# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr
# implementation = 2004--Zhou-X-W--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr--LAMMPS--ipr1
# composition = Mg2Pd
# 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 2024-04-11

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  nan             
1.02  nan             
1.04  nan             
1.06  nan             
1.08  nan             
1.10  nan             
1.12  nan             
1.14  4.112594015e+02 
1.16  3.792899869e+02 
1.18  3.499139706e+02 
1.20  3.228977802e+02 
1.22  2.980326426e+02 
1.24  2.751318444e+02 
1.26  2.540269559e+02 
1.28  2.345653319e+02 
1.30  2.166090174e+02 
1.32  2.000337489e+02 
1.34  1.847271663e+02 
1.36  1.705865562e+02 
1.38  1.575170364e+02 
1.40  1.454306430e+02 
1.42  1.342463595e+02 
1.44  1.238906560e+02 
1.46  1.143055093e+02 
1.48  1.054518343e+02 
1.50  9.727332365e+01 
1.52  8.971748673e+01 
1.54  8.273597326e+01 
1.56  7.628401120e+01 
1.58  7.031999811e+01 
1.60  6.480531773e+01 
1.62  5.970439132e+01 
1.64  5.498482406e+01 
1.66  5.061736302e+01 
1.68  4.657557020e+01 
1.70  4.283533566e+01 
1.72  3.937441804e+01 
1.74  3.617215048e+01 
1.76  3.320931751e+01 
1.78  3.046811962e+01 
1.80  2.793212246e+01 
1.82  2.558614806e+01 
1.84  2.341612780e+01 
1.86  2.140896827e+01 
1.88  1.955244408e+01 
1.90  1.783514421e+01 
1.92  1.624647879e+01 
1.94  1.477671703e+01 
1.96  1.341701086e+01 
1.98  1.215935534e+01 
2.00  1.099648426e+01 
2.02  9.921733250e+00 
2.04  8.928915336e+00 
2.06  8.012233526e+00 
2.08  7.166232705e+00 
2.10  6.385785303e+00 
2.12  5.666091625e+00 
2.14  5.002684642e+00 
2.16  4.391428644e+00 
2.18  3.828505514e+00 
2.20  3.310394905e+00 
2.22  2.833848120e+00 
2.24  2.395867087e+00 
2.26  1.993689362e+00 
2.28  1.624774263e+00 
2.30  1.286792771e+00 
2.32  9.776020179e-01 
2.34  6.948443778e-01 
2.36  4.366111153e-01 
2.38  2.014213966e-01 
2.40 -1.217943492e-02 
2.42 -2.056336605e-01 
2.44 -3.803783618e-01 
2.46 -5.378464279e-01 
2.48 -6.794553191e-01 
2.50 -8.066133106e-01 
2.52 -9.206944760e-01 
2.54 -1.022952435e+00 
2.56 -1.114493946e+00 
2.58 -1.196272724e+00 
2.60 -1.269099935e+00 
2.62 -1.333666422e+00 
2.64 -1.390570995e+00 
2.66 -1.440343701e+00 
2.68 -1.483466828e+00 
2.70 -1.520387791e+00 
2.72 -1.551527084e+00 
2.74 -1.577282671e+00 
2.76 -1.598032585e+00 
2.78 -1.614136941e+00 
2.80 -1.625942412e+00 
2.82 -1.633784447e+00 
2.84 -1.637994217e+00 
2.86 -1.638903419e+00 
2.88 -1.636847811e+00 
2.90 -1.632184728e+00 
2.92 -1.625288318e+00 
2.94 -1.616442558e+00 
2.96 -1.605916642e+00 
2.98 -1.593958099e+00 
3.00 -1.580782532e+00 
3.02 -1.566568473e+00 
3.04 -1.551457387e+00 
3.06 -1.535557665e+00 
3.08 -1.518904695e+00 
3.10 -1.501480550e+00 
3.12 -1.483274566e+00 
3.14 -1.464289365e+00 
3.16 -1.444539757e+00 
3.18 -1.424053897e+00 
3.20 -1.402871622e+00 
3.22 -1.381042675e+00 
3.24 -1.358624756e+00 
3.26 -1.335681577e+00 
3.28 -1.312280941e+00 
3.30 -1.288492777e+00 
3.32 -1.264387096e+00 
3.34 -1.240031980e+00 
3.36 -1.215491808e+00 
