# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2025--Kushnerov-O-I-Ryabtsev-S-I-Bashev-V-F--Co-Cr-Fe-Ni-Mn-Al
# implementation = 2025--Kushnerov-O-I--Co-Cr-Fe-Ni-Mn-Al--LAMMPS--ipr1
# composition = Co2Mn
# 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 2025-07-01

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  2.418367852e+02 
0.98  2.212507288e+02 
1.00  2.027278568e+02 
1.02  1.858655420e+02 
1.04  1.702292895e+02 
1.06  1.561708047e+02 
1.08  1.433218295e+02 
1.10  1.315577963e+02 
1.12  1.206505455e+02 
1.14  1.105884178e+02 
1.16  1.014555171e+02 
1.18  9.305815554e+01 
1.20  8.552805827e+01 
1.22  7.843279655e+01 
1.24  7.183644354e+01 
1.26  6.586777165e+01 
1.28  6.034673092e+01 
1.30  5.530691585e+01 
1.32  5.056111426e+01 
1.34  4.633828890e+01 
1.36  4.229962669e+01 
1.38  3.859825888e+01 
1.40  3.517132250e+01 
1.42  3.201437711e+01 
1.44  2.923477219e+01 
1.46  2.669030431e+01 
1.48  2.418975848e+01 
1.50  2.188600066e+01 
1.52  1.981626214e+01 
1.54  1.794551455e+01 
1.56  1.612909007e+01 
1.58  1.448095069e+01 
1.60  1.293790956e+01 
1.62  1.151732614e+01 
1.64  1.020978803e+01 
1.66  9.057382292e+00 
1.68  7.990212016e+00 
1.70  6.963662644e+00 
1.72  6.020374864e+00 
1.74  5.224924570e+00 
1.76  4.422989325e+00 
1.78  3.687490401e+00 
1.80  3.013422654e+00 
1.82  2.464348133e+00 
1.84  1.893439737e+00 
1.86  1.461796921e+00 
1.88  9.774633301e-01 
1.90  5.358945229e-01 
1.92  1.338659616e-01 
1.94 -1.953021779e-01 
1.96 -5.300893408e-01 
1.98 -8.333695148e-01 
2.00 -1.107531736e+00 
2.02 -1.354788657e+00 
2.04 -1.577190102e+00 
2.06 -1.776635495e+00 
2.08 -1.954885279e+00 
2.10 -2.072979373e+00 
2.12 -2.194701599e+00 
2.14 -2.323386149e+00 
2.16 -2.436355227e+00 
2.18 -2.534844754e+00 
2.20 -2.620001088e+00 
2.22 -2.692887574e+00 
2.24 -2.681850606e+00 
2.26 -2.738510441e+00 
2.28 -2.785246898e+00 
2.30 -2.822877256e+00 
2.32 -2.852159606e+00 
2.34 -2.873797096e+00 
2.36 -2.888441848e+00 
2.38 -2.896698593e+00 
2.40 -2.899128040e+00 
2.42 -2.896249991e+00 
2.44 -2.833653343e+00 
2.46 -2.825332065e+00 
2.48 -2.812788282e+00 
2.50 -2.796422507e+00 
2.52 -2.730853776e+00 
2.54 -2.710978012e+00 
2.56 -2.688110193e+00 
2.58 -2.662557799e+00 
2.60 -2.634605324e+00 
2.62 -2.604515874e+00 
2.64 -2.572532656e+00 
2.66 -2.538880359e+00 
2.68 -2.503766445e+00 
2.70 -2.467382350e+00 
2.72 -2.429904595e+00 
2.74 -2.373137489e+00 
2.76 -2.335074814e+00 
2.78 -2.296299651e+00 
2.80 -2.256942784e+00 
2.82 -2.217124367e+00 
2.84 -2.176954676e+00 
2.86 -2.136534796e+00 
2.88 -2.095957272e+00 
2.90 -2.055306712e+00 
2.92 -2.014660345e+00 
2.94 -1.974088552e+00 
2.96 -1.933655350e+00 
2.98 -1.893418851e+00 
3.00 -1.853431683e+00 
3.02 -1.813741390e+00 
3.04 -1.774390800e+00 
3.06 -1.735418371e+00 
3.08 -1.696858508e+00 
3.10 -1.658741870e+00 
3.12 -1.621095640e+00 
3.14 -1.583943792e+00 
3.16 -1.529504589e+00 
3.18 -1.494354362e+00 
3.20 -1.459702727e+00 
3.22 -1.425565767e+00 
3.24 -1.391957277e+00 
3.26 -1.358888932e+00 
3.28 -1.326370461e+00 
3.30 -1.247203751e+00 
3.32 -1.218219765e+00 
