# 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 = IdLi2
# 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  nan             
1.02  nan             
1.04  nan             
1.06  nan             
1.08  nan             
1.10  nan             
1.12  nan             
1.14  nan             
1.16  nan             
1.18  3.303108727e+07 
1.20  2.465926190e+07 
1.22  1.849744210e+07 
1.24  1.393952527e+07 
1.26  1.055170044e+07 
1.28  8.021794732e+06 
1.30  6.123989794e+06 
1.32  4.694107271e+06 
1.34  3.612196818e+06 
1.36  2.790205258e+06 
1.38  2.163195866e+06 
1.40  1.683065759e+06 
1.42  1.314027181e+06 
1.44  1.029342210e+06 
1.46  8.089528973e+05 
1.48  6.377523826e+05 
1.50  5.043187025e+05 
1.52  3.999837315e+05 
1.54  3.181450829e+05 
1.56  2.537559181e+05 
1.58  2.029451769e+05 
1.60  1.627337328e+05 
1.62  1.308212355e+05 
1.64  1.054258291e+05 
1.66  8.516299749e+04 
1.68  6.895376782e+04 
1.70  5.595471335e+04 
1.72  4.550467802e+04 
1.74  3.708391874e+04 
1.76  3.028275496e+04 
1.78  2.477740420e+04 
1.80  2.031129264e+04 
1.82  1.668059523e+04 
1.84  1.372299082e+04 
1.86  1.130887615e+04 
1.88  9.334586646e+03 
1.90  7.716972353e+03 
1.92  6.389189563e+03 
1.94  5.297390331e+03 
1.96  4.398104065e+03 
1.98  3.656164472e+03 
2.00  3.043055642e+03 
2.02  2.535634997e+03 
2.04  2.115063069e+03 
2.06  1.765977445e+03 
2.08  1.475829452e+03 
2.10  1.234350673e+03 
2.12  1.033124003e+03 
2.14  8.652368018e+02 
2.16  7.250045579e+02 
2.18  6.077422861e+02 
2.20  5.095896302e+02 
2.22  4.273529697e+02 
2.24  3.583892714e+02 
2.26  3.005074033e+02 
2.28  2.518894523e+02 
2.30  2.110242719e+02 
2.32  1.766542235e+02 
2.34  1.477313403e+02 
2.36  1.233805830e+02 
2.38  1.028724053e+02 
2.40  8.559496915e+01 
2.42  7.103588426e+01 
2.44  5.876920135e+01 
2.46  4.843508722e+01 
2.48  3.973130013e+01 
2.50  3.240374643e+01 
2.52  2.623850430e+01 
2.54  2.105528193e+01 
2.56  1.670206934e+01 
2.58  1.305092980e+01 
2.60  9.993294030e+00 
2.62  7.437785486e+00 
2.64  5.307094702e+00 
2.66  3.535878766e+00 
2.68  2.068610035e+00 
2.70  8.582443631e-01 
2.72 -1.350932162e-01 
2.74 -9.459883214e-01 
2.76 -1.602514023e+00 
2.78 -2.128644505e+00 
2.80 -2.545055943e+00 
2.82 -2.869293939e+00 
2.84 -3.116247027e+00 
2.86 -3.298547386e+00 
2.88 -3.426879316e+00 
2.90 -3.510364719e+00 
2.92 -3.556705984e+00 
2.94 -3.572424535e+00 
2.96 -3.563039826e+00 
2.98 -3.533218766e+00 
3.00 -3.486902726e+00 
3.02 -3.427415530e+00 
3.04 -3.357725048e+00 
3.06 -3.280015489e+00 
3.08 -3.196209295e+00 
3.10 -3.107960980e+00 
3.12 -3.016646226e+00 
3.14 -2.923404487e+00 
3.16 -2.829174247e+00 
3.18 -2.734770433e+00 
3.20 -2.640812647e+00 
3.22 -2.547728533e+00 
3.24 -2.455920240e+00 
3.26 -2.365850131e+00 
3.28 -2.277698882e+00 
3.30 -2.191508646e+00 
3.32 -2.107407943e+00 
3.34 -2.025502200e+00 
3.36 -1.945837542e+00 
3.38 -1.868409192e+00 
3.40 -1.793216141e+00 
3.42 -1.720239415e+00 
3.44 -1.649446463e+00 
