# 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 = Cr2Ni
# 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  2.846681249e+02 
0.98  2.603973991e+02 
1.00  2.385415420e+02 
1.02  2.186288025e+02 
1.04  2.002146113e+02 
1.06  1.836354849e+02 
1.08  1.684836907e+02 
1.10  1.546184206e+02 
1.12  1.417812040e+02 
1.14  1.299505247e+02 
1.16  1.192092321e+02 
1.18  1.093311462e+02 
1.20  1.004502684e+02 
1.22  9.210986664e+01 
1.24  8.436760988e+01 
1.26  7.734830658e+01 
1.28  7.086890393e+01 
1.30  6.494566537e+01 
1.32  5.938312760e+01 
1.34  5.440770996e+01 
1.36  4.967888219e+01 
1.38  4.534360534e+01 
1.40  4.133274491e+01 
1.42  3.763856924e+01 
1.44  3.437983415e+01 
1.46  3.138546597e+01 
1.48  2.846356422e+01 
1.50  2.577206766e+01 
1.52  2.334159618e+01 
1.54  2.115350334e+01 
1.56  1.903397283e+01 
1.58  1.710809444e+01 
1.60  1.530836068e+01 
1.62  1.365167092e+01 
1.64  1.212700065e+01 
1.66  1.077115758e+01 
1.68  9.526038061e+00 
1.70  8.330579117e+00 
1.72  7.232153086e+00 
1.74  6.297478190e+00 
1.76  5.364462161e+00 
1.78  4.508749051e+00 
1.80  3.724496792e+00 
1.82  3.069487968e+00 
1.84  2.406538669e+00 
1.86  1.901379151e+00 
1.88  1.339125670e+00 
1.90  8.264394051e-01 
1.92  3.595708552e-01 
1.94 -2.699246405e-02 
1.96 -4.156562753e-01 
1.98 -7.678641490e-01 
2.00 -1.086389299e+00 
2.02 -1.373799478e+00 
2.04 -1.632472799e+00 
2.06 -1.864612249e+00 
2.08 -2.072259014e+00 
2.10 -2.211889073e+00 
2.12 -2.354965950e+00 
2.14 -2.505229435e+00 
2.16 -2.637358669e+00 
2.18 -2.752783989e+00 
2.20 -2.852831623e+00 
2.22 -2.938731346e+00 
2.24 -2.935677398e+00 
2.26 -3.002348881e+00 
2.28 -3.057620071e+00 
2.30 -3.102432559e+00 
2.32 -3.137659415e+00 
2.34 -3.164110111e+00 
2.36 -3.182535090e+00 
2.38 -3.193629983e+00 
2.40 -3.198039525e+00 
2.42 -3.196361179e+00 
2.44 -3.138280559e+00 
2.46 -3.129603564e+00 
2.48 -3.116131861e+00 
2.50 -3.098322233e+00 
2.52 -3.025430163e+00 
2.54 -3.003615062e+00 
2.56 -2.978408638e+00 
2.58 -2.950160916e+00 
2.60 -2.919195584e+00 
2.62 -2.885811836e+00 
2.64 -2.850286086e+00 
2.66 -2.812873563e+00 
2.68 -2.773809796e+00 
2.70 -2.733311997e+00 
2.72 -2.691580341e+00 
2.74 -2.629603070e+00 
2.76 -2.587132761e+00 
2.78 -2.543864840e+00 
2.80 -2.499947043e+00 
2.82 -2.455515005e+00 
2.84 -2.410693122e+00 
2.86 -2.365595341e+00 
2.88 -2.320325905e+00 
2.90 -2.274980041e+00 
2.92 -2.229644605e+00 
2.94 -2.184398681e+00 
2.96 -2.139314140e+00 
2.98 -2.094456163e+00 
3.00 -2.049883722e+00 
3.02 -2.005650035e+00 
3.04 -1.961802988e+00 
3.06 -1.918385528e+00 
3.08 -1.875436025e+00 
3.10 -1.832988620e+00 
3.12 -1.791073537e+00 
3.14 -1.749717380e+00 
3.16 -1.692455642e+00 
3.18 -1.653184474e+00 
3.20 -1.614483987e+00 
3.22 -1.576371535e+00 
3.24 -1.538861915e+00 
3.26 -1.501967568e+00 
3.28 -1.465698762e+00 
3.30 -1.377258153e+00 
3.32 -1.344981272e+00 
3.34 -1.313210001e+00 
3.36 -1.281954647e+00 
3.38 -1.251223749e+00 
3.40 -1.221024214e+00 
3.42 -1.191361448e+00 
