# 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 = NiTi2
# 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  2.396497623e+02 
1.16  2.202434452e+02 
1.18  2.024375130e+02 
1.20  1.860909274e+02 
1.22  1.710751444e+02 
1.24  1.572734282e+02 
1.26  1.445808773e+02 
1.28  1.329038174e+02 
1.30  1.221572667e+02 
1.32  1.122621531e+02 
1.34  1.031447192e+02 
1.36  9.473780828e+01 
1.38  8.698175529e+01 
1.40  7.982377595e+01 
1.42  7.321661096e+01 
1.44  6.711746496e+01 
1.46  6.148729865e+01 
1.48  5.629007711e+01 
1.50  5.149209026e+01 
1.52  4.706169639e+01 
1.54  4.296948452e+01 
1.56  3.918849480e+01 
1.58  3.569416080e+01 
1.60  3.246404253e+01 
1.62  2.947768104e+01 
1.64  2.671702151e+01 
1.66  2.416543020e+01 
1.68  2.180737933e+01 
1.70  1.962834215e+01 
1.72  1.761474211e+01 
1.74  1.575405021e+01 
1.76  1.403480666e+01 
1.78  1.244650910e+01 
1.80  1.097950905e+01 
1.82  9.625010637e+00 
1.84  8.375090447e+00 
1.86  7.222616040e+00 
1.88  6.161044475e+00 
1.90  5.184191753e+00 
1.92  4.286072507e+00 
1.94  3.460859780e+00 
1.96  2.702954120e+00 
1.98  2.007100066e+00 
2.00  1.368467544e+00 
2.02  7.826525282e-01 
2.04  2.456198299e-01 
2.06 -2.463512766e-01 
2.08 -6.966772698e-01 
2.10 -1.108445006e+00 
2.12 -1.484394229e+00 
2.14 -1.826941365e+00 
2.16 -2.138244107e+00 
2.18 -2.420284625e+00 
2.20 -2.674948522e+00 
2.22 -2.904087242e+00 
2.24 -3.109555066e+00 
2.26 -3.293215935e+00 
2.28 -3.456922412e+00 
2.30 -3.602476828e+00 
2.32 -3.731591301e+00 
2.34 -3.845852366e+00 
2.36 -3.946692961e+00 
2.38 -4.035371699e+00 
2.40 -4.112965267e+00 
2.42 -4.180458643e+00 
2.44 -4.238685936e+00 
2.46 -4.288120434e+00 
2.48 -4.329213614e+00 
2.50 -4.362421010e+00 
2.52 -4.388206487e+00 
2.54 -4.407037172e+00 
2.56 -4.419369487e+00 
2.58 -4.425474501e+00 
2.60 -4.425409282e+00 
2.62 -4.419281342e+00 
2.64 -4.407258416e+00 
2.66 -4.389560838e+00 
2.68 -4.366457330e+00 
2.70 -4.338260644e+00 
2.72 -4.305291539e+00 
2.74 -4.267776599e+00 
2.76 -4.225954483e+00 
2.78 -4.180099732e+00 
2.80 -4.130506340e+00 
2.82 -4.077474274e+00 
2.84 -4.021302590e+00 
2.86 -3.962287455e+00 
2.88 -3.900723520e+00 
2.90 -3.836905508e+00 
2.92 -3.771127726e+00 
2.94 -3.703681044e+00 
2.96 -3.634848802e+00 
2.98 -3.564903708e+00 
3.00 -3.494106803e+00 
3.02 -3.422707682e+00 
3.04 -3.350943888e+00 
3.06 -3.279038616e+00 
3.08 -3.207194797e+00 
3.10 -3.135590102e+00 
3.12 -3.064372904e+00 
3.14 -2.993661942e+00 
3.16 -2.923548730e+00 
3.18 -2.854102685e+00 
3.20 -2.785376538e+00 
3.22 -2.717411188e+00 
3.24 -2.650239264e+00 
3.26 -2.583887330e+00 
3.28 -2.518376971e+00 
3.30 -2.453725152e+00 
3.32 -2.389944248e+00 
3.34 -2.327042104e+00 
3.36 -2.265022417e+00 
3.38 -2.203885666e+00 
3.40 -2.143630754e+00 
3.42 -2.084257654e+00 
3.44 -2.025770373e+00 
3.46 -1.968180836e+00 
3.48 -1.911512433e+00 
3.50 -1.855802736e+00 
