509744958e-01 3.88 -6.205748305e-01 -6.205748305e-01 3.90 -5.917191352e-01 -5.917191352e-01 3.92 -5.643455361e-01 -5.643455361e-01 3.94 -5.383941404e-01 -5.383941404e-01 3.96 -5.138031717e-01 -5.138031717e-01 3.98 -4.905062125e-01 -4.905062125e-01 4.00 -4.684307993e-01 -4.684307993e-01 4.02 -4.474983477e-01 -4.474983477e-01 4.04 -4.276251638e-01 -4.276251638e-01 4.06 -4.087241806e-01 -4.087241806e-01 4.08 -3.907070434e-01 -3.907070434e-01 4.10 -3.734862311e-01 -3.734862311e-01 4.12 -3.569770007e-01 -3.569770007e-01 4.14 -3.410990457e-01 -3.410990457e-01 4.16 -3.257778391e-01 -3.257778391e-01 4.18 -3.109456786e-01 -3.109456786e-01 4.20 -2.965424705e-01 -2.965424705e-01 4.22 -2.825162870e-01 -2.825162870e-01 4.24 -2.688237201e-01 -2.688237201e-01 4.26 -2.554300499e-01 -2.554300499e-01 4.28 -2.423092439e-01 -2.423092439e-01 4.30 -2.294438205e-01 -2.294438205e-01 4.32 -2.168246186e-01 -2.168246186e-01 4.34 -2.044505208e-01 -2.044505208e-01 4.36 -1.923281594e-01 -1.923281594e-01 4.38 -1.804715885e-01 -1.804715885e-01 4.40 -1.689018511e-01 -1.689018511e-01 4.42 -1.576463191e-01 -1.576463191e-01 4.44 -1.467376675e-01 -1.467376675e-01 4.46 -1.362123758e-01 -1.362123758e-01 4.48 -1.261087336e-01 -1.261087336e-01 4.50 -1.164644351e-01 -1.164644351e-01 4.52 -1.073139677e-01 -1.073139677e-01 4.54 -9.868607071e-02 -9.868607071e-02 4.56 -9.060156598e-02 -9.060156598e-02 4.58 -8.307181681e-02 -8.307181681e-02 4.60 -7.609797334e-02 -7.609797334e-02 4.62 -6.967104321e-02 -6.967104321e-02 4.64 -6.377270832e-02 -6.377270832e-02 4.66 -5.837672089e-02 -5.837672089e-02 4.68 -5.345066824e-02 -5.345066824e-02 4.70 -4.895789783e-02 -4.895789783e-02 4.72 -4.485940910e-02 -4.485940910e-02 4.74 -4.111524163e-02 -4.111524163e-02 4.76 -3.768673769e-02 -3.768673769e-02 4.78 -3.453761000e-02 -3.453761000e-02 4.80 -3.163441300e-02 -3.163441300e-02 4.82 -2.894727827e-02 -2.894727827e-02 4.84 -2.645036882e-02 -2.645036882e-02 4.86 -2.412208708e-02 -2.412208708e-02 4.88 -2.194506372e-02 -2.194506372e-02 4.90 -1.990595053e-02 -1.990595053e-02 4.92 -1.799503890e-02 -1.799503890e-02 4.94 -1.620572962e-02 -1.620572962e-02 4.96 -1.453373307e-02 -1.453373307e-02 4.98 -1.297657029e-02 -1.297657029e-02 5.00 -1.153301244e-02 -1.153301244e-02 5.02 -1.020215103e-02 -1.020215103e-02 5.04 -8.982813814e-03 -8.982813814e-03 5.06 -7.873124124e-03 -7.873124124e-03 5.08 -6.870224661e-03 -6.870224661e-03 5.10 -5.970165689e-03 -5.970165689e-03 5.12 -5.167937960e-03 -5.167937960e-03 5.14 -4.457617145e-03 -4.457617145e-03 5.16 -3.832580337e-03 -3.832580337e-03 5.18 -3.285755950e-03 -3.285755950e-03 5.20 -2.809874293e-03 -2.809874293e-03 5.22 -2.397694850e-03 -2.397694850e-03 5.24 -2.042195600e-03 -2.042195600e-03 5.26 -1.736717973e-03 -1.736717973e-03 5.28 -1.475067417e-03 -1.475067417e-03 5.30 -1.251573757e-03 -1.251573757e-03 5.32 -1.061117852e-03 -1.061117852e-03 5.34 -8.991318584e-04 -8.991318584e-04 5.36 -7.615801608e-04 -7.615801608e-04 5.38 -6.449272554e-04 -6.449272554e-04 5.40 -5.460977319e-04 -5.460977319e-04 5.42 -4.624323892e-04 -4.624323892e-04 5.44 -3.916434504e-04 -3.916434504e-04 5.46 -3.317709431e-04 -3.317709431e-04 5.48 -2.811415876e-04 -2.811415876e-04 5.50 -2.383309754e-04 -2.383309754e-04 5.52 -2.021294119e-04 -2.021294119e-04 5.54 -1.715115110e-04 -1.715115110e-04 5.56 -1.456094372e-04 -1.456094372e-04 5.58 -1.236895736e-04 -1.236895736e-04 5.60 -1.051323269e-04 -1.051323269e-04 5.62 -8.941475327e-05 -8.941475327e-05 5.64 -7.609568386e-05 -7.609568386e-05 5.66 -6.480304131e-05 -6.480304131e-05 5.68 -5.522305890e-05 -5.522305890e-05 5.70 -4.709114140e-05 -4.709114140e-05 5.72 -4.018413362e-05 -4.018413362e-05 5.74 -3.431379079e-05 -3.431379079e-05 5.76 -2.932127108e-05 -2.932127108e-05 5.78 -2.507249489e-05 -2.507249489e-05 5.80 -2.145423748e-05 -2.145423748e-05 5.82 -1.837084066e-05 -1.837084066e-05 5.84 -1.574144639e-05 -1.574144639e-05 5.86 -1.349766991e-05 -1.349766991e-05 5.88 -1.158164256e-05 -1.158164256e-05 5.90 -9.944365552e-06 -9.944365552e-06 5.92 -8.544324943e-06 -8.544324943e-06 5.94 -7.346326088e-06 -7.346326088e-06 5.96 -6.320512524e-06 -6.320512524e-06 5.98 -5.441539748e-06 -5.441539748e-06 6.00 -4.687879129e-06 -4.687879129e-06