# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2011--Apostol-F-Mishin-Y--Al-Cu
# implementation = 2011--Apostol-F--Al-Cu--LAMMPS--ipr1
# composition = Al2Cu
# 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  2.432338420e+02 
0.98  2.220624333e+02 
1.00  2.024278364e+02 
1.02  1.842131342e+02 
1.04  1.673871890e+02 
1.06  1.518330884e+02 
1.08  1.375563090e+02 
1.10  1.244674267e+02 
1.12  1.126426106e+02 
1.14  1.020831724e+02 
1.16  9.252901580e+01 
1.18  8.379811742e+01 
1.20  7.576926346e+01 
1.22  6.834498829e+01 
1.24  6.155613134e+01 
1.26  5.548189821e+01 
1.28  5.008960704e+01 
1.30  4.519984238e+01 
1.32  4.069784641e+01 
1.34  3.658985776e+01 
1.36  3.290612530e+01 
1.38  2.962754989e+01 
1.40  2.669236414e+01 
1.42  2.406062851e+01 
1.44  2.172421924e+01 
1.46  1.968834287e+01 
1.48  1.795970850e+01 
1.50  1.648231447e+01 
1.52  1.517064355e+01 
1.54  1.395798937e+01 
1.56  1.279296705e+01 
1.58  1.162934270e+01 
1.60  1.046431413e+01 
1.62  9.334166080e+00 
1.64  8.278788614e+00 
1.66  7.308566872e+00 
1.68  6.408088233e+00 
1.70  5.564523164e+00 
1.72  4.775615034e+00 
1.74  4.038079421e+00 
1.76  3.341858420e+00 
1.78  2.676546734e+00 
1.80  2.037232823e+00 
1.82  1.429702647e+00 
1.84  8.681219420e-01 
1.86  3.654672915e-01 
1.88 -7.561596970e-02 
1.90 -4.664219728e-01 
1.92 -8.191430458e-01 
1.94 -1.138115258e+00 
1.96 -1.421627529e+00 
1.98 -1.669480145e+00 
2.00 -1.883066032e+00 
2.02 -2.065873323e+00 
2.04 -2.222628005e+00 
2.06 -2.357531243e+00 
2.08 -2.474482732e+00 
2.10 -2.577762685e+00 
2.12 -2.673815616e+00 
2.14 -2.768625968e+00 
2.16 -2.865382742e+00 
2.18 -2.963644262e+00 
2.20 -3.059343289e+00 
2.22 -3.146563285e+00 
2.24 -3.222830108e+00 
2.26 -3.290673620e+00 
2.28 -3.353314687e+00 
2.30 -3.411496013e+00 
2.32 -3.463972366e+00 
2.34 -3.509199774e+00 
2.36 -3.547279135e+00 
2.38 -3.578192303e+00 
2.40 -3.601273813e+00 
2.42 -3.615869651e+00 
2.44 -3.622232028e+00 
2.46 -3.620698558e+00 
2.48 -3.611681607e+00 
2.50 -3.595653955e+00 
2.52 -3.573043486e+00 
2.54 -3.544254026e+00 
2.56 -3.509705885e+00 
2.58 -3.469881666e+00 
2.60 -3.425358967e+00 
2.62 -3.376560078e+00 
2.64 -3.323524538e+00 
2.66 -3.266776975e+00 
2.68 -3.206889241e+00 
2.70 -3.144433663e+00 
2.72 -3.079971064e+00 
2.74 -3.014022465e+00 
2.76 -2.947007975e+00 
2.78 -2.879087599e+00 
2.80 -2.809890326e+00 
2.82 -2.738646355e+00 
2.84 -2.665279658e+00 
2.86 -2.589097297e+00 
2.88 -2.508916858e+00 
2.90 -2.423463880e+00 
2.92 -2.332333366e+00 
2.94 -2.237528865e+00 
2.96 -2.142837772e+00 
2.98 -2.052502263e+00 
3.00 -1.970038255e+00 
3.02 -1.897304699e+00 
3.04 -1.833565313e+00 
3.06 -1.777187403e+00 
3.08 -1.727052157e+00 
3.10 -1.682433955e+00 
3.12 -1.642644198e+00 
3.14 -1.607021069e+00 
3.16 -1.574925915e+00 
3.18 -1.545750189e+00 
3.20 -1.518897673e+00 
3.22 -1.493822961e+00 
3.24 -1.470303248e+00 
3.26 -1.448199869e+00 
3.28 -1.427384107e+00 
3.30 -1.407733040e+00 
3.32 -1.389124347e+00 
3.34 -1.371431643e+00 
3.36 -1.354520985e+00 
3.38 -1.338248511e+00 
