# 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 = Mn2Ni
# 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  7.078746785e+04 
1.02  5.576444427e+04 
1.04  4.412870887e+04 
1.06  3.507261413e+04 
1.08  2.799125826e+04 
1.10  2.242911260e+04 
1.12  1.804133308e+04 
1.14  1.456554306e+04 
1.16  1.180113594e+04 
1.18  9.594011032e+03 
1.20  7.825255025e+03 
1.22  6.402705889e+03 
1.24  5.254632266e+03 
1.26  4.324976032e+03 
1.28  3.569754368e+03 
1.30  2.954325782e+03 
1.32  2.451305565e+03 
1.34  2.038968232e+03 
1.36  1.700017587e+03 
1.38  1.420637472e+03 
1.40  1.189755774e+03 
1.42  9.984711046e+02 
1.44  8.396051758e+02 
1.46  7.073523816e+02 
1.48  5.970038516e+02 
1.50  5.047297964e+02 
1.52  4.274066632e+02 
1.54  3.624802065e+02 
1.56  3.078561527e+02 
1.58  2.618129731e+02 
1.60  2.229324234e+02 
1.62  1.900432286e+02 
1.64  1.621755189e+02 
1.66  1.385245906e+02 
1.68  1.184213728e+02 
1.70  1.013084015e+02 
1.72  8.672033399e+01 
1.74  7.426801845e+01 
1.76  6.362532322e+01 
1.78  5.451829664e+01 
1.80  4.671648629e+01 
1.82  4.002575623e+01 
1.84  3.428217450e+01 
1.86  2.934712818e+01 
1.88  2.510328624e+01 
1.90  2.145119810e+01 
1.92  1.830646763e+01 
1.94  1.559728176e+01 
1.96  1.326234526e+01 
1.98  1.124921111e+01 
2.00  9.513051358e+00 
2.02  8.015531943e+00 
2.04  6.723836357e+00 
2.06  5.609758626e+00 
2.08  4.649073607e+00 
2.10  3.820959836e+00 
2.12  3.107492428e+00 
2.14  2.493229578e+00 
2.16  1.964862841e+00 
2.18  1.510920881e+00 
2.20  1.121518300e+00 
2.22  7.881168953e-01 
2.24  5.032568941e-01 
2.26  2.604652483e-01 
2.28  5.414394418e-02 
2.30 -1.205501258e-01 
2.32 -2.678020591e-01 
2.34 -3.912221223e-01 
2.36 -4.939685300e-01 
2.38 -5.788530413e-01 
2.40 -6.483305007e-01 
2.42 -7.045378193e-01 
2.44 -7.493331033e-01 
2.46 -7.843292103e-01 
2.48 -8.109225193e-01 
2.50 -8.303175865e-01 
2.52 -8.435482581e-01 
2.54 -8.514957312e-01 
2.56 -8.549040623e-01 
2.58 -8.544131739e-01 
2.60 -8.505992180e-01 
2.62 -8.439507468e-01 
2.64 -8.348838842e-01 
2.66 -8.237901669e-01 
2.68 -8.110230898e-01 
2.70 -7.968893746e-01 
2.72 -7.816452767e-01 
2.74 -7.655040176e-01 
2.76 -7.486497624e-01 
2.78 -7.312414005e-01 
2.80 -7.134154604e-01 
2.82 -6.952886037e-01 
2.84 -6.769597509e-01 
2.86 -6.585118901e-01 
2.88 -6.400179381e-01 
2.90 -6.215516195e-01 
2.92 -6.031800372e-01 
2.94 -5.849626257e-01 
2.96 -5.669520563e-01 
2.98 -5.491949972e-01 
3.00 -5.317327460e-01 
3.02 -5.146017503e-01 
3.04 -4.978340301e-01 
3.06 -4.814575135e-01 
3.08 -4.654962965e-01 
3.10 -4.499708363e-01 
3.12 -4.348980848e-01 
3.14 -4.202915714e-01 
3.16 -4.061613903e-01 
3.18 -3.925109622e-01 
3.20 -3.793355867e-01 
3.22 -3.666278301e-01 
3.24 -3.543778982e-01 
3.26 -3.425734527e-01 
3.28 -3.311994060e-01 
3.30 -3.202376957e-01 
3.32 -3.096688646e-01 
