# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2021--Sivaraman-G-Gallington-L-Krishnamoorthy-A-N-et-al--Hf-O
# implementation = 2021--Sivaraman-G--Hf-O--LAMMPS--ipr1
# composition = 7282
# 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 2022-12-14

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  4.000189706e+01 
0.80  3.656647919e+01 
0.82  3.335503703e+01 
0.84  3.054037018e+01 
0.86  2.817561862e+01 
0.88  2.616900586e+01 
0.90  2.427333791e+01 
0.92  2.237783155e+01 
0.94  2.061156463e+01 
0.96  1.912716613e+01 
0.98  1.787875191e+01 
1.00  1.691944649e+01 
1.02  1.615872602e+01 
1.04  1.546902024e+01 
1.06  1.472573084e+01 
1.08  1.392429377e+01 
1.10  1.302730479e+01 
1.12  1.209259431e+01 
1.14  1.111634321e+01 
1.16  1.007216684e+01 
1.18  9.043255810e+00 
1.20  8.182478178e+00 
1.22  7.517640108e+00 
1.24  7.036319991e+00 
1.26  6.728781085e+00 
1.28  6.533170353e+00 
1.30  6.384629605e+00 
1.32  6.228086308e+00 
1.34  6.026086972e+00 
1.36  5.808048463e+00 
1.38  5.557953264e+00 
1.40  5.245090737e+00 
1.42  4.851492488e+00 
1.44  4.424905770e+00 
1.46  3.960616668e+00 
1.48  3.432852666e+00 
1.50  2.822675486e+00 
1.52  2.122858592e+00 
1.54  1.334003174e+00 
1.56  4.671116093e-01 
1.58 -4.336613485e-01 
1.60 -1.346408126e+00 
1.62 -2.227963006e+00 
1.64 -3.064999756e+00 
1.66 -3.850895151e+00 
1.68 -4.581884083e+00 
1.70 -5.257466082e+00 
1.72 -5.879766397e+00 
1.74 -6.451015733e+00 
1.76 -6.964481249e+00 
1.78 -7.421519976e+00 
1.80 -7.824130528e+00 
1.82 -8.171738234e+00 
1.84 -8.461540834e+00 
1.86 -8.687847892e+00 
1.88 -8.850078295e+00 
1.90 -8.956944880e+00 
1.92 -9.025558649e+00 
1.94 -9.077706904e+00 
1.96 -9.132962222e+00 
1.98 -9.202859946e+00 
2.00 -9.289767032e+00 
2.02 -9.386801117e+00 
2.04 -9.486381998e+00 
2.06 -9.586357826e+00 
2.08 -9.687166549e+00 
2.10 -9.787906425e+00 
2.12 -9.876122234e+00 
2.14 -9.950478498e+00 
2.16 -1.001040689e+01 
2.18 -1.005407907e+01 
2.20 -1.007885684e+01 
2.22 -1.008233519e+01 
2.24 -1.006358315e+01 
2.26 -1.002399590e+01 
2.28 -9.967333896e+00 
2.30 -9.898961074e+00 
2.32 -9.824689038e+00 
2.34 -9.749722035e+00 
2.36 -9.677986435e+00 
2.38 -9.611839307e+00 
2.40 -9.551985478e+00 
2.42 -9.497435029e+00 
2.44 -9.445425905e+00 
2.46 -9.391955743e+00 
2.48 -9.336636913e+00 
2.50 -9.279289350e+00 
2.52 -9.219348805e+00 
2.54 -9.156201267e+00 
2.56 -9.089238264e+00 
2.58 -9.017908557e+00 
2.60 -8.941778347e+00 
2.62 -8.862436776e+00 
2.64 -8.780955965e+00 
2.66 -8.697171985e+00 
2.68 -8.611029286e+00 
2.70 -8.522567271e+00 
2.72 -8.431899287e+00 
2.74 -8.339184312e+00 
2.76 -8.244590090e+00 
2.78 -8.148245587e+00 
2.80 -8.050180907e+00 
2.82 -7.950254291e+00 
2.84 -7.848068379e+00 
2.86 -7.742881279e+00 
2.88 -7.633521998e+00 
2.90 -7.518324158e+00 
2.92 -7.395096209e+00 
2.94 -7.261149469e+00 
2.96 -7.113405577e+00 
2.98 -6.948600062e+00 
3.00 -6.763586633e+00 
3.02 -6.553587160e+00 
3.04 -6.315354573e+00 
3.06 -6.049581747e+00 
3.08 -5.758795361e+00 
3.10 -5.447399851e+00 
3.12 -5.121444849e+00 
3.14 -4.788136739e+00 
3.16 -4.455178687e+00 
3.18 -4.130064806e+00 
3.20 -3.819458244e+00 
3.22 -3.528750573e+00 
3.24 -3.261845773e+00 
