# 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 = Cu2Ta
# 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  2.133764537e+02 
1.16  1.962286661e+02 
1.18  1.804729857e+02 
1.20  1.659892516e+02 
1.22  1.526714998e+02 
1.24  1.404220999e+02 
1.26  1.291487228e+02 
1.28  1.187640640e+02 
1.30  1.091872830e+02 
1.32  1.003464014e+02 
1.34  9.217952551e+01 
1.36  8.463339327e+01 
1.38  7.766077945e+01 
1.40  7.121886862e+01 
1.42  6.526863574e+01 
1.44  5.977419737e+01 
1.46  5.470177215e+01 
1.48  5.001863904e+01 
1.50  4.569256675e+01 
1.52  4.169193318e+01 
1.54  3.798870275e+01 
1.56  3.456084141e+01 
1.58  3.138323807e+01 
1.60  2.843443565e+01 
1.62  2.569706301e+01 
1.64  2.315710088e+01 
1.66  2.080305254e+01 
1.68  1.862482438e+01 
1.70  1.661277891e+01 
1.72  1.475725931e+01 
1.74  1.304848781e+01 
1.76  1.147672940e+01 
1.78  1.003253982e+01 
1.80  8.706945918e+00 
1.82  7.491519894e+00 
1.84  6.378381757e+00 
1.86  5.360159847e+00 
1.88  4.429916871e+00 
1.90  3.581049722e+00 
1.92  2.807186593e+00 
1.94  2.102115183e+00 
1.96  1.459770143e+00 
1.98  8.742896973e-01 
2.00  3.401320570e-01 
2.02 -1.477735382e-01 
2.04 -5.938807554e-01 
2.06 -1.001931605e+00 
2.08 -1.374947231e+00 
2.10 -1.715306956e+00 
2.12 -2.024887978e+00 
2.14 -2.305225451e+00 
2.16 -2.557659025e+00 
2.18 -2.783288062e+00 
2.20 -2.983447345e+00 
2.22 -3.159738372e+00 
2.24 -3.313845953e+00 
2.26 -3.447560262e+00 
2.28 -3.562780982e+00 
2.30 -3.661013100e+00 
2.32 -3.743202043e+00 
2.34 -3.810577438e+00 
2.36 -3.864683996e+00 
2.38 -3.907270900e+00 
2.40 -3.940136015e+00 
2.42 -3.964966133e+00 
2.44 -3.983212989e+00 
2.46 -3.996026955e+00 
2.48 -4.004248805e+00 
2.50 -4.008444983e+00 
2.52 -4.008966599e+00 
2.54 -4.006014666e+00 
2.56 -3.999700015e+00 
2.58 -3.990092401e+00 
2.60 -3.977358219e+00 
2.62 -3.962053348e+00 
2.64 -3.943925829e+00 
2.66 -3.922707208e+00 
2.68 -3.898262585e+00 
2.70 -3.870578264e+00 
2.72 -3.839742443e+00 
2.74 -3.805918864e+00 
2.76 -3.769315725e+00 
2.78 -3.730170639e+00 
2.80 -3.688757780e+00 
2.82 -3.645322131e+00 
2.84 -3.600064318e+00 
2.86 -3.553148390e+00 
2.88 -3.504714013e+00 
2.90 -3.454889011e+00 
2.92 -3.403799457e+00 
2.94 -3.351576019e+00 
2.96 -3.298356491e+00 
2.98 -3.244285163e+00 
3.00 -3.189509983e+00 
3.02 -3.134178452e+00 
3.04 -3.078433066e+00 
3.06 -3.022406845e+00 
3.08 -2.966219337e+00 
3.10 -2.909973282e+00 
3.12 -2.853752052e+00 
3.14 -2.797617925e+00 
3.16 -2.741611219e+00 
3.18 -2.685750368e+00 
3.20 -2.630032962e+00 
3.22 -2.574437769e+00 
3.24 -2.518927722e+00 
3.26 -2.463453707e+00 
3.28 -2.407958937e+00 
3.30 -2.352383551e+00 
3.32 -2.296669033e+00 
3.34 -2.240762019e+00 
3.36 -2.184617125e+00 
3.38 -2.128198558e+00 
3.40 -2.071480447e+00 
3.42 -2.014446012e+00 
3.44 -1.957085851e+00 
3.46 -1.899395734e+00 
3.48 -1.841374331e+00 
3.50 -1.783021293e+00 