3.40 -1.322459877e+00 
3.42 -1.306993216e+00 
3.44 -1.291681927e+00 
3.46 -1.276357690e+00 
3.48 -1.260858690e+00 
3.50 -1.245059693e+00 
3.52 -1.228885362e+00 
3.54 -1.212365450e+00 
3.56 -1.195571076e+00 
3.58 -1.178592916e+00 
3.60 -1.161534513e+00 
3.62 -1.144498268e+00 
3.64 -1.127566804e+00 
3.66 -1.110785634e+00 
3.68 -1.094153654e+00 
3.70 -1.077626068e+00 
3.72 -1.061146860e+00 
3.74 -1.044663974e+00 
3.76 -1.028125679e+00 
3.78 -1.011489814e+00 
3.80 -9.947283944e-01 
3.82 -9.778277608e-01 
3.84 -9.607855948e-01 
3.86 -9.436065239e-01 
3.88 -9.263045579e-01 
3.90 -9.088997215e-01 
3.92 -8.914097543e-01 
3.94 -8.738493617e-01 
3.96 -8.562299735e-01 
3.98 -8.385595230e-01 
4.00 -8.208423177e-01 
4.02 -8.030834488e-01 
4.04 -7.853028658e-01 
4.06 -7.675211879e-01 
4.08 -7.497606714e-01 
4.10 -7.320493246e-01 
4.12 -7.144122521e-01 
4.14 -6.968709018e-01 
4.16 -6.794431483e-01 
4.18 -6.621433543e-01 
4.20 -6.449825597e-01 
4.22 -6.279686863e-01 
4.24 -6.111066712e-01 
4.26 -5.943985656e-01 
4.28 -5.778481169e-01 
4.30 -5.614742430e-01 
4.32 -5.452990395e-01 
4.34 -5.293440314e-01 
4.36 -5.136380321e-01 
4.38 -4.982174407e-01 
4.40 -4.831183496e-01 
4.42 -4.683762025e-01 
4.44 -4.540258087e-01 
4.46 -4.401013470e-01 
4.48 -4.266363889e-01 
4.50 -4.136639208e-01 
4.52 -4.012070184e-01 
4.54 -3.892471164e-01 
4.56 -3.777533750e-01 
4.58 -3.666944528e-01 
4.60 -3.560385427e-01 
4.62 -3.457534012e-01 
4.64 -3.358063830e-01 
4.66 -3.261644846e-01 
4.68 -3.167943886e-01 
4.70 -3.076625239e-01 
4.72 -2.987351383e-01 
4.74 -2.899783910e-01 
4.76 -2.813584768e-01 
4.78 -2.728417790e-01 
4.80 -2.643950696e-01 
4.82 -2.559857634e-01 
4.84 -2.475822394e-01 
4.86 -2.391542389e-01 
4.88 -2.306733509e-01 
4.90 -2.221135820e-01 
4.92 -2.134520032e-01 
4.94 -2.046694364e-01 
4.96 -1.957511217e-01 
4.98 -1.866872815e-01 
5.00 -1.774733871e-01 
5.02 -1.681235340e-01 
5.04 -1.587101922e-01 
5.06 -1.493224098e-01 
5.08 -1.400468856e-01 
5.10 -1.309738916e-01 
5.12 -1.221909450e-01 
5.14 -1.137768831e-01 
5.16 -1.058001113e-01 
5.18 -9.831801095e-02 
5.20 -9.137747366e-02 
5.22 -8.501624977e-02 
5.24 -7.926460487e-02 
5.26 -7.414671503e-02 
5.28 -6.968128802e-02 
5.30 -6.588105024e-02 
5.32 -6.275093463e-02 
5.34 -6.028502090e-02 
5.36 -5.846250947e-02 
5.38 -5.724326145e-02 
5.40 -5.656372350e-02 
5.42 -5.633434830e-02 
5.44 -5.643983593e-02 
5.46 -5.674372701e-02 
5.48 -5.709951103e-02 
5.50 -5.736466744e-02 
5.52 -5.740139699e-02 
5.54 -5.704465741e-02 
5.56 -5.616928418e-02 
5.58 -5.471593122e-02 
5.60 -5.269060665e-02 
5.62 -5.015503618e-02 
5.64 -4.721035802e-02 
5.66 -4.397801524e-02 
5.68 -4.058172168e-02 
5.70 -3.713329789e-02 
5.72 -3.372364622e-02 
5.74 -3.041876293e-02 
5.76 -2.725982676e-02 
5.78 -2.426604241e-02 
5.80 -2.143891574e-02 
5.82 -1.876725223e-02 
5.84 -1.623272634e-02 
5.86 -1.383592790e-02 
5.88 -1.159951050e-02 
5.90 -9.550539097e-03 
5.92 -7.711839997e-03 
5.94 -6.097712131e-03 
5.96 -4.713257869e-03 
5.98 -3.554564153e-03 
6.00 -2.609671317e-03