# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2022--Mendelev-M-I--Ni-Nb
# implementation = 2022--Mendelev-M-I--Ni-Nb--LAMMPS--ipr1
# composition = NbNi2
# 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    C1--CaF2--fluori 
0.50  nan             
0.52  nan             
0.54  nan             
0.56  nan             
0.58  nan             
0.60  nan             
0.62  nan             
0.64  nan             
0.66  nan             
0.68  nan             
0.70  nan             
0.72  nan             
0.74  nan             
0.76  nan             
0.78  nan             
0.80  nan             
0.82  nan             
0.84  nan             
0.86  nan             
0.88  nan             
0.90  nan             
0.92  nan             
0.94  nan             
0.96  nan             
0.98  nan             
1.00  nan             
1.02  nan             
1.04  8.042203114e+04 
1.06  7.426184703e+04 
1.08  6.855233604e+04 
1.10  6.325316970e+04 
1.12  5.832819286e+04 
1.14  5.374497169e+04 
1.16  4.947468858e+04 
1.18  4.549156120e+04 
1.20  4.177218372e+04 
1.22  3.829533659e+04 
1.24  3.504179780e+04 
1.26  3.199394729e+04 
1.28  2.913560593e+04 
1.30  2.645198917e+04 
1.32  2.392958031e+04 
1.34  2.155611285e+04 
1.36  1.932060804e+04 
1.38  1.721335147e+04 
1.40  1.522557916e+04 
1.42  1.341962214e+04 
1.44  1.186286165e+04 
1.46  1.051097673e+04 
1.48  9.327851545e+03 
1.50  8.284500864e+03 
1.52  7.357546263e+03 
1.54  6.528072614e+03 
1.56  5.780722578e+03 
1.58  5.102989913e+03 
1.60  4.484667411e+03 
1.62  3.917395483e+03 
1.64  3.394291025e+03 
1.66  2.909681466e+03 
1.68  2.458868276e+03 
1.70  2.037896224e+03 
1.72  1.643435661e+03 
1.74  1.277810804e+03 
1.76  9.810603998e+02 
1.78  7.491120711e+02 
1.80  5.684948900e+02 
1.82  4.284371007e+02 
1.84  3.203380991e+02 
1.86  2.373437234e+02 
1.88  1.740006621e+02 
1.90  1.259779957e+02 
1.92  8.984431361e+01 
1.94  6.288862022e+01 
1.96  4.297593886e+01 
1.98  2.843101372e+01 
2.00  1.794468127e+01 
2.02  1.049792949e+01 
2.04  5.299907606e+00 
2.06  1.740270042e+00 
2.08 -6.474890252e-01 
2.10 -2.215768861e+00 
2.12 -3.220548476e+00 
2.14 -3.849946016e+00 
2.16 -4.243570308e+00 
2.18 -4.497312563e+00 
2.20 -4.673569290e+00 
2.22 -4.809490065e+00 
2.24 -4.923545551e+00 
2.26 -5.021758842e+00 
2.28 -5.105879405e+00 
2.30 -5.176632894e+00 
2.32 -5.234330559e+00 
2.34 -5.279084020e+00 
2.36 -5.311026653e+00 
2.38 -5.331108573e+00 
2.40 -5.341248937e+00 
2.42 -5.343812390e+00 
2.44 -5.340562297e+00 
2.46 -5.332307881e+00 
2.48 -5.319155270e+00 
2.50 -5.300956348e+00 
2.52 -5.277803340e+00 
2.54 -5.250169996e+00 
2.56 -5.219052093e+00 
2.58 -5.185766748e+00 
2.60 -5.151618432e+00 
2.62 -5.117642185e+00 
2.64 -5.084541243e+00 
2.66 -5.052662395e+00 
2.68 -5.021838057e+00 
2.70 -4.991489859e+00 
2.72 -4.960774866e+00 
2.74 -4.928904297e+00 
2.76 -4.895615310e+00 
2.78 -4.861126778e+00 
2.80 -4.825888619e+00 
2.82 -4.790470003e+00 
2.84 -4.755447221e+00 
2.86 -4.721238073e+00 
2.88 -4.688062353e+00 
2.90 -4.655949253e+00 
2.92 -4.624737156e+00 
2.94 -4.594063152e+00 
2.96 -4.563358722e+00 
2.98 -4.531980985e+00 
3.00 -4.499327224e+00 
3.02 -4.464818185e+00 
3.04 -4.427924702e+00 
3.06 -4.388218769e+00 
3.08 -4.345389414e+00 
3.10 -4.299255226e+00 
3.12 -4.249780798e+00 
3.14 -4.197121779e+00 
