# 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 = Co2Fe
# 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 -5.639838881e+02 
0.94 -5.248824093e+02 
0.96 -4.893870995e+02 
0.98 -4.575320308e+02 
1.00 -4.286298706e+02 
1.02 -4.022715027e+02 
1.04 -3.775409874e+02 
1.06 -3.544077999e+02 
1.08 -3.328842153e+02 
1.10 -3.126402308e+02 
1.12 -2.933304564e+02 
1.14 -2.746517788e+02 
1.16 -2.563097108e+02 
1.18 -2.383644911e+02 
1.20 -2.212469275e+02 
1.22 -2.053475740e+02 
1.24 -1.909884790e+02 
1.26 -1.781316058e+02 
1.28 -1.669907650e+02 
1.30 -1.568698905e+02 
1.32 -1.476030309e+02 
1.34 -1.390091454e+02 
1.36 -1.310508492e+02 
1.38 -1.235704747e+02 
1.40 -1.165015797e+02 
1.42 -1.095399696e+02 
1.44 -1.025852855e+02 
1.46 -9.578091581e+01 
1.48 -8.896130458e+01 
1.50 -8.224460035e+01 
1.52 -7.567227943e+01 
1.54 -6.920936443e+01 
1.56 -6.278676106e+01 
1.58 -5.646557624e+01 
1.60 -5.019367967e+01 
1.62 -4.404656081e+01 
1.64 -3.809404157e+01 
1.66 -3.242883652e+01 
1.68 -2.696169964e+01 
1.70 -2.181868711e+01 
1.72 -1.712613784e+01 
1.74 -1.283727751e+01 
1.76 -8.775012869e+00 
1.78 -5.406208033e+00 
1.80 -3.026962570e+00 
1.82 -1.452929321e+00 
1.84 -5.007234238e-01 
1.86  1.769030400e-02 
1.88  2.461980822e-01 
1.90  2.869354617e-01 
1.92  1.993969191e-01 
1.94  4.103434711e-02 
1.96 -1.424422143e-01 
1.98 -3.409559580e-01 
2.00 -5.715881199e-01 
2.02 -8.340426516e-01 
2.04 -1.107953758e+00 
2.06 -1.379808390e+00 
2.08 -1.643686012e+00 
2.10 -1.897098100e+00 
2.12 -2.137637597e+00 
2.14 -2.355276407e+00 
2.16 -2.556458590e+00 
2.18 -2.735982969e+00 
2.20 -2.892053418e+00 
2.22 -3.024301897e+00 
2.24 -3.135131374e+00 
2.26 -3.227447831e+00 
2.28 -3.303953272e+00 
2.30 -3.367099703e+00 
2.32 -3.419144477e+00 
2.34 -3.452666366e+00 
2.36 -3.481278047e+00 
2.38 -3.501552012e+00 
2.40 -3.515501806e+00 
2.42 -3.522063363e+00 
2.44 -3.522550556e+00 
2.46 -3.517564274e+00 
2.48 -3.507726405e+00 
2.50 -3.493721509e+00 
2.52 -3.475889183e+00 
2.54 -3.454125668e+00 
2.56 -3.428317122e+00 
2.58 -3.398396908e+00 
2.60 -3.364599085e+00 
2.62 -3.327055809e+00 
2.64 -3.286113591e+00 
2.66 -3.242134717e+00 
2.68 -3.195436957e+00 
2.70 -3.146350509e+00 
2.72 -3.095268722e+00 
2.74 -3.042684847e+00 
2.76 -2.989113437e+00 
2.78 -2.935138655e+00 
2.80 -2.881510482e+00 
2.82 -2.829088470e+00 
2.84 -2.778674810e+00 
2.86 -2.730823398e+00 
2.88 -2.685530764e+00 
2.90 -2.641940235e+00 
2.92 -2.598220514e+00 
2.94 -2.551702642e+00 
2.96 -2.499315879e+00 
2.98 -2.437966214e+00 
3.00 -2.364162115e+00 
3.02 -2.274754901e+00 
3.04 -2.167171962e+00 
3.06 -2.037414947e+00 
3.08 -1.881461806e+00 
3.10 -1.694790016e+00 
3.12 -1.472817717e+00 
3.14 -1.242484730e+00 
3.16 -9.824301835e-01 
3.18 -7.148661284e-01 
3.20 -4.493912390e-01 
3.22 -1.949468197e-01 
3.24  4.006506001e-02 
3.26  2.484793815e-01 
3.28  4.251787336e-01 
3.30  5.678734930e-01 
3.32  6.774979609e-01 
3.34  7.579161479e-01 
3.36  8.148866238e-01 
3.38  8.546831167e-01 
3.40  8.829003792e-01 