3.52 -1.801104383e+00 
3.54 -1.747483346e+00 
3.56 -1.695014287e+00 
3.58 -1.643773438e+00 
3.60 -1.593830277e+00 
3.62 -1.545239737e+00 
3.64 -1.498036577e+00 
3.66 -1.452232952e+00 
3.68 -1.407819255e+00 
3.70 -1.364767535e+00 
3.72 -1.323036355e+00 
3.74 -1.282575943e+00 
3.76 -1.243332806e+00 
3.78 -1.205253325e+00 
3.80 -1.168286215e+00 
3.82 -1.132383955e+00 
3.84 -1.097503385e+00 
3.86 -1.063605716e+00 
3.88 -1.030656161e+00 
3.90 -9.986233518e-01 
3.92 -9.674786028e-01 
3.94 -9.371955218e-01 
3.96 -9.077489384e-01 
3.98 -8.791146776e-01 
4.00 -8.512690214e-01 
4.02 -8.241883474e-01 
4.04 -7.978488528e-01 
4.06 -7.722263580e-01 
4.08 -7.472961791e-01 
4.10 -7.230329834e-01 
4.12 -6.994111292e-01 
4.14 -6.764041861e-01 
4.16 -6.539854402e-01 
4.18 -6.321279927e-01 
4.20 -6.108050432e-01 
4.22 -5.899902674e-01 
4.24 -5.696582980e-01 
4.26 -5.497853128e-01 
4.28 -5.303497235e-01 
4.30 -5.113329460e-01 
4.32 -4.927202143e-01 
4.34 -4.745013774e-01 
4.36 -4.566715964e-01 
4.38 -4.392318430e-01 
4.40 -4.221890884e-01 
4.42 -4.055560842e-01 
4.44 -3.893506639e-01 
4.46 -3.735945465e-01 
4.48 -3.583116922e-01 
4.50 -3.435263356e-01 
4.52 -3.292608822e-01 
4.54 -3.155338930e-01 
4.56 -3.023583743e-01 
4.58 -2.897405514e-01 
4.60 -2.776792282e-01 
4.62 -2.661657498e-01 
4.64 -2.551845069e-01 
4.66 -2.447138618e-01 
4.68 -2.347273477e-01 
4.70 -2.251949965e-01 
4.72 -2.160846704e-01 
4.74 -2.073633064e-01 
4.76 -1.989980241e-01 
4.78 -1.909570733e-01 
4.80 -1.832105159e-01 
4.82 -1.757313410e-01 
4.84 -1.684952748e-01 
4.86 -1.614817182e-01 
4.88 -1.546739474e-01 
4.90 -1.480593451e-01 
4.92 -1.416295087e-01 
4.94 -1.353802093e-01 
4.96 -1.293111688e-01 
4.98 -1.234256319e-01 
5.00 -1.177297293e-01 
5.02 -1.122316452e-01 
5.04 -1.069406404e-01 
5.06 -1.018660034e-01 
5.08 -9.701595362e-02 
5.10 -9.239640637e-02 
5.12 -8.801134557e-02 
5.14 -8.386176399e-02 
5.16 -7.994534365e-02 
5.18 -7.625657307e-02 
5.20 -7.278708219e-02 
5.22 -6.952612801e-02 
5.24 -6.646115966e-02 
5.26 -6.357839795e-02 
5.28 -6.086337860e-02 
5.30 -5.830142495e-02 
5.32 -5.587803258e-02 
5.34 -5.357916180e-02 
5.36 -5.139144379e-02 
5.38 -4.930231254e-02 
5.40 -4.730007747e-02 
5.42 -4.537395233e-02 
5.44 -4.351405499e-02 
5.46 -4.171139105e-02 
5.48 -3.995783162e-02 
5.50 -3.824609387e-02 
5.52 -3.656973006e-02 
5.54 -3.492312916e-02 
5.56 -3.330153266e-02 
5.58 -3.170106417e-02 
5.60 -3.011877049e-02 
5.62 -2.855266930e-02 
5.64 -2.700179681e-02 
5.66 -2.546624669e-02 
5.68 -2.394719032e-02 
5.70 -2.244686780e-02 
5.72 -2.096853970e-02 
5.74 -1.951639192e-02 
5.76 -1.809538940e-02 
5.78 -1.671107979e-02 
5.80 -1.536935289e-02 
5.82 -1.407616993e-02 
5.84 -1.283727995e-02 
5.86 -1.165794351e-02 
5.88 -1.054268531e-02 
5.90 -9.495094088e-03 
5.92 -8.517621980e-03 
5.94 -7.611492533e-03 
5.96 -6.777031431e-03 
5.98 -6.013458517e-03 
6.00 -5.318982998e-03