3.34 -2.994777967e-01 
3.36 -2.896489501e-01 
3.38 -2.801644672e-01 
3.40 -2.710039667e-01 
3.42 -2.621443264e-01 
3.44 -2.535594583e-01 
3.46 -2.452214908e-01 
3.48 -2.371165503e-01 
3.50 -2.292412864e-01 
3.52 -2.215929269e-01 
3.54 -2.141690544e-01 
3.56 -2.069675588e-01 
3.58 -1.999865862e-01 
3.60 -1.932244847e-01 
3.62 -1.866797479e-01 
3.64 -1.803509560e-01 
3.66 -1.742367147e-01 
3.68 -1.683355929e-01 
3.70 -1.626460581e-01 
3.72 -1.571664114e-01 
3.74 -1.518947202e-01 
3.76 -1.468287511e-01 
3.78 -1.419659013e-01 
3.80 -1.373031288e-01 
3.82 -1.328368830e-01 
3.84 -1.285630340e-01 
3.86 -1.244768018e-01 
3.88 -1.205726844e-01 
3.90 -1.168443867e-01 
3.92 -1.132847483e-01 
3.94 -1.098856712e-01 
3.96 -1.066380473e-01 
3.98 -1.035316862e-01 
4.00 -1.005552421e-01 
4.02 -9.769614114e-02 
4.04 -9.494050881e-02 
4.06 -9.227482092e-02 
4.08 -8.969342836e-02 
4.10 -8.719345359e-02 
4.12 -8.477211979e-02 
4.14 -8.242674663e-02 
4.16 -8.015474730e-02 
4.18 -7.795362552e-02 
4.20 -7.582097268e-02 
4.22 -7.375446493e-02 
4.24 -7.175186044e-02 
4.26 -6.981099661e-02 
4.28 -6.792978741e-02 
4.30 -6.610622076e-02 
4.32 -6.433835597e-02 
4.34 -6.262432129e-02 
4.36 -6.096231146e-02 
4.38 -5.935058539e-02 
4.40 -5.778746388e-02 
4.42 -5.627132741e-02 
4.44 -5.480061400e-02 
4.46 -5.337381717e-02 
4.48 -5.198930182e-02 
4.50 -5.064478978e-02 
4.52 -4.933796938e-02 
4.54 -4.806668338e-02 
4.56 -4.682892362e-02 
4.58 -4.562282579e-02 
4.60 -4.444666410e-02 
4.62 -4.329884615e-02 
4.64 -4.217790774e-02 
4.66 -4.108250771e-02 
4.68 -4.001142288e-02 
4.70 -3.896354301e-02 
4.72 -3.793786571e-02 
4.74 -3.693349150e-02 
4.76 -3.594961887e-02 
4.78 -3.498553928e-02 
4.80 -3.404063236e-02 
4.82 -3.311436095e-02 
4.84 -3.220626634e-02 
4.86 -3.131596343e-02 
4.88 -3.044313593e-02 
4.90 -2.958753164e-02 
4.92 -2.874895770e-02 
4.94 -2.792727589e-02 
4.96 -2.712239794e-02 
4.98 -2.633428087e-02 
5.00 -2.556292238e-02 
5.02 -2.480835619e-02 
5.04 -2.407064746e-02 
5.06 -2.334988823e-02 
5.08 -2.264619285e-02 
5.10 -2.195969341e-02 
5.12 -2.129053529e-02 
5.14 -2.063887257e-02 
5.16 -2.000484305e-02 
5.18 -1.938812363e-02 
5.20 -1.878797689e-02 
5.22 -1.820371886e-02 
5.24 -1.763473327e-02 
5.26 -1.708046472e-02 
5.28 -1.654041199e-02 
5.30 -1.601412117e-02 
5.32 -1.550117891e-02 
5.34 -1.500120567e-02 
5.36 -1.451384890e-02 
5.38 -1.403877626e-02 
5.40 -1.357566887e-02 
5.42 -1.312421449e-02 
5.44 -1.268410077e-02 
5.46 -1.225500847e-02 
5.48 -1.183660463e-02 
5.50 -1.142853587e-02 
5.52 -1.103042152e-02 
5.54 -1.064184693e-02 
5.56 -1.026235661e-02 
5.58 -9.891447496e-03 
5.60 -9.528562144e-03 
5.62 -9.173081971e-03 
5.64 -8.824320459e-03 
5.66 -8.481516377e-03 
5.68 -8.143827005e-03 
5.70 -7.810321344e-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