3.52 -1.724336036e+00 
3.54 -1.665317484e+00 
3.56 -1.605964930e+00 
3.58 -1.546280088e+00 
3.60 -1.486270276e+00 
3.62 -1.425952630e+00 
3.64 -1.365359111e+00 
3.66 -1.304542008e+00 
3.68 -1.243579504e+00 
3.70 -1.182580803e+00 
3.72 -1.121690194e+00 
3.74 -1.061089395e+00 
3.76 -1.000997507e+00 
3.78 -9.416680303e-01 
3.80 -8.833826029e-01 
3.82 -8.264414670e-01 
3.84 -7.711511291e-01 
3.86 -7.178101272e-01 
3.88 -6.666942201e-01 
3.90 -6.180425187e-01 
3.92 -5.720460238e-01 
3.94 -5.288397134e-01 
3.96 -4.884988039e-01 
3.98 -4.510392083e-01 
4.00 -4.164216812e-01 
4.02 -3.845587656e-01 
4.04 -3.553234911e-01 
4.06 -3.285587980e-01 
4.08 -3.040868317e-01 
4.10 -2.817174804e-01 
4.12 -2.612557837e-01 
4.14 -2.425080496e-01 
4.16 -2.252866904e-01 
4.18 -2.094138917e-01 
4.20 -1.947242943e-01 
4.22 -1.810668821e-01 
4.24 -1.683062616e-01 
4.26 -1.563234825e-01 
4.28 -1.450165056e-01 
4.30 -1.343003682e-01 
4.32 -1.241070615e-01 
4.34 -1.143850753e-01 
4.36 -1.050983031e-01 
4.38 -9.622502282e-02 
4.40 -8.775666081e-02 
4.42 -7.969471567e-02 
4.44 -7.204813838e-02 
4.46 -6.483043478e-02 
4.48 -5.805669170e-02 
4.50 -5.174077804e-02 
4.52 -4.589295935e-02 
4.54 -4.051811254e-02 
4.56 -3.561464799e-02 
4.58 -3.117414354e-02 
4.60 -2.718162343e-02 
4.62 -2.361635288e-02 
4.64 -2.045296845e-02 
4.66 -1.766276160e-02 
4.68 -1.521497164e-02 
4.70 -1.307799182e-02 
4.72 -1.122012074e-02 
4.74 -9.610985943e-03 
4.76 -8.222049416e-03 
4.78 -7.026669075e-03 
4.80 -6.000394159e-03 
4.82 -5.121098416e-03 
4.84 -4.368989695e-03 
4.86 -3.726534220e-03 
4.88 -3.178323110e-03 
4.90 -2.710905223e-03 
4.92 -2.312603695e-03 
4.94 -1.973328740e-03 
4.96 -1.684395317e-03 
4.98 -1.438351147e-03 
5.00 -1.228818256e-03 
5.02 -1.050349545e-03 
5.04 -8.983007471e-04 
5.06 -7.687173463e-04 
5.08 -6.582355746e-04 
5.10 -5.639963410e-04 
5.12 -4.835708203e-04 
5.14 -4.148964198e-04 
5.16 -3.562218796e-04 
5.18 -3.060603454e-04 
5.20 -2.631493544e-04 
5.22 -2.264167808e-04 
5.24 -1.949518988e-04 
5.26 -1.679808235e-04 
5.28 -1.448456856e-04 
5.30 -1.249869842e-04 
5.32 -1.079286400e-04 
5.34 -9.326533860e-05 
5.36 -8.065181427e-05 
5.38 -6.979377774e-05 
5.40 -6.044023374e-05 
5.42 -5.237697487e-05 
5.44 -4.542106992e-05 
5.46 -3.941619301e-05 
5.48 -3.422866370e-05 
5.50 -2.974408831e-05 
5.52 -2.586450976e-05 
5.54 -2.250598770e-05 
5.56 -1.959654271e-05 
5.58 -1.707440893e-05 
5.60 -1.488654773e-05 
5.62 -1.298738289e-05 
5.64 -1.133772339e-05 
5.66 -9.903845435e-06 
5.68 -8.656709756e-06 
5.70 -7.571293664e-06 
5.72 -6.626020748e-06 
5.74 -5.802273582e-06 
5.76 -5.083977064e-06 
5.78 -4.457241933e-06 
5.80 -3.910059541e-06 
5.82 -3.432040351e-06 
5.84 -3.014189731e-06 
5.86 -2.648715605e-06 
5.88 -2.328863313e-06 
5.90 -2.048773741e-06 
5.92 -1.803361362e-06 
5.94 -1.588209322e-06 
5.96 -1.399479119e-06 
5.98 -1.233832818e-06 
6.00 -1.088365988e-06