# 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 = Co2Cr
# 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  5.664013369e+04 
1.02  4.460640644e+04 
1.04  3.528739302e+04 
1.06  2.803563226e+04 
1.08  2.236622189e+04 
1.10  1.791402100e+04 
1.12  1.440262839e+04 
1.14  1.162175713e+04 
1.16  9.410638878e+03 
1.18  7.645785554e+03 
1.20  6.231914817e+03 
1.22  5.095186835e+03 
1.24  4.178136938e+03 
1.26  3.435861719e+03 
1.28  2.833134767e+03 
1.30  2.342214885e+03 
1.32  1.941175398e+03 
1.34  1.612623748e+03 
1.36  1.342715576e+03 
1.38  1.120394043e+03 
1.40  9.368001038e+02 
1.42  7.848130448e+02 
1.44  6.586918221e+02 
1.46  5.537944343e+02 
1.48  4.663568711e+02 
1.50  3.933188068e+02 
1.52  3.321850537e+02 
1.54  2.809159116e+02 
1.56  2.378395582e+02 
1.58  2.015821968e+02 
1.60  1.710125556e+02 
1.62  1.451967673e+02 
1.64  1.233618164e+02 
1.66  1.048666205e+02 
1.68  8.917842196e+01 
1.70  7.585357373e+01 
1.72  6.452197940e+01 
1.74  5.487436701e+01 
1.76  4.665173614e+01 
1.78  3.963665924e+01 
1.80  3.364637683e+01 
1.82  2.852707753e+01 
1.84  2.414898225e+01 
1.86  2.040246075e+01 
1.88  1.719482633e+01 
1.90  1.444762268e+01 
1.92  1.209437181e+01 
1.94  1.007857675e+01 
1.96  8.352049730e+00 
1.98  6.873575206e+00 
2.00  5.607972026e+00 
2.02  4.525206851e+00 
2.04  3.599617001e+00 
2.06  2.809167040e+00 
2.08  2.134965437e+00 
2.10  1.560808396e+00 
2.12  1.072774184e+00 
2.14  6.588968356e-01 
2.16  3.088907012e-01 
2.18  1.391756008e-02 
2.20 -2.336104092e-01 
2.22 -4.402246979e-01 
2.24 -6.116351971e-01 
2.26 -7.527837925e-01 
2.28 -8.679254791e-01 
2.30 -9.607237807e-01 
2.32 -1.034325994e+00 
2.34 -1.091427706e+00 
2.36 -1.134382716e+00 
2.38 -1.165297509e+00 
2.40 -1.186004726e+00 
2.42 -1.198091271e+00 
2.44 -1.202928371e+00 
2.46 -1.201697227e+00 
2.48 -1.195410904e+00 
2.50 -1.184932972e+00 
2.52 -1.170993368e+00 
2.54 -1.154201856e+00 
2.56 -1.135059506e+00 
2.58 -1.113988997e+00 
2.60 -1.091373109e+00 
2.62 -1.067526743e+00 
2.64 -1.042710126e+00 
2.66 -1.017177143e+00 
2.68 -9.911587325e-01 
2.70 -9.648515860e-01 
2.72 -9.384124653e-01 
2.74 -9.119645604e-01 
2.76 -8.856109947e-01 
2.78 -8.594376458e-01 
2.80 -8.335151847e-01 
2.82 -8.079007915e-01 
2.84 -7.826395877e-01 
2.86 -7.577658251e-01 
2.88 -7.333084696e-01 
2.90 -7.093021945e-01 
2.92 -6.857789680e-01 
2.94 -6.627664853e-01 
2.96 -6.402887282e-01 
2.98 -6.183664137e-01 
3.00 -5.970173471e-01 
3.02 -5.762566910e-01 
3.04 -5.560971601e-01 
3.06 -5.365491522e-01 
3.08 -5.176208222e-01 
3.10 -4.993181068e-01 
3.12 -4.816447054e-01 
3.14 -4.646020233e-01 
3.16 -4.481890295e-01 
3.18 -4.323987026e-01 
3.20 -4.172163897e-01 
3.22 -4.026254323e-01 
3.24 -3.886074795e-01 
3.26 -3.751422185e-01 
3.28 -3.622070889e-01 
3.30 -3.497769840e-01 
3.32 -3.378258378e-01 
3.34 -3.263325505e-01 
3.36 -3.152759705e-01 
3.38 -3.046328797e-01 
3.40 -2.943777352e-01 
3.42 -2.844824054e-01 
3.44 -2.749159002e-01 