3.44 -1.162239478e+00 
3.46 -1.133661062e+00 
3.48 -1.105627795e+00 
3.50 -1.078140207e+00 
3.52 -1.051197857e+00 
3.54 -1.024799414e+00 
3.56 -9.989427357e-01 
3.58 -9.736249472e-01 
3.60 -9.488425047e-01 
3.62 -9.245912611e-01 
3.64 -9.008665252e-01 
3.66 -8.776631162e-01 
3.68 -8.549754152e-01 
3.70 -8.327974124e-01 
3.72 -8.111227512e-01 
3.74 -7.899447686e-01 
3.76 -7.692565335e-01 
3.78 -7.490508812e-01 
3.80 -7.293204459e-01 
3.82 -7.100576905e-01 
3.84 -6.912549341e-01 
3.86 -6.331910797e-01 
3.88 -6.170427781e-01 
3.90 -6.012532576e-01 
3.92 -5.858178959e-01 
3.94 -5.707318885e-01 
3.96 -5.559902722e-01 
3.98 -5.415879455e-01 
4.00 -5.275196888e-01 
4.02 -5.137801826e-01 
4.04 -5.003640240e-01 
4.06 -4.872657426e-01 
4.08 -4.744798147e-01 
4.10 -4.620006769e-01 
4.12 -4.498227378e-01 
4.14 -4.379403899e-01 
4.16 -4.263480192e-01 
4.18 -4.150400156e-01 
4.20 -4.040107807e-01 
4.22 -3.932547364e-01 
4.24 -3.827663319e-01 
4.26 -3.725400502e-01 
4.28 -3.625704143e-01 
4.30 -3.528519927e-01 
4.32 -3.433794042e-01 
4.34 -3.341473221e-01 
4.36 -3.251504786e-01 
4.38 -3.163836681e-01 
4.40 -3.078417504e-01 
4.42 -2.995196534e-01 
4.44 -2.914123758e-01 
4.46 -2.835149888e-01 
4.48 -2.758226383e-01 
4.50 -2.683305465e-01 
4.52 -2.610340127e-01 
4.54 -2.539284150e-01 
4.56 -2.470092108e-01 
4.58 -2.402719375e-01 
4.60 -2.337122130e-01 
4.62 -2.273257363e-01 
4.64 -2.211082869e-01 
4.66 -2.150557258e-01 
4.68 -2.091639946e-01 
4.70 -2.034291155e-01 
4.72 -1.978471913e-01 
4.74 -1.924144043e-01 
4.76 -1.871270162e-01 
4.78 -1.819813677e-01 
4.80 -1.769738770e-01 
4.82 -1.721010399e-01 
4.84 -1.673594284e-01 
4.86 -1.627456903e-01 
4.88 -1.582565478e-01 
4.90 -1.538887967e-01 
4.92 -1.496393057e-01 
4.94 -1.455050149e-01 
4.96 -1.414829350e-01 
4.98 -1.375701461e-01 
5.00 -1.337637969e-01 
5.02 -1.300611029e-01 
5.04 -1.264593461e-01 
5.06 -1.229558731e-01 
5.08 -1.195480945e-01 
5.10 -1.162334834e-01 
5.12 -1.130095743e-01 
5.14 -1.098739621e-01 
5.16 -1.068243007e-01 
5.18 -1.038583019e-01 
5.20 -1.009737344e-01 
5.22 -9.816842235e-02 
5.24 -9.544024454e-02 
5.26 -9.278713297e-02 
5.28 -9.020707187e-02 
5.30 -8.769809655e-02 
5.32 -8.525829229e-02 
5.34 -8.288579324e-02 
5.36 -8.057878132e-02 
5.38 -7.833548519e-02 
5.40 -7.615417917e-02 
5.42 -7.403318220e-02 
5.44 -7.197085682e-02 
5.46 -5.733068982e-02 
5.48 -5.578402217e-02 
5.50 -5.427855301e-02 
5.52 -5.281321371e-02 
5.54 -5.138696179e-02 
5.56 -4.999878036e-02 
5.58 -4.864767753e-02 
5.60 -4.733268594e-02 
5.62 -4.605286219e-02 
5.64 -4.480728632e-02 
5.66 -4.359506131e-02 
5.68 -4.241531257e-02 
5.70 -4.126718742e-02 
5.72 -4.014985463e-02 
5.74 -3.906250390e-02 
5.76 -3.800434541e-02 
5.78 -3.697460934e-02 
5.80 -3.597254539e-02 
5.82 -3.499742237e-02 
5.84 -3.404852771e-02 
5.86 -3.312516706e-02 
5.88 -3.222666383e-02 
5.90 -3.135235879e-02 
5.92 -3.050160965e-02 
5.94 -2.967379065e-02 
5.96 -2.886829215e-02 
5.98 -2.808452031e-02 
6.00 -2.732189659e-02