# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2018--Farkas-D-Caro-A--Fe-Ni-Cr-Co-Cu
# implementation = 2018--Farkas-D--Fe-Ni-Cr-Co-Cu--LAMMPS--ipr1
# composition = CoFe2
# 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 -6.859311408e+02 
0.94 -6.393801572e+02 
0.96 -5.981918489e+02 
0.98 -5.601157036e+02 
1.00 -5.239458167e+02 
1.02 -4.895646216e+02 
1.04 -4.577364055e+02 
1.06 -4.286840050e+02 
1.08 -4.016305516e+02 
1.10 -3.762825693e+02 
1.12 -3.526126360e+02 
1.14 -3.308383204e+02 
1.16 -3.111953444e+02 
1.18 -2.929720813e+02 
1.20 -2.754758846e+02 
1.22 -2.585015109e+02 
1.24 -2.421879070e+02 
1.26 -2.271739129e+02 
1.28 -2.134534103e+02 
1.30 -2.011961980e+02 
1.32 -1.899958951e+02 
1.34 -1.794953499e+02 
1.36 -1.693900959e+02 
1.38 -1.593976161e+02 
1.40 -1.493958900e+02 
1.42 -1.395655604e+02 
1.44 -1.299914350e+02 
1.46 -1.205397223e+02 
1.48 -1.112391221e+02 
1.50 -1.020438144e+02 
1.52 -9.300207470e+01 
1.54 -8.422336045e+01 
1.56 -7.585117956e+01 
1.58 -6.796451995e+01 
1.60 -6.079526925e+01 
1.62 -5.420806339e+01 
1.64 -4.809033909e+01 
1.66 -4.231166113e+01 
1.68 -3.691036617e+01 
1.70 -3.181179272e+01 
1.72 -2.694032186e+01 
1.74 -2.212122769e+01 
1.76 -1.744679706e+01 
1.78 -1.307314202e+01 
1.80 -9.216233900e+00 
1.82 -6.226288912e+00 
1.84 -4.011717962e+00 
1.86 -2.429606483e+00 
1.88 -1.362488923e+00 
1.90 -7.090128060e-01 
1.92 -3.686563368e-01 
1.94 -2.465499770e-01 
1.96 -2.621489138e-01 
1.98 -3.545162499e-01 
2.00 -4.958464312e-01 
2.02 -7.056523624e-01 
2.04 -9.903075073e-01 
2.06 -1.315633019e+00 
2.08 -1.644270116e+00 
2.10 -1.946451921e+00 
2.12 -2.206846987e+00 
2.14 -2.436923079e+00 
2.16 -2.632369205e+00 
2.18 -2.803386459e+00 
2.20 -2.952103153e+00 
2.22 -3.079175107e+00 
2.24 -3.186204963e+00 
2.26 -3.274575531e+00 
2.28 -3.345336741e+00 
2.30 -3.399353118e+00 
2.32 -3.437335239e+00 
2.34 -3.471243059e+00 
2.36 -3.488052742e+00 
2.38 -3.494443591e+00 
2.40 -3.493450525e+00 
2.42 -3.484258218e+00 
2.44 -3.469306889e+00 
2.46 -3.450134333e+00 
2.48 -3.428256799e+00 
2.50 -3.405187290e+00 
2.52 -3.382041880e+00 
2.54 -3.359456478e+00 
2.56 -3.338016025e+00 
2.58 -3.318239530e+00 
2.60 -3.302267324e+00 
2.62 -3.288488116e+00 
2.64 -3.277687840e+00 
2.66 -3.269442231e+00 
2.68 -3.262719575e+00 
2.70 -3.254799114e+00 
2.72 -3.241271390e+00 
2.74 -3.219673744e+00 
2.76 -3.189763130e+00 
2.78 -3.152479087e+00 
2.80 -3.108632152e+00 
2.82 -3.058109314e+00 
2.84 -2.999345234e+00 
2.86 -2.929220628e+00 
2.88 -2.843463430e+00 
2.90 -2.737226824e+00 
2.92 -2.605686189e+00 
2.94 -2.444684376e+00 
2.96 -2.250875445e+00 
2.98 -2.021492495e+00 
3.00 -1.750781125e+00 
3.02 -1.432910194e+00 
3.04 -1.078029015e+00 
3.06 -6.911645541e-01 
3.08 -2.807304171e-01 
3.10  1.443968289e-01 
3.12  5.744643272e-01 
3.14  9.713384391e-01 
3.16  1.362818764e+00 
3.18  1.721846627e+00 
3.20  2.037697367e+00 
3.22  2.300358407e+00 
3.24  2.501440307e+00 
3.26  2.635934613e+00 
3.28  2.703828012e+00 
3.30  2.711164269e+00 
3.32  2.669822844e+00 
3.34  2.595634186e+00 