3.42  9.037733273e-01 
3.44  9.200818261e-01 
3.46  9.334497726e-01 
3.48  9.447789018e-01 
3.50  9.546345179e-01 
3.52  9.635075751e-01 
3.54  9.719455437e-01 
3.56  9.805730702e-01 
3.58  9.900336312e-01 
3.60  1.000924646e+00 
3.62  1.013780846e+00 
3.64  1.029069455e+00 
3.66  1.047170866e+00 
3.68  1.054010202e+00 
3.70  1.070256896e+00 
3.72  1.087322307e+00 
3.74  1.104982800e+00 
3.76  1.122989815e+00 
3.78  1.141076877e+00 
3.80  1.158964669e+00 
3.82  1.176365535e+00 
3.84  1.192985783e+00 
3.86  1.208548341e+00 
3.88  1.222962742e+00 
3.90  1.236236243e+00 
3.92  1.248377376e+00 
3.94  1.259383922e+00 
3.96  1.269232846e+00 
3.98  1.277897672e+00 
4.00  1.285350280e+00 
4.02  1.291560596e+00 
4.04  1.296496725e+00 
4.06  1.300125245e+00 
4.08  1.302410249e+00 
4.10  1.303314281e+00 
4.12  1.302797659e+00 
4.14  1.300824540e+00 
4.16  1.297366535e+00 
4.18  1.292393464e+00 
4.20  1.285871851e+00 
4.22  1.277757654e+00 
4.24  1.268001469e+00 
4.26  1.256552199e+00 
4.28  1.243355834e+00 
4.30  1.228357119e+00 
4.32  1.211498268e+00 
4.34  1.192720133e+00 
4.36  1.171962548e+00 
4.38  1.149164546e+00 
4.40  1.124265016e+00 
4.42  1.097204371e+00 
4.44  1.067924544e+00 
4.46  1.036371347e+00 
4.48  1.002495125e+00 
4.50  9.662534335e-01 
4.52  9.276153271e-01 
4.54  8.866138282e-01 
4.56  8.433871321e-01 
4.58  7.981134765e-01 
4.60  7.509920372e-01 
4.62  7.022414263e-01 
4.64  6.520949066e-01 
4.66  6.007949218e-01 
4.68  5.485867378e-01 
4.70  4.957107174e-01 
4.72  4.423969533e-01 
4.74  3.888622808e-01 
4.76  3.353094495e-01 
4.78  2.819240213e-01 
4.80  2.288756261e-01 
4.82  1.763296289e-01 
4.84  1.244603988e-01 
4.86  7.346246788e-02 
4.88  2.355344561e-02 
4.90 -2.502041238e-02 
4.92 -7.198591587e-02 
4.94 -1.170536394e-01 
4.96 -1.596217831e-01 
4.98 -1.976509808e-01 
5.00 -2.294958445e-01 
5.02 -2.543067138e-01 
5.04 -2.719484653e-01 
5.06 -2.828864936e-01 
5.08 -2.880426501e-01 
5.10 -2.886274518e-01 
5.12 -2.859600659e-01 
5.14 -2.812880866e-01 
5.16 -2.756208710e-01 
5.18 -2.695944853e-01 
5.20 -2.652766790e-01 
5.22 -2.593327515e-01 
5.24 -2.523745950e-01 
5.26 -2.435235156e-01 
5.28 -2.319402299e-01 
5.30 -2.170354959e-01 
5.32 -1.986263353e-01 
5.34 -1.770090697e-01 
5.36 -1.529343176e-01 
5.38 -1.274951504e-01 
5.40 -1.019535125e-01 
5.42 -7.755112775e-02 
5.44 -5.534506465e-02 
5.46 -3.610234254e-02 
5.48 -2.025823142e-02 
5.50 -7.932849065e-03 
5.52  1.016516288e-03 
5.54  6.925611135e-03 
5.56  1.025750076e-02 
5.58  1.153981406e-02 
5.60  1.131109566e-02 
5.62  1.007940197e-02 
5.64  8.291577645e-03 
5.66  6.313917401e-03 
5.68  4.423532757e-03 
5.70  2.806282193e-03 
5.72  1.562799317e-03 
5.74  7.195076729e-04 
5.76  2.397601245e-04 
5.78  3.911356619e-05 
5.80  2.596802795e-07 
5.82 -1.251686715e-05 
5.84 -1.396967658e-04 
5.86 -5.222355773e-04 
5.88 -1.300429333e-03 
5.90 -2.615109309e-03 
5.92 -4.605993251e-03 
5.94 -7.411608049e-03 
5.96 -1.116834735e-02 
5.98 -1.600920639e-02 
6.00 -1.046366418e-02