# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2020--Groger-R-Vitek-V-Dlouhy-A--Co-Cr-Fe-Mn-Ni
# implementation = 2020--Groger-R--Co-Cr-Fe-Mn-Ni--LAMMPS--ipr1
# composition = MnNi2
# 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  6.606899361e+04 
1.02  5.204357547e+04 
1.04  4.118092405e+04 
1.06  3.272687414e+04 
1.08  2.611658773e+04 
1.10  2.092471259e+04 
1.12  1.682925386e+04 
1.14  1.358522402e+04 
1.16  1.100531517e+04 
1.18  8.945645143e+03 
1.20  7.295188279e+03 
1.22  5.967897872e+03 
1.24  4.896804021e+03 
1.26  4.029571217e+03 
1.28  3.325138665e+03 
1.30  2.751167340e+03 
1.32  2.282093610e+03 
1.34  1.897637541e+03 
1.36  1.581654440e+03 
1.38  1.321248549e+03 
1.40  1.106085875e+03 
1.42  9.278588541e+02 
1.44  7.798684310e+02 
1.46  6.566969334e+02 
1.48  5.539504448e+02 
1.50  4.680556161e+02 
1.52  3.960982784e+02 
1.54  3.356956144e+02 
1.56  2.848940701e+02 
1.58  2.420879252e+02 
1.60  2.059544868e+02 
1.62  1.754015052e+02 
1.64  1.495246250e+02 
1.66  1.275735844e+02 
1.68  1.089246566e+02 
1.70  9.305822811e+01 
1.72  7.954062169e+01 
1.74  6.800923264e+01 
1.76  5.816022780e+01 
1.78  4.973842435e+01 
1.80  4.252920078e+01 
1.82  3.635180043e+01 
1.84  3.105361886e+01 
1.86  2.650565203e+01 
1.88  2.259873556e+01 
1.90  1.924037256e+01 
1.92  1.635209816e+01 
1.94  1.386716339e+01 
1.96  1.172860413e+01 
1.98  9.887685243e+00 
2.00  8.302765098e+00 
2.02  6.938249682e+00 
2.04  5.763682666e+00 
2.06  4.752892724e+00 
2.08  3.883411482e+00 
2.10  3.135936641e+00 
2.12  2.493858861e+00 
2.14  1.942877137e+00 
2.16  1.470673639e+00 
2.18  1.066638403e+00 
2.20  7.216360309e-01 
2.22  4.277822308e-01 
2.24  1.781881362e-01 
2.26 -3.312011849e-02 
2.28 -2.113034657e-01 
2.30 -3.608218105e-01 
2.32 -4.855237865e-01 
2.34 -5.887237807e-01 
2.36 -6.733199757e-01 
2.38 -7.418958506e-01 
2.40 -7.967050386e-01 
2.42 -8.397067910e-01 
2.44 -8.726021147e-01 
2.46 -8.968647284e-01 
2.48 -9.137675672e-01 
2.50 -9.244054626e-01 
2.52 -9.297145291e-01 
2.54 -9.304887159e-01 
2.56 -9.273939945e-01 
2.58 -9.210008806e-01 
2.60 -9.118247787e-01 
2.62 -9.003001266e-01 
2.64 -8.867947525e-01 
2.66 -8.716570655e-01 
2.68 -8.552020130e-01 
2.70 -8.377018307e-01 
2.72 -8.193818930e-01 
2.74 -8.004277424e-01 
2.76 -7.809987102e-01 
2.78 -7.612313820e-01 
2.80 -7.412422329e-01 
2.82 -7.211298741e-01 
2.84 -7.009769584e-01 
2.86 -6.808517930e-01 
2.88 -6.608140757e-01 
2.90 -6.409257260e-01 
2.92 -6.212432222e-01 
2.94 -6.018164091e-01 
2.96 -5.826892952e-01 
2.98 -5.639007155e-01 
3.00 -5.454848768e-01 
3.02 -5.274718010e-01 
3.04 -5.098876774e-01 
3.06 -4.927551357e-01 
3.08 -4.760934494e-01 
3.10 -4.599186779e-01 
3.12 -4.442437547e-01 
3.14 -4.290785285e-01 
3.16 -4.144297121e-01 
3.18 -4.002975774e-01 
3.20 -3.866744623e-01 
3.22 -3.735501854e-01 
3.24 -3.609123987e-01 
3.26 -3.487463802e-01 
3.28 -3.370348067e-01 
3.30 -3.257575089e-01 
3.32 -3.148930940e-01 
3.34 -3.044248699e-01 
3.36 -2.943359089e-01 
3.38 -2.846070886e-01 
