# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2013--Bonny-G-Terentyev-D-Bakaev-A-et-al--Fe-Cu-Ni-Mn
# implementation = 2013--Bonny-G--Fe-Cu-Ni-Mn--LAMMPS--ipr1
# composition = CuNi2
# 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 2024-01-04

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  4.751208408e+02 
0.90  4.337660656e+02 
0.92  3.966922157e+02 
0.94  3.633925554e+02 
0.96  3.333804600e+02 
0.98  3.061761094e+02 
1.00  2.812904711e+02 
1.02  2.583727201e+02 
1.04  2.372551051e+02 
1.06  2.177728239e+02 
1.08  1.997803605e+02 
1.10  1.831430295e+02 
1.12  1.677427949e+02 
1.14  1.535057846e+02 
1.16  1.403440005e+02 
1.18  1.281883594e+02 
1.20  1.169677677e+02 
1.22  1.066190017e+02 
1.24  9.707342846e+01 
1.26  8.827018198e+01 
1.28  8.016494238e+01 
1.30  7.270709730e+01 
1.32  6.584901617e+01 
1.34  5.955654120e+01 
1.36  5.378951062e+01 
1.38  4.850771725e+01 
1.40  4.368141156e+01 
1.42  3.929094232e+01 
1.44  3.530775666e+01 
1.46  3.170541775e+01 
1.48  2.826863200e+01 
1.50  2.487371723e+01 
1.52  2.177871822e+01 
1.54  1.896852210e+01 
1.56  1.641775662e+01 
1.58  1.410912648e+01 
1.60  1.202888208e+01 
1.62  1.016238727e+01 
1.64  8.495242803e+00 
1.66  7.013662600e+00 
1.68  5.703365320e+00 
1.70  4.549808464e+00 
1.72  3.543196907e+00 
1.74  2.671329814e+00 
1.76  1.920769921e+00 
1.78  1.278023053e+00 
1.80  7.297778239e-01 
1.82  2.629353005e-01 
1.84 -1.357912955e-01 
1.86 -4.818675841e-01 
1.88 -7.864724461e-01 
1.90 -1.061798145e+00 
1.92 -1.319114339e+00 
1.94 -1.561252795e+00 
1.96 -1.788442691e+00 
1.98 -2.000737257e+00 
2.00 -2.198163490e+00 
2.02 -2.380750326e+00 
2.04 -2.548536726e+00 
2.06 -2.701712572e+00 
2.08 -2.841364866e+00 
2.10 -2.967697704e+00 
2.12 -3.081053296e+00 
2.14 -3.181922982e+00 
2.16 -3.270790376e+00 
2.18 -3.348113580e+00 
2.20 -3.414306835e+00 
2.22 -3.469709243e+00 
2.24 -3.514627157e+00 
2.26 -3.549348278e+00 
2.28 -3.574129849e+00 
2.30 -3.589202658e+00 
2.32 -3.594978331e+00 
2.34 -3.592447466e+00 
2.36 -3.582053115e+00 
2.38 -3.564645897e+00 
2.40 -3.542404167e+00 
2.42 -3.515432167e+00 
2.44 -3.483975338e+00 
2.46 -3.448471738e+00 
2.48 -3.409352765e+00 
2.50 -3.367044261e+00 
2.52 -3.321973345e+00 
2.54 -3.274546311e+00 
2.56 -3.225130726e+00 
2.58 -3.174020943e+00 
2.60 -3.121500822e+00 
2.62 -3.067866811e+00 
2.64 -3.013425794e+00 
2.66 -2.958424905e+00 
2.68 -2.902955726e+00 
2.70 -2.847082119e+00 
2.72 -2.790863400e+00 
2.74 -2.734410584e+00 
2.76 -2.677862140e+00 
2.78 -2.621349818e+00 
2.80 -2.565002771e+00 
2.82 -2.508951377e+00 
2.84 -2.453329322e+00 
2.86 -2.398274705e+00 
2.88 -2.343930836e+00 
2.90 -2.290439554e+00 
2.92 -2.237949527e+00 
2.94 -2.186847434e+00 
2.96 -2.136561127e+00 
2.98 -2.086908421e+00 
3.00 -2.037910852e+00 
3.02 -1.989584956e+00 
3.04 -1.941944786e+00 
3.06 -1.895000808e+00 
3.08 -1.848758337e+00 
3.10 -1.803215600e+00 
3.12 -1.758362408e+00 
3.14 -1.714179982e+00 
3.16 -1.670642958e+00 
3.18 -1.627723195e+00 
3.20 -1.585394610e+00 
3.22 -1.543637619e+00 
3.24 -1.502441505e+00 
3.26 -1.461804902e+00 
3.28 -1.421734214e+00 
3.30 -1.382237225e+00 
