# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2011--Zhou-X-W-Doty-F-P-Yang-P--Li-Na-K-Rb-Cs-F-Cl-Br-I
# implementation = 2011--Zhou-X-W--Li-Na-K-Rb-Cs-F-Cl-Br-I--LAMMPS--ipr1
# composition = F2Li
# 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 2022-05-24

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  1.894259559e+04 
1.02  1.447924959e+04 
1.04  1.112276370e+04 
1.06  8.584956613e+03 
1.08  6.656556529e+03 
1.10  5.183743376e+03 
1.12  4.053632442e+03 
1.14  3.182608354e+03 
1.16  2.508259500e+03 
1.18  1.983970792e+03 
1.20  1.574730768e+03 
1.22  1.254044272e+03 
1.24  1.001662978e+03 
1.26  8.024041798e+02 
1.28  6.445804222e+02 
1.30  5.191563527e+02 
1.32  4.191456820e+02 
1.34  3.391032879e+02 
1.36  2.749039643e+02 
1.38  2.232671097e+02 
1.40  1.816165244e+02 
1.42  1.479295669e+02 
1.44  1.206098716e+02 
1.46  9.839022174e+01 
1.48  8.028885925e+01 
1.50  6.551012602e+01 
1.52  5.341690443e+01 
1.54  4.350258876e+01 
1.56  3.535980931e+01 
1.58  2.866012148e+01 
1.60  2.313005156e+01 
1.62  1.856048581e+01 
1.64  1.479045569e+01 
1.66  1.167750448e+01 
1.68  9.106280509e+00 
1.70  6.983039488e+00 
1.72  5.230010057e+00 
1.74  3.782800687e+00 
1.76  2.588421214e+00 
1.78  1.604955220e+00 
1.80  7.959238355e-01 
1.82  1.288236591e-01 
1.84 -4.201950499e-01 
1.86 -8.692550689e-01 
1.88 -1.234659818e+00 
1.90 -1.530836084e+00 
1.92 -1.769896956e+00 
1.94 -1.961835371e+00 
1.96 -2.114919356e+00 
1.98 -2.236025292e+00 
2.00 -2.330764605e+00 
2.02 -2.403746860e+00 
2.04 -2.458745307e+00 
2.06 -2.498852306e+00 
2.08 -2.526591070e+00 
2.10 -2.544011682e+00 
2.12 -2.552779618e+00 
2.14 -2.555170802e+00 
2.16 -2.551792499e+00 
2.18 -2.543583468e+00 
2.20 -2.530345381e+00 
2.22 -2.512649569e+00 
2.24 -2.491111928e+00 
2.26 -2.466238539e+00 
2.28 -2.438449812e+00 
2.30 -2.408099758e+00 
2.32 -2.375491162e+00 
2.34 -2.341579596e+00 
2.36 -2.306212613e+00 
2.38 -2.269152250e+00 
2.40 -2.230455254e+00 
2.42 -2.190365839e+00 
2.44 -2.149098887e+00 
2.46 -2.106844588e+00 
2.48 -2.063772020e+00 
2.50 -2.020029468e+00 
2.52 -1.975746452e+00 
2.54 -1.931051736e+00 
2.56 -1.886050269e+00 
2.58 -1.840834244e+00 
2.60 -1.795484007e+00 
2.62 -1.750285613e+00 
2.64 -1.705126909e+00 
2.66 -1.659937966e+00 
2.68 -1.614780921e+00 
2.70 -1.569708845e+00 
2.72 -1.524768015e+00 
2.74 -1.479999407e+00 
2.76 -1.435443342e+00 
2.78 -1.391138944e+00 
2.80 -1.347126638e+00 
2.82 -1.303449658e+00 
2.84 -1.260209058e+00 
2.86 -1.217576682e+00 
2.88 -1.175421555e+00 
2.90 -1.133787240e+00 
2.92 -1.092737839e+00 
2.94 -1.052346718e+00 
2.96 -1.012689322e+00 
2.98 -9.738419925e-01 
3.00 -9.358806270e-01 
3.02 -8.990983605e-01 
3.04 -8.633472737e-01 
3.06 -8.286349962e-01 
3.08 -7.950329983e-01 
3.10 -7.626050093e-01 
3.12 -7.314035560e-01 
3.14 -7.014705131e-01 
3.16 -6.728367861e-01 
3.18 -6.455222025e-01 
3.20 -6.195356093e-01 
3.22 -5.948751700e-01 
3.24 -5.715288455e-01 
3.26 -5.494750430e-01 
3.28 -5.286834044e-01 
3.30 -5.091157122e-01 
3.32 -4.907268791e-01 
3.34 -4.734659953e-01 