3.16 -4.141587731e+00 
3.18 -4.083517796e+00 
3.20 -4.023259648e+00 
3.22 -3.961167135e+00 
3.24 -3.897596453e+00 
3.26 -3.832901072e+00 
3.28 -3.767425746e+00 
3.30 -3.701499923e+00 
3.32 -3.635430883e+00 
3.34 -3.569496944e+00 
3.36 -3.503941072e+00 
3.38 -3.438965258e+00 
3.40 -3.374726002e+00 
3.42 -3.311331286e+00 
3.44 -3.248839389e+00 
3.46 -3.187259937e+00 
3.48 -3.126557561e+00 
3.50 -3.066658568e+00 
3.52 -3.007461002e+00 
3.54 -2.948848529e+00 
3.56 -2.890708534e+00 
3.58 -2.832954862e+00 
3.60 -2.775555628e+00 
3.62 -2.718563871e+00 
3.64 -2.662101535e+00 
3.66 -2.606293846e+00 
3.68 -2.551239962e+00 
3.70 -2.496995484e+00 
3.72 -2.443594538e+00 
3.74 -2.391067744e+00 
3.76 -2.339442666e+00 
3.78 -2.288743633e+00 
3.80 -2.238991636e+00 
3.82 -2.190204314e+00 
3.84 -2.142396001e+00 
3.86 -2.095577831e+00 
3.88 -2.049757874e+00 
3.90 -2.004941288e+00 
3.92 -1.961130462e+00 
3.94 -1.918325112e+00 
3.96 -1.876522313e+00 
3.98 -1.835716412e+00 
4.00 -1.795898809e+00 
4.02 -1.757057531e+00 
4.04 -1.719176582e+00 
4.06 -1.682234998e+00 
4.08 -1.646205568e+00 
4.10 -1.611053155e+00 
4.12 -1.576732559e+00 
4.14 -1.543185860e+00 
4.16 -1.510339172e+00 
4.18 -1.478101635e+00 
4.20 -1.446382137e+00 
4.22 -1.415101326e+00 
4.24 -1.384189857e+00 
4.26 -1.353587672e+00 
4.28 -1.323246162e+00 
4.30 -1.293127961e+00 
4.32 -1.263206014e+00 
4.34 -1.233462602e+00 
4.36 -1.203888340e+00 
4.38 -1.174481165e+00 
4.40 -1.145245337e+00 
4.42 -1.116190440e+00 
4.44 -1.087330430e+00 
4.46 -1.058682712e+00 
4.48 -1.030267266e+00 
4.50 -1.002105831e+00 
4.52 -9.742211486e-01 
4.54 -9.466362803e-01 
4.56 -9.193739897e-01 
4.58 -8.924562038e-01 
4.60 -8.659035505e-01 
4.62 -8.397349730e-01 
4.64 -8.139674208e-01 
4.66 -7.886156130e-01 
4.68 -7.636918710e-01 
4.70 -7.392060315e-01 
4.72 -7.151653995e-01 
4.74 -6.915747651e-01 
4.76 -6.684364739e-01 
4.78 -6.457505280e-01 
4.80 -6.235146833e-01 
4.82 -6.017246264e-01 
4.84 -5.803741035e-01 
4.86 -5.594550270e-01 
4.88 -5.389575795e-01 
4.90 -5.188702724e-01 
4.92 -4.991799271e-01 
4.94 -4.798715773e-01 
4.96 -4.609283036e-01 
4.98 -4.423308798e-01 
5.00 -4.240572476e-01 
5.02 -4.060825270e-01 
5.04 -3.883860660e-01 
5.06 -3.709582282e-01 
5.08 -3.537981251e-01 
5.10 -3.369143004e-01 
5.12 -3.203217802e-01 
5.14 -3.040381786e-01 
5.16 -2.880884324e-01 
5.18 -2.724895999e-01 
5.20 -2.572652645e-01 
5.22 -2.424292939e-01 
5.24 -2.279807660e-01 
5.26 -2.139699740e-01 
5.28 -2.001772759e-01 
5.30 -1.867175635e-01 
5.32 -1.740684069e-01 
5.34 -1.625672367e-01 
5.36 -1.524298207e-01 
5.38 -1.425911107e-01 
5.40 -1.320733075e-01 
5.42 -1.206035981e-01 
5.44 -1.084849226e-01 
5.46 -9.609147337e-02 
5.48 -8.347401141e-02 
5.50 -7.057353347e-02 
5.52 -5.753758864e-02 
5.54 -4.461021394e-02 
5.56 -3.214431606e-02 
5.58 -2.081555096e-02 
5.60 -1.102990666e-02 
5.62 -2.940759415e-03 
5.64  3.457910528e-03 
5.66  8.266725636e-03 
5.68  1.163715311e-02 
5.70  1.374299198e-02 
5.72  1.476263843e-02 
5.74  1.486874579e-02 
5.76  1.422276962e-02 
5.78  1.297258313e-02 
5.80  1.125188928e-02 
5.82  9.180569892e-03 
5.84  6.865419545e-03 
5.86  4.400934928e-03 
5.88  1.869984663e-03 
5.90 -6.557126972e-04 
5.92 -3.115311552e-03 
5.94 -5.458736961e-03 
5.96 -7.646715467e-03 
5.98 -9.650894401e-03 
6.00 -1.145400978e-02