# 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 = Ta2Ti
# 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  4.233227030e+02 
1.16  3.911382567e+02 
1.18  3.614839377e+02 
1.20  3.341459937e+02 
1.22  3.089335314e+02 
1.24  2.856732185e+02 
1.26  2.642060011e+02 
1.28  2.443853264e+02 
1.30  2.260761759e+02 
1.32  2.091542658e+02 
1.34  1.935051876e+02 
1.36  1.790237850e+02 
1.38  1.656140528e+02 
1.40  1.531891713e+02 
1.42  1.416709573e+02 
1.44  1.309886050e+02 
1.46  1.210771672e+02 
1.48  1.118762718e+02 
1.50  1.033294096e+02 
1.52  9.538386486e+01 
1.54  8.799108498e+01 
1.56  8.110712428e+01 
1.58  7.469282361e+01 
1.60  6.871358399e+01 
1.62  6.313882430e+01 
1.64  5.794129789e+01 
1.66  5.309638885e+01 
1.68  4.858147606e+01 
1.70  4.437544374e+01 
1.72  4.045836837e+01 
1.74  3.681134786e+01 
1.76  3.341641184e+01 
1.78  3.025650237e+01 
1.80  2.732312130e+01 
1.82  2.460637173e+01 
1.84  2.209102793e+01 
1.86  1.976301101e+01 
1.88  1.760935067e+01 
1.90  1.561774922e+01 
1.92  1.377663493e+01 
1.94  1.207509002e+01 
1.96  1.050282127e+01 
1.98  9.050179040e+00 
2.00  7.708199247e+00 
2.02  6.468638817e+00 
2.04  5.323988684e+00 
2.06  4.267462909e+00 
2.08  3.292966587e+00 
2.10  2.395041892e+00 
2.12  1.568791581e+00 
2.14  8.097865015e-01 
2.16  1.139722383e-01 
2.18 -5.224125438e-01 
2.20 -1.102903357e+00 
2.22 -1.630869916e+00 
2.24 -2.109576658e+00 
2.26 -2.542246448e+00 
2.28 -2.932121140e+00 
2.30 -3.282504537e+00 
2.32 -3.596770878e+00 
2.34 -3.878327054e+00 
2.36 -4.130532530e+00 
2.38 -4.356594140e+00 
2.40 -4.559461741e+00 
2.42 -4.741748090e+00 
2.44 -4.905686841e+00 
2.46 -5.053041570e+00 
2.48 -5.185093655e+00 
2.50 -5.303385322e+00 
2.52 -5.409192923e+00 
2.54 -5.503543502e+00 
2.56 -5.587284995e+00 
2.58 -5.661139753e+00 
2.60 -5.725742870e+00 
2.62 -5.781522478e+00 
2.64 -5.828446909e+00 
2.66 -5.866508193e+00 
2.68 -5.895801563e+00 
2.70 -5.916494155e+00 
2.72 -5.928800032e+00 
2.74 -5.932960290e+00 
2.76 -5.929227554e+00 
2.78 -5.917854499e+00 
2.80 -5.899104951e+00 
2.82 -5.873255098e+00 
2.84 -5.840480641e+00 
2.86 -5.800950587e+00 
2.88 -5.754837718e+00 
2.90 -5.702322587e+00 
2.92 -5.643598379e+00 
2.94 -5.578875951e+00 
2.96 -5.508388295e+00 
2.98 -5.432391743e+00 
3.00 -5.351115812e+00 
3.02 -5.264758912e+00 
3.04 -5.173547180e+00 
3.06 -5.077723122e+00 
3.08 -4.977529906e+00 
3.10 -4.873200117e+00 
3.12 -4.764952824e+00 
3.14 -4.653001087e+00 
3.16 -4.537567567e+00 
3.18 -4.418906427e+00 
3.20 -4.297325855e+00 
3.22 -4.173207495e+00 
3.24 -4.047019149e+00 
3.26 -3.919318231e+00 
3.28 -3.790744519e+00 
3.30 -3.662002033e+00 
3.32 -3.533831266e+00 
3.34 -3.406974479e+00 
3.36 -3.282137899e+00 
3.38 -3.159955338e+00 
3.40 -3.040957536e+00 
3.42 -2.925550706e+00 
3.44 -2.814005939e+00 
3.46 -2.706459919e+00 
3.48 -2.602925285e+00 
3.50 -2.503308234e+00 