3.32 -1.343318849e+00 
3.34 -1.304984336e+00 
3.36 -1.267238055e+00 
3.38 -1.230082232e+00 
3.40 -1.193516606e+00 
3.42 -1.157540424e+00 
3.44 -1.122153404e+00 
3.46 -1.087355736e+00 
3.48 -1.053147987e+00 
3.50 -1.019531015e+00 
3.52 -9.865058863e-01 
3.54 -9.540738046e-01 
3.56 -9.222360567e-01 
3.58 -8.909939227e-01 
3.60 -8.603487011e-01 
3.62 -8.303027956e-01 
3.64 -8.008599532e-01 
3.66 -7.720239318e-01 
3.68 -7.437981286e-01 
3.70 -7.161857662e-01 
3.72 -6.891899788e-01 
3.74 -6.628137298e-01 
3.76 -6.370598895e-01 
3.78 -6.119312535e-01 
3.80 -5.874305998e-01 
3.82 -5.635608113e-01 
3.84 -5.403248959e-01 
3.86 -5.177260703e-01 
3.88 -4.957680854e-01 
3.90 -4.744550669e-01 
3.92 -4.537918333e-01 
3.94 -4.337842916e-01 
3.96 -4.144390230e-01 
3.98 -3.957644680e-01 
4.00 -3.777699215e-01 
4.02 -3.604668456e-01 
4.04 -3.438691753e-01 
4.06 -3.279914519e-01 
4.08 -3.128523061e-01 
4.10 -2.984715270e-01 
4.12 -2.848711629e-01 
4.14 -2.720817442e-01 
4.16 -2.600392103e-01 
4.18 -2.483913384e-01 
4.20 -2.370950990e-01 
4.22 -2.261409377e-01 
4.24 -2.155206746e-01 
4.26 -2.052285972e-01 
4.28 -1.952608378e-01 
4.30 -1.856141701e-01 
4.32 -1.762892173e-01 
4.34 -1.672831862e-01 
4.36 -1.585902767e-01 
4.38 -1.502058683e-01 
4.40 -1.421263473e-01 
4.42 -1.343489628e-01 
4.44 -1.268717063e-01 
4.46 -1.196932155e-01 
4.48 -1.128131821e-01 
4.50 -1.062341324e-01 
4.52 -9.995878949e-02 
4.54 -9.398963812e-02 
4.56 -8.832890781e-02 
4.58 -8.297785212e-02 
4.60 -7.793658614e-02 
4.62 -7.320349216e-02 
4.64 -6.878242563e-02 
4.66 -6.467681619e-02 
4.68 -6.088914960e-02 
4.70 -5.742140868e-02 
4.72 -5.427538233e-02 
4.74 -5.144410775e-02 
4.76 -4.892705567e-02 
4.78 -4.673133518e-02 
4.80 -4.482906875e-02 
4.82 -4.304037970e-02 
4.84 -4.133944195e-02 
4.86 -3.972665467e-02 
4.88 -3.820222983e-02 
4.90 -3.676445358e-02 
4.92 -3.541107297e-02 
4.94 -3.414033417e-02 
4.96 -3.295106208e-02 
4.98 -3.184269035e-02 
5.00 -3.081522883e-02 
5.02 -2.986915417e-02 
5.04 -2.900521352e-02 
5.06 -2.822414147e-02 
5.08 -2.752630379e-02 
5.10 -2.691129775e-02 
5.12 -2.637755359e-02 
5.14 -2.592199075e-02 
5.16 -2.553978176e-02 
5.18 -2.522426440e-02 
5.20 -2.496767641e-02 
5.22 -2.476418741e-02 
5.24 -2.460793634e-02 
5.26 -2.449233040e-02 
5.28 -2.441048829e-02 
5.30 -2.435564743e-02 
5.32 -2.432149803e-02 
5.34 -2.430242492e-02 
5.36 -2.429365459e-02 
5.38 -2.429131712e-02 
5.40 -2.429244000e-02 
5.42 -2.429489329e-02 
5.44 -2.429730453e-02 
5.46 -2.429895889e-02 
5.48 -2.429969600e-02 
5.50 -2.429981118e-02 
5.52 -2.429981103e-02 
5.54 -2.429981103e-02 
5.56 -2.429981103e-02 
5.58 -2.429981103e-02 
5.60 -2.429981103e-02 
5.62 -2.429981103e-02 
5.64 -2.429981103e-02 
5.66 -2.429981103e-02 
5.68 -2.429981103e-02 
5.70 -2.429981103e-02 
5.72 -2.429981103e-02 
5.74 -2.429981103e-02 
5.76 -2.429981103e-02 
5.78 -2.429981103e-02 
5.80 -2.429981103e-02 
5.82 -2.429981103e-02 
5.84 -2.429981103e-02 
5.86 -2.429981103e-02 
5.88 -2.429981103e-02 
5.90 -2.429981103e-02 
5.92 -2.429981103e-02 
5.94 -2.429981103e-02 
5.96 -2.429981103e-02 
5.98 -2.429981103e-02 
6.00 -2.429981103e-02