# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 1986--Foiles-S-M-Baskes-M-I-Daw-M-S--Ag-Au-Cu-Ni-Pd-Pt
# implementation = 1986--Foiles-S-M--Ag-Au-Cu-Ni-Pd-Pt--LAMMPS--ipr1
# composition = AgPt2
# 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  1.167539712e+03 
0.90  1.064959455e+03 
0.92  9.721364341e+02 
0.94  8.880334519e+02 
0.96  8.117476803e+02 
0.98  7.424827519e+02 
1.00  6.795384597e+02 
1.02  6.222907497e+02 
1.04  5.701866139e+02 
1.06  5.227335791e+02 
1.08  4.794871595e+02 
1.10  4.400535511e+02 
1.12  4.040761584e+02 
1.14  3.712324804e+02 
1.16  3.412334105e+02 
1.18  3.138175341e+02 
1.20  2.887472899e+02 
1.22  2.658070252e+02 
1.24  2.448052159e+02 
1.26  2.255653620e+02 
1.28  2.079277868e+02 
1.30  1.917459566e+02 
1.32  1.768899688e+02 
1.34  1.632414484e+02 
1.36  1.506923452e+02 
1.38  1.391446535e+02 
1.40  1.285095575e+02 
1.42  1.187055288e+02 
1.44  1.096604491e+02 
1.46  1.013081522e+02 
1.48  9.358850200e+01 
1.50  8.644691593e+01 
1.52  7.983402608e+01 
1.54  7.370493882e+01 
1.56  6.801853313e+01 
1.58  6.273776203e+01 
1.60  5.783015890e+01 
1.62  5.326536052e+01 
1.64  4.901587342e+01 
1.66  4.505651318e+01 
1.68  4.136448903e+01 
1.70  3.791908365e+01 
1.72  3.470134760e+01 
1.74  3.169420805e+01 
1.76  2.888686068e+01 
1.78  2.626656082e+01 
1.80  2.382932447e+01 
1.82  2.156289819e+01 
1.84  1.943423164e+01 
1.86  1.747328100e+01 
1.88  1.564828488e+01 
1.90  1.395015378e+01 
1.92  1.237060748e+01 
1.94  1.090205971e+01 
1.96  9.537516388e+00 
1.98  8.270356741e+00 
2.00  7.094756604e+00 
2.02  6.005170116e+00 
2.04  4.996419107e+00 
2.06  4.063536577e+00 
2.08  3.201836348e+00 
2.10  2.407291645e+00 
2.12  1.675564043e+00 
2.14  1.003175737e+00 
2.16  3.868486503e-01 
2.18 -1.763514638e-01 
2.20 -6.900593772e-01 
2.22 -1.157384881e+00 
2.24 -1.581164723e+00 
2.26 -1.964103594e+00 
2.28 -2.308692251e+00 
2.30 -2.617625262e+00 
2.32 -2.893400406e+00 
2.34 -3.138070395e+00 
2.36 -3.353772574e+00 
2.38 -3.542537322e+00 
2.40 -3.706293442e+00 
2.42 -3.846821362e+00 
2.44 -3.965301059e+00 
2.46 -4.063990176e+00 
2.48 -4.144441353e+00 
2.50 -4.208125977e+00 
2.52 -4.256430029e+00 
2.54 -4.290657462e+00 
2.56 -4.311985208e+00 
2.58 -4.321600937e+00 
2.60 -4.320587449e+00 
2.62 -4.309945928e+00 
2.64 -4.290610355e+00 
2.66 -4.263763677e+00 
2.68 -4.230187203e+00 
2.70 -4.190315525e+00 
2.72 -4.144839894e+00 
2.74 -4.094401879e+00 
2.76 -4.039584766e+00 
2.78 -3.981199002e+00 
2.80 -3.917690988e+00 
2.82 -3.851244607e+00 
2.84 -3.782464525e+00 
2.86 -3.711731733e+00 
2.88 -3.639397298e+00 
2.90 -3.565806521e+00 
2.92 -3.491500029e+00 
2.94 -3.416441445e+00 
2.96 -3.340872978e+00 
2.98 -3.265013927e+00 
3.00 -3.189062337e+00 
3.02 -3.113199622e+00 
3.04 -3.037565196e+00 
3.06 -2.962226590e+00 
3.08 -2.887412322e+00 
3.10 -2.813238838e+00 
3.12 -2.739807727e+00 