3.46 -1.580794906e+00 
3.48 -1.514235711e+00 
3.50 -1.449715867e+00 
3.52 -1.387179198e+00 
3.54 -1.326572016e+00 
3.56 -1.267841424e+00 
3.58 -1.210936940e+00 
3.60 -1.155811093e+00 
3.62 -1.102420270e+00 
3.64 -1.050724989e+00 
3.66 -1.000689963e+00 
3.68 -9.522839735e-01 
3.70 -9.054795923e-01 
3.72 -8.604676873e-01 
3.74 -8.170225181e-01 
3.76 -7.750694053e-01 
3.78 -7.345983986e-01 
3.80 -6.955996428e-01 
3.82 -6.580628538e-01 
3.84 -6.219768153e-01 
3.86 -5.873289136e-01 
3.88 -5.541047269e-01 
3.90 -5.222876807e-01 
3.92 -4.918587770e-01 
3.94 -4.627964054e-01 
3.96 -4.350762362e-01 
3.98 -4.086711956e-01 
4.00 -3.835515194e-01 
4.02 -3.596848787e-01 
4.04 -3.370365700e-01 
4.06 -3.155697594e-01 
4.08 -2.952457697e-01 
4.10 -2.760244004e-01 
4.12 -2.578642673e-01 
4.14 -2.407231513e-01 
4.16 -2.245583463e-01 
4.18 -2.093269960e-01 
4.20 -1.949864120e-01 
4.22 -1.814943658e-01 
4.24 -1.688093511e-01 
4.26 -1.568908110e-01 
4.28 -1.457171224e-01 
4.30 -1.352473323e-01 
4.32 -1.254249388e-01 
4.34 -1.162150617e-01 
4.36 -1.075846386e-01 
4.38 -9.950207043e-02 
4.40 -9.193721138e-02 
4.42 -8.486142192e-02 
4.44 -7.824752999e-02 
4.46 -7.206977843e-02 
4.48 -6.630376240e-02 
4.50 -6.104196613e-02 
4.52 -5.616267456e-02 
4.54 -5.160029142e-02 
4.56 -4.734015607e-02 
4.58 -4.336785559e-02 
4.60 -3.966924433e-02 
4.62 -3.623046358e-02 
4.64 -3.303796130e-02 
4.66 -3.007851124e-02 
4.68 -2.733923136e-02 
4.70 -2.480760111e-02 
4.72 -2.247147737e-02 
4.74 -2.031910882e-02 
4.76 -1.833914866e-02 
4.78 -1.652066529e-02 
4.80 -1.485315115e-02 
4.82 -1.332652949e-02 
4.84 -1.193115904e-02 
4.86 -1.065783659e-02 
4.88 -9.497797619e-03 
4.90 -8.442714831e-03 
4.92 -7.484694866e-03 
4.94 -6.616273164e-03 
4.96 -5.830282981e-03 
4.98 -5.119690861e-03 
5.00 -4.478884503e-03 
5.02 -3.902023898e-03 
5.04 -3.383650219e-03 
5.06 -2.918672666e-03 
5.08 -2.502354504e-03 
5.10 -2.130298457e-03 
5.12 -1.798431610e-03 
5.14 -1.502989948e-03 
5.16 -1.240502688e-03 
5.18 -1.007776515e-03 
5.20 -8.018798505e-04 
5.22 -6.201272509e-04 
5.24 -4.680206649e-04 
5.26 -4.357362827e-04 
5.28 -4.052736850e-04 
5.30 -3.766014456e-04 
5.32 -3.496381091e-04 
5.34 -3.243043625e-04 
5.36 -3.005230776e-04 
5.38 -2.782193462e-04 
5.40 -2.573205074e-04 
5.42 -2.377561685e-04 
5.44 -2.194582199e-04 
5.46 -2.023608420e-04 
5.48 -1.864005072e-04 
5.50 -1.715159757e-04 
5.52 -1.576482851e-04 
5.54 -1.447407357e-04 
5.56 -1.327388693e-04 
5.58 -1.215904449e-04 
5.60 -1.112454089e-04 
5.62 -1.016558615e-04 
5.64 -9.277601942e-05 
5.66 -8.456217526e-05 
5.68 -7.697265362e-05 
5.70 -6.996776445e-05 
5.72 -6.350975394e-05 
5.74 -5.756275333e-05 
5.76 -5.209272572e-05 
5.78 -4.706741145e-05 
5.80 -4.245627208e-05 
5.82 -3.823043345e-05 
5.84 -3.436262791e-05 
5.86 -3.082713609e-05 
5.88 -2.759972841e-05 
5.90 -2.465760648e-05 
5.92 -2.197934474e-05 
5.94 -1.954483234e-05 
5.96 -1.733521570e-05 
5.98 -1.533284165e-05 
6.00 -1.352120143e-05