3.40 -2.752168738e-01 
3.42 -2.661410895e-01 
3.44 -2.573526872e-01 
3.46 -2.488229186e-01 
3.48 -2.405371104e-01 
3.50 -2.324911828e-01 
3.52 -2.246816975e-01 
3.54 -2.171056293e-01 
3.56 -2.097603129e-01 
3.58 -2.026433869e-01 
3.60 -1.957527355e-01 
3.62 -1.890864273e-01 
3.64 -1.826426525e-01 
3.66 -1.764196588e-01 
3.68 -1.704156848e-01 
3.70 -1.646288929e-01 
3.72 -1.590573012e-01 
3.74 -1.536987133e-01 
3.76 -1.485506486e-01 
3.78 -1.436102713e-01 
3.80 -1.388743183e-01 
3.82 -1.343390276e-01 
3.84 -1.300000654e-01 
3.86 -1.258524534e-01 
3.88 -1.218904951e-01 
3.90 -1.181077029e-01 
3.92 -1.144967238e-01 
3.94 -1.110492662e-01 
3.96 -1.077560250e-01 
3.98 -1.046066086e-01 
4.00 -1.015894637e-01 
4.02 -9.869180181e-02 
4.04 -9.589952492e-02 
4.06 -9.319889455e-02 
4.08 -9.058414058e-02 
4.10 -8.805230006e-02 
4.12 -8.560051611e-02 
4.14 -8.322603324e-02 
4.16 -8.092619408e-02 
4.18 -7.869843607e-02 
4.20 -7.654028830e-02 
4.22 -7.444936838e-02 
4.24 -7.242337936e-02 
4.26 -7.046010679e-02 
4.28 -6.855741580e-02 
4.30 -6.671324833e-02 
4.32 -6.492562033e-02 
4.34 -6.319261916e-02 
4.36 -6.151240101e-02 
4.38 -5.988318838e-02 
4.40 -5.830326772e-02 
4.42 -5.677098703e-02 
4.44 -5.528475367e-02 
4.46 -5.384303214e-02 
4.48 -5.244415425e-02 
4.50 -5.108578867e-02 
4.52 -4.976556914e-02 
4.54 -4.848128821e-02 
4.56 -4.723089185e-02 
4.58 -4.601247391e-02 
4.60 -4.482427080e-02 
4.62 -4.366465614e-02 
4.64 -4.253213542e-02 
4.66 -4.142534073e-02 
4.68 -4.034302552e-02 
4.70 -3.928405944e-02 
4.72 -3.824742309e-02 
4.74 -3.723220298e-02 
4.76 -3.623758634e-02 
4.78 -3.526285611e-02 
4.80 -3.430738587e-02 
4.82 -3.337063485e-02 
4.84 -3.245214293e-02 
4.86 -3.155152570e-02 
4.88 -3.066846952e-02 
4.90 -2.980272663e-02 
4.92 -2.895411029e-02 
4.94 -2.812248988e-02 
4.96 -2.730778615e-02 
4.98 -2.650996632e-02 
5.00 -2.572903939e-02 
5.02 -2.496505130e-02 
5.04 -2.421808026e-02 
5.06 -2.348823196e-02 
5.08 -2.277563492e-02 
5.10 -2.208043577e-02 
5.12 -2.140279462e-02 
5.14 -2.074288036e-02 
5.16 -2.010084551e-02 
5.18 -1.947638149e-02 
5.20 -1.886876500e-02 
5.22 -1.827732570e-02 
5.24 -1.770146027e-02 
5.26 -1.714062552e-02 
5.28 -1.659433142e-02 
5.30 -1.606213418e-02 
5.32 -1.554362936e-02 
5.34 -1.503844492e-02 
5.36 -1.454623430e-02 
5.38 -1.406666947e-02 
5.40 -1.359943405e-02 
5.42 -1.314421634e-02 
5.44 -1.270070242e-02 
5.46 -1.226856923e-02 
5.48 -1.184747761e-02 
5.50 -1.143706542e-02 
5.52 -1.103694056e-02 
5.54 -1.064667412e-02 
5.56 -1.026579336e-02 
5.58 -9.893774875e-03 
5.60 -9.530037596e-03 
5.62 -9.173935913e-03 
5.64 -8.824752729e-03 
5.66 -8.481692538e-03 
5.68 -8.143874496e-03 
5.70 -7.810325501e-03 
5.72 -7.479975759e-03 
5.74 -7.152117595e-03 
5.76 -6.827001964e-03 
5.78 -6.505024034e-03 
5.80 -6.186594165e-03 
5.82 -5.872135197e-03 
5.84 -5.562079743e-03 
5.86 -5.256867469e-03 
5.88 -4.956942391e-03 
5.90 -4.662750159e-03 
5.92 -4.374735348e-03 
5.94 -4.093338742e-03 
5.96 -3.818994629e-03 
5.98 -3.552128087e-03 
6.00 -3.293152269e-03