3.52 -2.407430296e+00 
3.54 -2.315051376e+00 
3.56 -2.225891721e+00 
3.58 -2.139651384e+00 
3.60 -2.056026668e+00 
3.62 -1.974723801e+00 
3.64 -1.895470450e+00 
3.66 -1.818025683e+00 
3.68 -1.742188691e+00 
3.70 -1.667806185e+00 
3.72 -1.594778076e+00 
3.74 -1.523060852e+00 
3.76 -1.452668142e+00 
3.78 -1.383668054e+00 
3.80 -1.316177195e+00 
3.82 -1.250351569e+00 
3.84 -1.186374899e+00 
3.86 -1.124445236e+00 
3.88 -1.064760934e+00 
3.90 -1.007507156e+00 
3.92 -9.528440252e-01 
3.94 -9.008973187e-01 
3.96 -8.517522697e-01 
3.98 -8.054506628e-01 
4.00 -7.619910508e-01 
4.02 -7.213316230e-01 
4.04 -6.833950715e-01 
4.06 -6.480747322e-01 
4.08 -6.152413061e-01 
4.10 -5.847494555e-01 
4.12 -5.564445365e-01 
4.14 -5.301673307e-01 
4.16 -5.057591567e-01 
4.18 -4.830653412e-01 
4.20 -4.619379098e-01 
4.22 -4.422374483e-01 
4.24 -4.238342546e-01 
4.26 -4.066089143e-01 
4.28 -3.904524255e-01 
4.30 -3.752659896e-01 
4.32 -3.609605648e-01 
4.34 -3.474562662e-01 
4.36 -3.346816753e-01 
4.38 -3.225731057e-01 
4.40 -3.110738681e-01 
4.42 -3.001335543e-01 
4.44 -2.897072942e-01 
4.46 -2.797549473e-01 
4.48 -2.702413061e-01 
4.50 -2.611349779e-01 
4.52 -2.524078686e-01 
4.54 -2.440348147e-01 
4.56 -2.359932420e-01 
4.58 -2.282628571e-01 
4.60 -2.208253708e-01 
4.62 -2.136642529e-01 
4.64 -2.067645168e-01 
4.66 -2.001125298e-01 
4.68 -1.936958484e-01 
4.70 -1.875030734e-01 
4.72 -1.815237246e-01 
4.74 -1.757481314e-01 
4.76 -1.701673373e-01 
4.78 -1.647730171e-01 
4.80 -1.595573483e-01 
4.82 -1.545131819e-01 
4.84 -1.496336204e-01 
4.86 -1.449122257e-01 
4.88 -1.403429089e-01 
4.90 -1.359198925e-01 
4.92 -1.316376771e-01 
4.94 -1.274910116e-01 
4.96 -1.234748665e-01 
4.98 -1.195844093e-01 
5.00 -1.158149830e-01 
5.02 -1.121620858e-01 
5.04 -1.086213521e-01 
5.06 -1.051885353e-01 
5.08 -1.018594913e-01 
5.10 -9.863016249e-02 
5.12 -9.549656354e-02 
5.14 -9.245476639e-02 
5.16 -8.950088667e-02 
5.18 -8.663107029e-02 
5.20 -8.384148065e-02 
5.22 -8.112828642e-02 
5.24 -7.848765011e-02 
5.26 -7.591571768e-02 
5.28 -7.340860953e-02 
5.30 -7.096241319e-02 
5.32 -6.857317909e-02 
5.34 -6.623691780e-02 
5.36 -6.394960213e-02 
5.38 -6.170717499e-02 
5.40 -5.950556290e-02 
5.42 -5.734069721e-02 
5.44 -5.520854452e-02 
5.46 -5.310514779e-02 
5.48 -5.102667984e-02 
5.50 -4.896951035e-02 
5.52 -4.693028733e-02 
5.54 -4.490603274e-02 
5.56 -4.289425401e-02 
5.58 -4.089306416e-02 
5.60 -3.890130922e-02 
5.62 -3.691869677e-02 
5.64 -3.494591617e-02 
5.66 -3.298473986e-02 
5.68 -3.103809314e-02 
5.70 -2.911007933e-02 
5.72 -2.720594827e-02 
5.74 -2.533199861e-02 
5.76 -2.349540568e-02 
5.78 -2.170379468e-02 
5.80 -1.996529345e-02 
5.82 -1.828816988e-02 
5.84 -1.668032910e-02 
5.86 -1.514896246e-02 
5.88 -1.370023369e-02 
5.90 -1.233902709e-02 
5.92 -1.106877552e-02 
5.94 -9.891377330e-03 
5.96 -8.807201957e-03 
5.98 -7.815175223e-03 
6.00 -6.912929173e-03