3.36 -4.572774010e-01 
3.38 -4.421017576e-01 
3.40 -4.278770918e-01 
3.42 -4.145397893e-01 
3.44 -4.020255199e-01 
3.46 -3.902700792e-01 
3.48 -3.792101353e-01 
3.50 -3.687838760e-01 
3.52 -3.589315200e-01 
3.54 -3.495957970e-01 
3.56 -3.407223767e-01 
3.58 -3.322599491e-01 
3.60 -3.241604650e-01 
3.62 -3.163792276e-01 
3.64 -3.088749205e-01 
3.66 -3.016095829e-01 
3.68 -2.945540334e-01 
3.70 -2.880085188e-01 
3.72 -2.816439875e-01 
3.74 -2.753441247e-01 
3.76 -2.690686849e-01 
3.78 -2.628100433e-01 
3.80 -2.565612181e-01 
3.82 -2.503159430e-01 
3.84 -2.440687365e-01 
3.86 -2.378149649e-01 
3.88 -2.315508978e-01 
3.90 -2.252737572e-01 
3.92 -2.189817564e-01 
3.94 -2.126741294e-01 
3.96 -2.063511504e-01 
3.98 -2.000141409e-01 
4.00 -1.936654653e-01 
4.02 -1.873085153e-01 
4.04 -1.809476806e-01 
4.06 -1.745883081e-01 
4.08 -1.682366493e-01 
4.10 -1.618997962e-01 
4.12 -1.555856057e-01 
4.14 -1.493026153e-01 
4.16 -1.430599492e-01 
4.18 -1.368672169e-01 
4.20 -1.307344061e-01 
4.22 -1.246717708e-01 
4.24 -1.186897159e-01 
4.26 -1.127986810e-01 
4.28 -1.070090244e-01 
4.30 -1.013309089e-01 
4.32 -9.577418096e-02 
4.34 -9.034824271e-02 
4.36 -8.506208287e-02 
4.38 -7.992405848e-02 
4.40 -7.494182109e-02 
4.42 -7.012227024e-02 
4.44 -6.547149319e-02 
4.46 -6.099471625e-02 
4.48 -5.669626805e-02 
4.50 -5.258034071e-02 
4.52 -4.871483768e-02 
4.54 -4.502726939e-02 
4.56 -4.151833423e-02 
4.58 -3.818853536e-02 
4.60 -3.503743189e-02 
4.62 -3.206368461e-02 
4.64 -2.926510945e-02 
4.66 -2.663873744e-02 
4.68 -2.418088016e-02 
4.70 -2.188719940e-02 
4.72 -1.975277988e-02 
4.74 -1.777220385e-02 
4.76 -1.593962640e-02 
4.78 -1.424885040e-02 
4.80 -1.269340020e-02 
4.82 -1.126659291e-02 
4.84 -9.961606802e-03 
4.86 -8.771545806e-03 
4.88 -7.689499750e-03 
4.90 -6.708599775e-03 
4.92 -5.822068606e-03 
4.94 -5.023265445e-03 
4.96 -4.305725359e-03 
4.98 -3.663193140e-03 
5.00 -3.089651710e-03 
5.02 -2.579345210e-03 
5.04 -2.126797012e-03 
5.06 -1.726822913e-03 
5.08 -1.374539859e-03 
5.10 -1.065370559e-03 
5.12 -7.950443706e-04 
5.14 -5.595948864e-04 
5.16 -3.553546141e-04 
5.18 -1.789471770e-04 
5.20 -2.727743003e-05 
5.22 -1.586748784e-08 
5.24 -1.064895524e-08 
5.26 -6.924859123e-09 
5.28 -4.330321644e-09 
5.30 -2.576045530e-09 
5.32 -1.434668418e-09 
5.34 -7.292927357e-10 
5.36 -3.238864876e-10 
5.38 -1.152866105e-10 
5.40 -2.656951640e-11 
5.42 -1.583219859e-12 
5.44  0.000000000e+00 
5.46  0.000000000e+00 
5.48  0.000000000e+00 
5.50  0.000000000e+00 
5.52  0.000000000e+00 
5.54  0.000000000e+00 
5.56  0.000000000e+00 
5.58  0.000000000e+00 
5.60  0.000000000e+00 
5.62  0.000000000e+00 
5.64  0.000000000e+00 
5.66  0.000000000e+00 
5.68  0.000000000e+00 
5.70  0.000000000e+00 
5.72  0.000000000e+00 
5.74  0.000000000e+00 
5.76  0.000000000e+00 
5.78  0.000000000e+00 
5.80  0.000000000e+00 
5.82  0.000000000e+00 
5.84  0.000000000e+00 
5.86  0.000000000e+00 
5.88  0.000000000e+00 
5.90  0.000000000e+00 
5.92  0.000000000e+00 
5.94  0.000000000e+00 
5.96  0.000000000e+00 
5.98  0.000000000e+00 
6.00  0.000000000e+00