3.34 -1.189681792e+00 
3.36 -1.161599405e+00 
3.38 -1.133980595e+00 
3.40 -1.106831888e+00 
3.42 -1.080158460e+00 
3.44 -1.053964249e+00 
3.46 -1.028252050e+00 
3.48 -1.003023611e+00 
3.50 -9.782797187e-01 
3.52 -9.540202819e-01 
3.54 -9.302444039e-01 
3.56 -9.069504553e-01 
3.58 -8.841361392e-01 
3.60 -8.617985519e-01 
3.62 -8.399342399e-01 
3.64 -8.185392534e-01 
3.66 -7.976091947e-01 
3.68 -7.771392643e-01 
3.70 -7.571243036e-01 
3.72 -7.375588338e-01 
3.74 -7.184370929e-01 
3.76 -6.997530696e-01 
3.78 -6.815005345e-01 
3.80 -6.636730691e-01 
3.82 -6.462640934e-01 
3.84 -6.292668899e-01 
3.86 -5.747078588e-01 
3.88 -5.601771530e-01 
3.90 -5.459648544e-01 
3.92 -5.320670553e-01 
3.94 -5.184796747e-01 
3.96 -5.051984797e-01 
3.98 -4.922191041e-01 
4.00 -4.795370667e-01 
4.02 -4.671477875e-01 
4.04 -4.550466037e-01 
4.06 -4.432287832e-01 
4.08 -4.316895382e-01 
4.10 -4.204240371e-01 
4.12 -4.094274160e-01 
4.14 -3.986947890e-01 
4.16 -3.882212575e-01 
4.18 -3.780019191e-01 
4.20 -3.680318757e-01 
4.22 -3.583062407e-01 
4.24 -3.488201461e-01 
4.26 -3.395687482e-01 
4.28 -3.305472335e-01 
4.30 -3.217508237e-01 
4.32 -3.131747805e-01 
4.34 -3.048144094e-01 
4.36 -2.966650639e-01 
4.38 -2.887221486e-01 
4.40 -2.809811223e-01 
4.42 -2.734375005e-01 
4.44 -2.660868583e-01 
4.46 -2.589248319e-01 
4.48 -2.519471206e-01 
4.50 -2.451494886e-01 
4.52 -2.385277659e-01 
4.54 -2.320778500e-01 
4.56 -2.257957062e-01 
4.58 -2.196773687e-01 
4.60 -2.137189411e-01 
4.62 -2.079165969e-01 
4.64 -2.022665795e-01 
4.66 -1.967652026e-01 
4.68 -1.914088501e-01 
4.70 -1.861939762e-01 
4.72 -1.811171046e-01 
4.74 -1.761748292e-01 
4.76 -1.713638125e-01 
4.78 -1.666807864e-01 
4.80 -1.621225507e-01 
4.82 -1.576859730e-01 
4.84 -1.533679878e-01 
4.86 -1.491655960e-01 
4.88 -1.450758642e-01 
4.90 -1.410959236e-01 
4.92 -1.372229694e-01 
4.94 -1.334542600e-01 
4.96 -1.297871157e-01 
4.98 -1.262189185e-01 
5.00 -1.227471105e-01 
5.02 -1.193691933e-01 
5.04 -1.160827269e-01 
5.06 -1.128853287e-01 
5.08 -1.097746727e-01 
5.10 -1.067484884e-01 
5.12 -1.038045596e-01 
5.14 -1.009407236e-01 
5.16 -9.815487042e-02 
5.18 -9.544494119e-02 
5.20 -9.280892768e-02 
5.22 -9.024487109e-02 
5.24 -8.775086104e-02 
5.26 -8.532503464e-02 
5.28 -8.296557547e-02 
5.30 -8.067071265e-02 
5.32 -7.843871978e-02 
5.34 -7.626791411e-02 
5.36 -7.415665546e-02 
5.38 -7.210334541e-02 
5.40 -7.010642628e-02 
5.42 -6.816438026e-02 
5.44 -6.627572852e-02 
5.46 -5.080252808e-02 
5.48 -4.944248255e-02 
5.50 -4.811835515e-02 
5.52 -4.682922399e-02 
5.54 -4.557418936e-02 
5.56 -4.435237332e-02 
5.58 -4.316291921e-02 
5.60 -4.200499122e-02 
5.62 -4.087777397e-02 
5.64 -3.978047204e-02 
5.66 -3.871230958e-02 
5.68 -3.767252987e-02 
5.70 -3.666039491e-02 
5.72 -3.567518500e-02 
5.74 -3.471619834e-02 
5.76 -3.378275063e-02 
5.78 -3.287417469e-02 
5.80 -3.198982006e-02 
5.82 -3.112905262e-02 
5.84 -3.029125422e-02 
5.86 -2.947582231e-02 
5.88 -2.868216960e-02 
5.90 -2.790972366e-02 
5.92 -2.715792663e-02 
5.94 -2.642623482e-02 
5.96 -2.571411841e-02 
5.98 -2.502106115e-02 
6.00 -2.434655994e-02