# 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 = AuTi2
# 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  3.739237800e+02 
1.16  3.455747356e+02 
1.18  3.194837264e+02 
1.20  2.954531707e+02 
1.22  2.733012536e+02 
1.24  2.528622900e+02 
1.26  2.339883693e+02 
1.28  2.165484339e+02 
1.30  2.004254593e+02 
1.32  1.855136407e+02 
1.34  1.717158735e+02 
1.36  1.589420164e+02 
1.38  1.471089068e+02 
1.40  1.361411040e+02 
1.42  1.259705932e+02 
1.44  1.165354402e+02 
1.46  1.077784405e+02 
1.48  9.964659225e+01 
1.50  9.209133444e+01 
1.52  8.506879217e+01 
1.54  7.853949269e+01 
1.56  7.246758154e+01 
1.58  6.681986093e+01 
1.60  6.156510699e+01 
1.62  5.667392213e+01 
1.64  5.211892582e+01 
1.66  4.787491866e+01 
1.68  4.391897296e+01 
1.70  4.023244059e+01 
1.72  3.681008875e+01 
1.74  3.363647696e+01 
1.76  3.069417811e+01 
1.78  2.796680309e+01 
1.80  2.543887857e+01 
1.82  2.309587221e+01 
1.84  2.092426087e+01 
1.86  1.891157164e+01 
1.88  1.704637117e+01 
1.90  1.531821067e+01 
1.92  1.371753569e+01 
1.94  1.223556001e+01 
1.96  1.086411713e+01 
1.98  9.595522807e+00 
2.00  8.422491742e+00 
2.02  7.338118940e+00 
2.04  6.335900980e+00 
2.06  5.409769087e+00 
2.08  4.554122756e+00 
2.10  3.763855326e+00 
2.12  3.034350752e+00 
2.14  2.361439083e+00 
2.16  1.741318799e+00 
2.18  1.170469568e+00 
2.20  6.455771062e-01 
2.22  1.634813551e-01 
2.24 -2.788450145e-01 
2.26 -6.842868882e-01 
2.28 -1.055554755e+00 
2.30 -1.395149314e+00 
2.32 -1.705346074e+00 
2.34 -1.988207312e+00 
2.36 -2.245612832e+00 
2.38 -2.479293869e+00 
2.40 -2.690859840e+00 
2.42 -2.881816702e+00 
2.44 -3.053579553e+00 
2.46 -3.207483251e+00 
2.48 -3.344791748e+00 
2.50 -3.466734863e+00 
2.52 -3.574594455e+00 
2.54 -3.669316465e+00 
2.56 -3.751782868e+00 
2.58 -3.822858554e+00 
2.60 -3.883381339e+00 
2.62 -3.934152121e+00 
2.64 -3.975925435e+00 
2.66 -4.009335361e+00 
2.68 -4.034695212e+00 
2.70 -4.052269502e+00 
2.72 -4.062355787e+00 
2.74 -4.065300983e+00 
2.76 -4.061511981e+00 
2.78 -4.051262766e+00 
2.80 -4.034840426e+00 
2.82 -4.012555874e+00 
2.84 -3.984740928e+00 
2.86 -3.951746002e+00 
2.88 -3.913937959e+00 
2.90 -3.871696954e+00 
2.92 -3.825409637e+00 
2.94 -3.775457915e+00 
2.96 -3.722220942e+00 
2.98 -3.666074145e+00 
3.00 -3.607388762e+00 
3.02 -3.546532547e+00 
3.04 -3.483868840e+00 
3.06 -3.419752531e+00 
3.08 -3.354520858e+00 
3.10 -3.288483593e+00 
3.12 -3.221913708e+00 
3.14 -3.155042265e+00 
3.16 -3.088057722e+00 
3.18 -3.021109955e+00 
3.20 -2.954316578e+00 
3.22 -2.887770066e+00 
3.24 -2.821544290e+00 
3.26 -2.755699739e+00 
3.28 -2.690287280e+00 
3.30 -2.625350658e+00 
3.32 -2.560928114e+00 
3.34 -2.497053528e+00 
3.36 -2.433757483e+00 
3.38 -2.371068572e+00 
3.40 -2.309015146e+00 
3.42 -2.247627859e+00 
3.44 -2.186942354e+00 
3.46 -2.127002674e+00 
3.48 -2.067864207e+00 
3.50 -2.009595690e+00 