3.14 -2.667209011e+00 
3.16 -2.595521907e+00 
3.18 -2.524815517e+00 
3.20 -2.455149938e+00 
3.22 -2.386577551e+00 
3.24 -2.319123252e+00 
3.26 -2.253819318e+00 
3.28 -2.189993346e+00 
3.30 -2.127325456e+00 
3.32 -2.065858577e+00 
3.34 -2.005594318e+00 
3.36 -1.946517787e+00 
3.38 -1.888629835e+00 
3.40 -1.831834007e+00 
3.42 -1.776113512e+00 
3.44 -1.721458194e+00 
3.46 -1.668029883e+00 
3.48 -1.615918876e+00 
3.50 -1.565092573e+00 
3.52 -1.515521160e+00 
3.54 -1.467184532e+00 
3.56 -1.420064134e+00 
3.58 -1.374149068e+00 
3.60 -1.329433546e+00 
3.62 -1.285902061e+00 
3.64 -1.243510947e+00 
3.66 -1.202252279e+00 
3.68 -1.162118545e+00 
3.70 -1.123103520e+00 
3.72 -1.085175058e+00 
3.74 -1.048185474e+00 
3.76 -1.012175474e+00 
3.78 -9.772011884e-01 
3.80 -9.433038332e-01 
3.82 -9.105106197e-01 
3.84 -8.788270164e-01 
3.86 -8.482858427e-01 
3.88 -8.189708456e-01 
3.90 -7.906615997e-01 
3.92 -7.631681065e-01 
3.94 -7.363506939e-01 
3.96 -7.099885291e-01 
3.98 -6.840236761e-01 
4.00 -6.584955599e-01 
4.02 -6.334452520e-01 
4.04 -6.089132559e-01 
4.06 -5.849378988e-01 
4.08 -5.615504357e-01 
4.10 -5.387353432e-01 
4.12 -5.166639526e-01 
4.14 -4.952717793e-01 
4.16 -4.744715631e-01 
4.18 -4.541970505e-01 
4.20 -4.343992319e-01 
4.22 -4.150430993e-01 
4.24 -3.961048701e-01 
4.26 -3.775696231e-01 
4.28 -3.594292985e-01 
4.30 -3.416810183e-01 
4.32 -3.243256849e-01 
4.34 -3.073667760e-01 
4.36 -2.907695125e-01 
4.38 -2.745613421e-01 
4.40 -2.588149131e-01 
4.42 -2.435838950e-01 
4.44 -2.289062607e-01 
4.46 -2.148070691e-01 
4.48 -2.013008204e-01 
4.50 -1.883934429e-01 
4.52 -1.760839660e-01 
4.54 -1.643659252e-01 
4.56 -1.532282814e-01 
4.58 -1.426354698e-01 
4.60 -1.331802754e-01 
4.62 -1.247769612e-01 
4.64 -1.167916858e-01 
4.66 -1.092297789e-01 
4.68 -1.020747986e-01 
4.70 -9.530979285e-02 
4.72 -8.891763374e-02 
4.74 -8.288121587e-02 
4.76 -7.718361448e-02 
4.78 -7.180820892e-02 
4.80 -6.673877913e-02 
4.82 -6.195957665e-02 
4.84 -5.745537825e-02 
4.86 -5.321152263e-02 
4.88 -4.921393376e-02 
4.90 -4.544913406e-02 
4.92 -4.190424896e-02 
4.94 -3.856700487e-02 
4.96 -3.542572116e-02 
4.98 -3.246929813e-02 
5.00 -2.968720170e-02 
5.02 -2.706944640e-02 
5.04 -2.460657626e-02 
5.06 -2.228964378e-02 
5.08 -2.011018901e-02 
5.10 -1.806021819e-02 
5.12 -1.613218245e-02 
5.14 -1.431895640e-02 
5.16 -1.261381707e-02 
5.18 -1.101042348e-02 
5.20 -9.502796862e-03 
5.22 -8.085301624e-03 
5.24 -6.752626587e-03 
5.26 -5.499747624e-03 
5.28 -4.323237571e-03 
5.30 -3.246590900e-03 
5.32 -2.856846788e-03 
5.34 -2.511372661e-03 
5.36 -2.192141448e-03 
5.38 -1.892852540e-03 
5.40 -1.612289907e-03 
5.42 -1.349309763e-03 
5.44 -1.102836373e-03 
5.46 -8.718581082e-04 
5.48 -6.554237436e-04 
5.50 -4.526389669e-04 
5.52 -2.626630340e-04 
5.54 -8.356715882e-05 
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