3.46 -2.656456026e-01 
3.48 -2.566540493e-01 
3.50 -2.479352079e-01 
3.52 -2.394838682e-01 
3.54 -2.312953855e-01 
3.56 -2.233656142e-01 
3.58 -2.156908381e-01 
3.60 -2.082676994e-01 
3.62 -2.010931260e-01 
3.64 -1.941642578e-01 
3.66 -1.874783715e-01 
3.68 -1.810328049e-01 
3.70 -1.748248800e-01 
3.72 -1.688518256e-01 
3.74 -1.631106995e-01 
3.76 -1.575983099e-01 
3.78 -1.523111368e-01 
3.80 -1.472452529e-01 
3.82 -1.423962444e-01 
3.84 -1.377591313e-01 
3.86 -1.333282879e-01 
3.88 -1.290973636e-01 
3.90 -1.250592024e-01 
3.92 -1.212057638e-01 
3.94 -1.175280428e-01 
3.96 -1.140159906e-01 
3.98 -1.106584345e-01 
4.00 -1.074429985e-01 
4.02 -1.043560241e-01 
4.04 -1.013824909e-01 
4.06 -9.850777048e-02 
4.08 -9.572562799e-02 
4.10 -9.303279274e-02 
4.12 -9.042611672e-02 
4.14 -8.790256884e-02 
4.16 -8.545923070e-02 
4.18 -8.309329240e-02 
4.20 -8.080204853e-02 
4.22 -7.858289430e-02 
4.24 -7.643332175e-02 
4.26 -7.435091612e-02 
4.28 -7.233335234e-02 
4.30 -7.037839160e-02 
4.32 -6.848387811e-02 
4.34 -6.664773593e-02 
4.36 -6.486796589e-02 
4.38 -6.314264269e-02 
4.40 -6.146991204e-02 
4.42 -5.984798798e-02 
4.44 -5.827515020e-02 
4.46 -5.674974154e-02 
4.48 -5.526997634e-02 
4.50 -5.383340536e-02 
4.52 -5.243754882e-02 
4.54 -5.108009153e-02 
4.56 -4.975887705e-02 
4.58 -4.847190203e-02 
4.60 -4.721731058e-02 
4.62 -4.599338867e-02 
4.64 -4.479855855e-02 
4.66 -4.363137332e-02 
4.68 -4.249051145e-02 
4.70 -4.137477138e-02 
4.72 -4.028306615e-02 
4.74 -3.921441812e-02 
4.76 -3.816795369e-02 
4.78 -3.714289804e-02 
4.80 -3.613856996e-02 
4.82 -3.515437666e-02 
4.84 -3.418980869e-02 
4.86 -3.324443482e-02 
4.88 -3.231789698e-02 
4.90 -3.140990524e-02 
4.92 -3.052023282e-02 
4.94 -2.964871112e-02 
4.96 -2.879522477e-02 
4.98 -2.795970670e-02 
5.00 -2.714213333e-02 
5.02 -2.634251960e-02 
5.04 -2.556091421e-02 
5.06 -2.479739478e-02 
5.08 -2.405206303e-02 
5.10 -2.332504007e-02 
5.12 -2.261646156e-02 
5.14 -2.192647307e-02 
5.16 -2.125520342e-02 
5.18 -2.060229189e-02 
5.20 -1.996693771e-02 
5.22 -1.934839773e-02 
5.24 -1.874600166e-02 
5.26 -1.815914490e-02 
5.28 -1.758728140e-02 
5.30 -1.702991654e-02 
5.32 -1.648660001e-02 
5.34 -1.595691863e-02 
5.36 -1.544048925e-02 
5.38 -1.493695159e-02 
5.40 -1.444596114e-02 
5.42 -1.396718197e-02 
5.44 -1.350027964e-02 
5.46 -1.304491402e-02 
5.48 -1.260073220e-02 
5.50 -1.216736134e-02 
5.52 -1.174440150e-02 
5.54 -1.133141854e-02 
5.56 -1.092793698e-02 
5.58 -1.053343286e-02 
5.60 -1.014732658e-02 
5.62 -9.768975793e-03 
5.64 -9.397668263e-03 
5.66 -9.032614722e-03 
5.68 -8.672941734e-03 
5.70 -8.317684562e-03 
5.72 -7.965782545e-03 
5.74 -7.616541424e-03 
5.76 -7.270234464e-03 
5.78 -6.927281370e-03 
5.80 -6.588118081e-03 
5.82 -6.253193878e-03 
5.84 -5.922968499e-03 
5.86 -5.597909248e-03 
5.88 -5.278488106e-03 
5.90 -4.965178844e-03 
5.92 -4.658454135e-03 
5.94 -4.358782662e-03 
5.96 -4.066626233e-03 
5.98 -3.782436891e-03 
6.00 -3.506654025e-03