3.52 -1.952279344e+00 
3.54 -1.896008421e+00 
3.56 -1.840881926e+00 
3.58 -1.786997022e+00 
3.60 -1.734440375e+00 
3.62 -1.683280207e+00 
3.64 -1.633560669e+00 
3.66 -1.585299543e+00 
3.68 -1.538489365e+00 
3.70 -1.493101241e+00 
3.72 -1.449090213e+00 
3.74 -1.406400997e+00 
3.76 -1.364973226e+00 
3.78 -1.324745667e+00 
3.80 -1.285659288e+00 
3.82 -1.247659225e+00 
3.84 -1.210695845e+00 
3.86 -1.174725146e+00 
3.88 -1.139708673e+00 
3.90 -1.105613143e+00 
3.92 -1.072409816e+00 
3.94 -1.040074132e+00 
3.96 -1.008584602e+00 
3.98 -9.779224618e-01 
4.00 -9.480709761e-01 
4.02 -9.190148897e-01 
4.04 -8.907399421e-01 
4.06 -8.632324600e-01 
4.08 -8.364790217e-01 
4.10 -8.104661122e-01 
4.12 -7.851802660e-01 
4.14 -7.606073901e-01 
4.16 -7.367330542e-01 
4.18 -7.135423451e-01 
4.20 -6.910198566e-01 
4.22 -6.691497084e-01 
4.24 -6.479155869e-01 
4.26 -6.273008018e-01 
4.28 -6.072883544e-01 
4.30 -5.878610104e-01 
4.32 -5.690013748e-01 
4.34 -5.506919613e-01 
4.36 -5.329152541e-01 
4.38 -5.156537561e-01 
4.40 -4.988900227e-01 
4.42 -4.826066776e-01 
4.44 -4.667864120e-01 
4.46 -4.514119686e-01 
4.48 -4.364661124e-01 
4.50 -4.219315944e-01 
4.52 -4.077911126e-01 
4.54 -3.940272758e-01 
4.56 -3.806225766e-01 
4.58 -3.675593800e-01 
4.60 -3.548199334e-01 
4.62 -3.423864032e-01 
4.64 -3.302409458e-01 
4.66 -3.183658177e-01 
4.68 -3.067435318e-01 
4.70 -2.953570652e-01 
4.72 -2.841901233e-01 
4.74 -2.732274641e-01 
4.76 -2.624552818e-01 
4.78 -2.518616463e-01 
4.80 -2.414368765e-01 
4.82 -2.311745108e-01 
4.84 -2.210710924e-01 
4.86 -2.111271403e-01 
4.88 -2.013473916e-01 
4.90 -1.917410319e-01 
4.92 -1.823217202e-01 
4.94 -1.731073562e-01 
4.96 -1.641195506e-01 
4.98 -1.553827859e-01 
5.00 -1.469232856e-01 
5.02 -1.387676557e-01 
5.04 -1.309413922e-01 
5.06 -1.234673839e-01 
5.08 -1.163645479e-01 
5.10 -1.096467277e-01 
5.12 -1.033219470e-01 
5.14 -9.739208403e-02 
5.16 -9.185295817e-02 
5.18 -8.669478505e-02 
5.20 -8.190264126e-02 
5.22 -7.745755133e-02 
5.24 -7.333845791e-02 
5.26 -6.952217712e-02 
5.28 -6.598433794e-02 
5.30 -6.270022663e-02 
5.32 -5.964546510e-02 
5.34 -5.679652333e-02 
5.36 -5.413107956e-02 
5.38 -5.162825043e-02 
5.40 -4.926871631e-02 
5.42 -4.703476771e-02 
5.44 -4.491029615e-02 
5.46 -4.288075009e-02 
5.48 -4.093307281e-02 
5.50 -3.905563532e-02 
5.52 -3.723817429e-02 
5.54 -3.547174148e-02 
5.56 -3.374866852e-02 
5.58 -3.206254781e-02 
5.60 -3.040822813e-02 
5.62 -2.878182049e-02 
5.64 -2.718070802e-02 
5.66 -2.560355092e-02 
5.68 -2.405027679e-02 
5.70 -2.252204527e-02 
5.72 -2.102117721e-02 
5.74 -1.955104000e-02 
5.76 -1.811588492e-02 
5.78 -1.672063703e-02 
5.80 -1.537064336e-02 
5.82 -1.407139284e-02 
5.84 -1.282822493e-02 
5.86 -1.164604694e-02 
5.88 -1.052908105e-02 
5.90 -9.480659386e-03 
5.92 -8.503015133e-03 
5.94 -7.597184933e-03 
5.96 -6.763355635e-03 
5.98 -6.000636154e-03 
6.00 -5.307147912e-03