3.36  2.505187614e+00 
3.38  2.412564494e+00 
3.40  2.327364590e+00 
3.42  2.254452881e+00 
3.44  2.194936432e+00 
3.46  2.147750821e+00 
3.48  2.111107424e+00 
3.50  2.083448523e+00 
3.52  2.063886443e+00 
3.54  2.052250032e+00 
3.56  2.048872844e+00 
3.58  2.054250083e+00 
3.60  2.068780394e+00 
3.62  2.092714299e+00 
3.64  2.126159870e+00 
3.66  2.169109644e+00 
3.68  2.185003266e+00 
3.70  2.226726744e+00 
3.72  2.271520148e+00 
3.74  2.318460547e+00 
3.76  2.366645786e+00 
3.78  2.415209210e+00 
3.80  2.463328693e+00 
3.82  2.510235255e+00 
3.84  2.555217316e+00 
3.86  2.597647840e+00 
3.88  2.637183050e+00 
3.90  2.673629494e+00 
3.92  2.706818563e+00 
3.94  2.736672929e+00 
3.96  2.763251437e+00 
3.98  2.786626525e+00 
4.00  2.806868711e+00 
4.02  2.824045042e+00 
4.04  2.838217427e+00 
4.06  2.849441345e+00 
4.08  2.857763122e+00 
4.10  2.863218629e+00 
4.12  2.865830501e+00 
4.14  2.865587381e+00 
4.16  2.862429956e+00 
4.18  2.856275156e+00 
4.20  2.847015043e+00 
4.22  2.834506815e+00 
4.24  2.818573974e+00 
4.26  2.799006477e+00 
4.28  2.775556180e+00 
4.30  2.747933714e+00 
4.32  2.715804524e+00 
4.34  2.678786276e+00 
4.36  2.636447401e+00 
4.38  2.588306744e+00 
4.40  2.533836648e+00 
4.42  2.472470642e+00 
4.44  2.403615307e+00 
4.46  2.326672999e+00 
4.48  2.241070323e+00 
4.50  2.146303947e+00 
4.52  2.042009209e+00 
4.54  1.928183065e+00 
4.56  1.805277987e+00 
4.58  1.674177271e+00 
4.60  1.536241658e+00 
4.62  1.393339536e+00 
4.64  1.247811407e+00 
4.66  1.102361849e+00 
4.68  9.598708621e-01 
4.70  8.231400125e-01 
4.72  6.946139406e-01 
4.74  5.761346314e-01 
4.76  4.687749734e-01 
4.78  3.727831924e-01 
4.80  2.876640914e-01 
4.82  2.123691036e-01 
4.84  1.455022875e-01 
4.86  8.554548309e-02 
4.88  3.105238738e-02 
4.90 -1.920559370e-02 
4.92 -6.615978238e-02 
4.94 -1.104659845e-01 
4.96 -1.520310012e-01 
4.98 -1.903921847e-01 
5.00 -2.250298607e-01 
5.02 -2.554429776e-01 
5.04 -2.812276640e-01 
5.06 -3.021372765e-01 
5.08 -3.180798602e-01 
5.10 -3.290711672e-01 
5.12 -3.351739073e-01 
5.14 -3.364282427e-01 
5.16 -3.327819853e-01 
5.18 -3.240332921e-01 
5.20 -3.313228779e-01 
5.22 -3.202856680e-01 
5.24 -3.056687292e-01 
5.26 -2.876283225e-01 
5.28 -2.663968234e-01 
5.30 -2.423378767e-01 
5.32 -2.159808034e-01 
5.34 -1.880279626e-01 
5.36 -1.593272717e-01 
5.38 -1.308169941e-01 
5.40 -1.034460267e-01 
5.42 -7.808838440e-02 
5.44 -5.546414025e-02 
5.46 -3.608422927e-02 
5.48 -2.022113700e-02 
5.50 -7.910484381e-03 
5.52  1.022457711e-03 
5.54  6.921599965e-03 
5.56  1.025111408e-02 
5.58  1.153349186e-02 
5.60  1.130529597e-02 
5.62  1.007446907e-02 
5.64  8.287862965e-03 
5.66  6.311523967e-03 
5.68  4.422249228e-03 
5.70  2.805729521e-03 
5.72  1.562619632e-03 
5.74  7.194684458e-04 
5.76  2.397557007e-04 
5.78  3.911344785e-05 
5.80  2.596802734e-07 
5.82 -1.251687929e-05 
5.84 -1.396982853e-04 
5.86 -5.222571252e-04 
5.88 -1.300566897e-03 
5.90 -2.615692684e-03 
5.92 -4.607930465e-03 
5.94 -7.417091042e-03 
5.96 -1.118222603e-02 
5.98 -1.604154204e-02 
6.00 -1.048286216e-02