3.38 -1.190825989e+00 
3.40 -1.166088204e+00 
3.42 -1.141326977e+00 
3.44 -1.116585261e+00 
3.46 -1.091901779e+00 
3.48 -1.067311576e+00 
3.50 -1.042846610e+00 
3.52 -1.018536158e+00 
3.54 -9.944070413e-01 
3.56 -9.704837130e-01 
3.58 -9.467882638e-01 
3.60 -9.233403974e-01 
3.62 -9.001574209e-01 
3.64 -8.772542842e-01 
3.66 -8.546436960e-01 
3.68 -8.323363336e-01 
3.70 -8.103411578e-01 
3.72 -7.886658310e-01 
3.74 -7.673172231e-01 
3.76 -7.463019699e-01 
3.78 -7.256270277e-01 
3.80 -7.053001480e-01 
3.82 -6.853301836e-01 
3.84 -6.657271481e-01 
3.86 -6.465019759e-01 
3.88 -6.276659895e-01 
3.90 -6.092301414e-01 
3.92 -5.912038775e-01 
3.94 -5.735955308e-01 
3.96 -5.564098414e-01 
3.98 -5.396489812e-01 
4.00 -5.233121926e-01 
4.02 -5.073960401e-01 
4.04 -4.918948311e-01 
4.06 -4.768011086e-01 
4.08 -4.621061336e-01 
4.10 -4.477999536e-01 
4.12 -4.338732017e-01 
4.14 -4.203149934e-01 
4.16 -4.071147180e-01 
4.18 -3.942616668e-01 
4.20 -3.817450493e-01 
4.22 -3.695539723e-01 
4.24 -3.576773954e-01 
4.26 -3.461040765e-01 
4.28 -3.348225152e-01 
4.30 -3.238209012e-01 
4.32 -3.130870739e-01 
4.34 -3.026084983e-01 
4.36 -2.923722605e-01 
4.38 -2.823650882e-01 
4.40 -2.725734007e-01 
4.42 -2.629833935e-01 
4.44 -2.535811638e-01 
4.46 -2.443528827e-01 
4.48 -2.352850208e-01 
4.50 -2.263646321e-01 
4.52 -2.175796978e-01 
4.54 -2.089195308e-01 
4.56 -2.003752324e-01 
4.58 -1.919401874e-01 
4.60 -1.836105716e-01 
4.62 -1.753858391e-01 
4.64 -1.672691407e-01 
4.66 -1.592676217e-01 
4.68 -1.513925414e-01 
4.70 -1.436591611e-01 
4.72 -1.360863613e-01 
4.74 -1.286959721e-01 
4.76 -1.215118320e-01 
4.78 -1.145586271e-01 
4.80 -1.078600612e-01 
4.82 -1.014397622e-01 
4.84 -9.531655554e-02 
4.86 -8.950589321e-02 
4.88 -8.401847514e-02 
4.90 -7.885985833e-02 
4.92 -7.403042277e-02 
4.94 -6.952562307e-02 
4.96 -6.533651863e-02 
4.98 -6.145048702e-02 
5.00 -5.785201974e-02 
5.02 -5.452353754e-02 
5.04 -5.144616551e-02 
5.06 -4.860042503e-02 
5.08 -4.596608069e-02 
5.10 -4.352386820e-02 
5.12 -4.125604988e-02 
5.14 -3.914575498e-02 
5.16 -3.717720162e-02 
5.18 -3.533583027e-02 
5.20 -3.360836915e-02 
5.22 -3.198285074e-02 
5.24 -3.044859472e-02 
5.26 -2.899616948e-02 
5.28 -2.761734079e-02 
5.30 -2.630501327e-02 
5.32 -2.505316745e-02 
5.34 -2.385679291e-02 
5.36 -2.271181640e-02 
5.38 -2.161502344e-02 
5.40 -2.056396978e-02 
5.42 -1.955688126e-02 
5.44 -1.859254200e-02 
5.46 -1.767017185e-02 
5.48 -1.678929692e-02 
5.50 -1.594961858e-02 
5.52 -1.515088827e-02 
5.54 -1.439279556e-02 
5.56 -1.367487638e-02 
5.58 -1.299644644e-02 
5.60 -1.235656227e-02 
5.62 -1.175400958e-02 
5.64 -1.118731572e-02 
5.66 -1.065478137e-02 
5.68 -1.015452544e-02 
5.70 -9.684536940e-03 
5.72 -9.242728283e-03 
5.74 -8.826985522e-03 
5.76 -8.435202272e-03 
5.78 -8.065333210e-03 
5.80 -7.715423036e-03 
5.82 -7.383618971e-03 
5.84 -7.068183612e-03 
5.86 -6.767501736e-03 
5.88 -6.480082360e-03 
5.90 -6.204557364e-03 
5.92 -5.939677868e-03 
5.94 -5.684309376e-03 
5.96 -5.437426530e-03 
5.98 -5.198108114e-03 
6.00 -4.965532788e-03