3.26 -3.021157287e+00 
3.28 -2.807767557e+00 
3.30 -2.621683198e+00 
3.32 -2.462122666e+00 
3.34 -2.327789236e+00 
3.36 -2.217101641e+00 
3.38 -2.128371956e+00 
3.40 -2.059932188e+00 
3.42 -2.010217338e+00 
3.44 -1.977814267e+00 
3.46 -1.961484090e+00 
3.48 -1.957783343e+00 
3.50 -1.961374525e+00 
3.52 -1.972394558e+00 
3.54 -1.991270229e+00 
3.56 -2.018457801e+00 
3.58 -2.054314433e+00 
3.60 -2.098951447e+00 
3.62 -2.152095238e+00 
3.64 -2.212986943e+00 
3.66 -2.280348756e+00 
3.68 -2.352432341e+00 
3.70 -2.427146014e+00 
3.72 -2.502238595e+00 
3.74 -2.575505078e+00 
3.76 -2.644976639e+00 
3.78 -2.709064658e+00 
3.80 -2.766641849e+00 
3.82 -2.817058501e+00 
3.84 -2.860103872e+00 
3.86 -2.895929792e+00 
3.88 -2.924955352e+00 
3.90 -2.947769337e+00 
3.92 -2.965042686e+00 
3.94 -2.977458280e+00 
3.96 -2.985660964e+00 
3.98 -2.990227385e+00 
4.00 -2.991653078e+00 
4.02 -2.991653078e+00 
4.04 -2.991653078e+00 
4.06 -2.991653078e+00 
4.08 -2.991653078e+00 
4.10 -2.991653078e+00 
4.12 -2.991653078e+00 
4.14 -2.991653078e+00 
4.16 -2.991653078e+00 
4.18 -2.991653078e+00 
4.20 -2.991653078e+00 
4.22 -2.991653078e+00 
4.24 -2.991653078e+00 
4.26 -2.991653078e+00 
4.28 -2.991653078e+00 
4.30 -2.991653078e+00 
4.32 -2.991653078e+00 
4.34 -2.991653078e+00 
4.36 -2.991653078e+00 
4.38 -2.991653078e+00 
4.40 -2.991653078e+00 
4.42 -2.991653078e+00 
4.44 -2.991653078e+00 
4.46 -2.991653078e+00 
4.48 -2.991653078e+00 
4.50 -2.991653078e+00 
4.52 -2.991653078e+00 
4.54 -2.991653078e+00 
4.56 -2.991653078e+00 
4.58 -2.991653078e+00 
4.60 -2.991653078e+00 
4.62 -2.991653078e+00 
4.64 -2.991653078e+00 
4.66 -2.991653078e+00 
4.68 -2.991653078e+00 
4.70 -2.991653078e+00 
4.72 -2.991653078e+00 
4.74 -2.991653078e+00 
4.76 -2.991653078e+00 
4.78 -2.991653078e+00 
4.80 -2.991653078e+00 
4.82 -2.991653078e+00 
4.84 -2.991653078e+00 
4.86 -2.991653078e+00 
4.88 -2.991653078e+00 
4.90 -2.991653078e+00 
4.92 -2.991653078e+00 
4.94 -2.991653078e+00 
4.96 -2.991653078e+00 
4.98 -2.991653078e+00 
5.00 -2.991653078e+00 
5.02 -2.991653078e+00 
5.04 -2.991653078e+00 
5.06 -2.991653078e+00 
5.08 -2.991653078e+00 
5.10 -2.991653078e+00 
5.12 -2.991653078e+00 
5.14 -2.991653078e+00 
5.16 -2.991653078e+00 
5.18 -2.991653078e+00 
5.20 -2.991653078e+00 
5.22 -2.991653078e+00 
5.24 -2.991653078e+00 
5.26 -2.991653078e+00 
5.28 -2.991653078e+00 
5.30 -2.991653078e+00 
5.32 -2.991653078e+00 
5.34 -2.991653078e+00 
5.36 -2.991653078e+00 
5.38 -2.991653078e+00 
5.40 -2.991653078e+00 
5.42 -2.991653078e+00 
5.44 -2.991653078e+00 
5.46 -2.991653078e+00 
5.48 -2.991653078e+00 
5.50 -2.991653078e+00 
5.52 -2.991653078e+00 
5.54 -2.991653078e+00 
5.56 -2.991653078e+00 
5.58 -2.991653078e+00 
5.60 -2.991653078e+00 
5.62 -2.991653078e+00 
5.64 -2.991653078e+00 
5.66 -2.991653078e+00 
5.68 -2.991653078e+00 
5.70 -2.991653078e+00 
5.72 -2.991653078e+00 
5.74 -2.991653078e+00 
5.76 -2.991653078e+00 
5.78 -2.991653078e+00 
5.80 -2.991653078e+00 
5.82 -2.991653078e+00 
5.84 -2.991653078e+00 
5.86 -2.991653078e+00 
5.88 -2.991653078e+00 
5.90 -2.991653078e+00 
5.92 -2.991653078e+00 
5.94 -2.991653078e+00 
5.96 -2.991653078e+00 
5.98 -2.991653078e+00 
6.00 -2.991653078e+00