# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2023--Daw-M-S-Chandross-M--Cu-Ag-Au-Ni-Pd-Pt
# implementation = 2023--Daw-M-S--Cu-Ag-Au-Ni-Pd-Pt--LAMMPS--ipr1
# composition = Ag2Au
# 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 2026-08-31

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  5.552423000e+06 
0.80  5.009443744e+06 
0.82  4.518648038e+06 
0.84  4.073998576e+06 
0.86  3.670212593e+06 
0.88  3.302690694e+06 
0.90  2.967561203e+06 
0.92  2.661380921e+06 
0.94  2.381116073e+06 
0.96  2.124162854e+06 
0.98  1.888123344e+06 
1.00  1.670918417e+06 
1.02  1.470733706e+06 
1.04  1.286000795e+06 
1.06  1.115299853e+06 
1.08  9.573630963e+05 
1.10  8.110029309e+05 
1.12  6.752076442e+05 
1.14  5.491672992e+05 
1.16  4.352951047e+05 
1.18  3.410391800e+05 
1.20  2.678236336e+05 
1.22  2.107853829e+05 
1.24  1.662431708e+05 
1.26  1.313800549e+05 
1.28  1.040319151e+05 
1.30  8.252504896e+04 
1.32  6.557455522e+04 
1.34  5.218447669e+04 
1.36  4.158908727e+04 
1.38  3.318907126e+04 
1.40  2.651705754e+04 
1.42  2.121026826e+04 
1.44  1.698353224e+04 
1.46  1.361292861e+04 
1.48  1.092188761e+04 
1.50  8.770342274e+03 
1.52  7.047963637e+03 
1.54  5.667893416e+03 
1.56  4.560997096e+03 
1.58  3.672223324e+03 
1.60  2.958115419e+03 
1.62  2.383998416e+03 
1.64  1.922118498e+03 
1.66  1.550141427e+03 
1.68  1.250292564e+03 
1.70  1.008514468e+03 
1.72  8.135277826e+02 
1.74  6.562436081e+02 
1.76  5.293302756e+02 
1.78  4.269197709e+02 
1.80  3.442821629e+02 
1.82  2.776015344e+02 
1.84  2.237985618e+02 
1.86  1.803878203e+02 
1.88  1.453627499e+02 
1.90  1.170939196e+02 
1.92  9.427390097e+01 
1.94  7.585339389e+01 
1.96  6.098401095e+01 
1.98  4.897996343e+01 
2.00  3.928660220e+01 
2.02  3.145174602e+01 
2.04  2.511563095e+01 
2.06  1.998905064e+01 
2.08  1.583814138e+01 
2.10  1.247392339e+01 
2.12  9.743801641e+00 
2.14  7.524659883e+00 
2.16  5.717250621e+00 
2.18  4.241639066e+00 
2.20  3.033292427e+00 
2.22  2.040322625e+00 
2.24  1.221575512e+00 
2.26  5.438593956e-01 
2.28 -1.937169774e-02 
2.30 -4.893569940e-01 
2.32 -8.831695892e-01 
2.34 -1.214522505e+00 
2.36 -1.494423434e+00 
2.38 -1.731705953e+00 
2.40 -1.933459863e+00 
2.42 -2.105379252e+00 
2.44 -2.252043453e+00 
2.46 -2.377125284e+00 
2.48 -2.483581458e+00 
2.50 -2.573831168e+00 
2.52 -2.649852631e+00 
2.54 -2.713275078e+00 
2.56 -2.765452207e+00 
2.58 -2.807520520e+00 
2.60 -2.840445470e+00 
2.62 -2.865057824e+00 
2.64 -2.882082182e+00 
2.66 -2.892159233e+00 
2.68 -2.895863021e+00 
2.70 -2.893714272e+00 
2.72 -2.886190600e+00 
2.74 -2.873734269e+00 
2.76 -2.856758051e+00 
2.78 -2.835649611e+00 
2.80 -2.810774755e+00 
2.82 -2.782479823e+00 
2.84 -2.751061295e+00 
2.86 -2.716798311e+00 
2.88 -2.679986176e+00 
2.90 -2.640905369e+00 
2.92 -2.599822088e+00 
2.94 -2.556988674e+00 
2.96 -2.512568954e+00 
2.98 -2.466663887e+00 
3.00 -2.419478875e+00 
3.02 -2.371211301e+00 
3.04 -2.322046988e+00 
3.06 -2.272160496e+00 
3.08 -2.221715429e+00 
3.10 -2.170864754e+00 
3.12 -2.119751128e+00 
3.14 -2.068507239e+00 
3.16 -2.017256157e+00 
3.18 -1.966111695e+00 
3.20 -1.915178777e+00 
3.22 -1.864553815e+00 
3.24 -1.814325080e+00 
3.26 -1.764573088e+00 
3.28 -1.715370972e+00 
3.30 -1.666784864e+00 
3.32 -1.618874262e+00 
3.34 -1.571692399e+00 
3.36 -1.525286599e+00 
3.38 -1.479698631e+00 
3.40 -1.434965046e+00 
3.42 -1.391117512e+00 
3.44 -1.348183128e+00 
3.46 -1.306167730e+00 
3.48 -1.264961791e+00 
3.50 -1.224551013e+00 
3.52 -1.184951162e+00 
3.54 -1.146175038e+00 
3.56 -1.108232685e+00 
3.58 -1.071131604e+00 
3.60 -1.034876943e+00 
3.62 -9.994716851e-01 
3.64 -9.649168259e-01 
3.66 -9.312115365e-01 
3.68 -8.983533218e-01 
3.70 -8.663381674e-01 
3.72 -8.351606787e-01 
3.74 -8.048142110e-01 
3.76 -7.752909918e-01 
3.78 -7.465822351e-01 
3.80 -7.186782485e-01 
3.82 -6.915685334e-01 
3.84 -6.652418776e-01 
3.86 -6.396864426e-01 
3.88 -6.148898439e-01 
3.90 -5.908392260e-01 
3.92 -5.675213319e-01 
3.94 -5.449225668e-01 
3.96 -5.230290579e-01 
3.98 -5.018267090e-01 
4.00 -4.813012505e-01 
4.02 -4.614382858e-01 
4.04 -4.422233340e-01 
4.06 -4.236418680e-01 
4.08 -4.056793506e-01 
4.10 -3.883212662e-01 
4.12 -3.715531505e-01 
4.14 -3.553606165e-01 
4.16 -3.397293789e-01 
4.18 -3.246452754e-01 
4.20 -3.100942861e-01 
4.22 -2.960625504e-01 
4.24 -2.825363826e-01 
4.26 -2.695022852e-01 
4.28 -2.569469610e-01 
4.30 -2.448573228e-01 
4.32 -2.332205030e-01 
4.34 -2.220238607e-01 
4.36 -2.112549879e-01 
4.38 -2.009017154e-01 
4.40 -1.909521163e-01 
4.42 -1.813945098e-01 
4.44 -1.722174634e-01 
4.46 -1.634097947e-01 
4.48 -1.549605722e-01 
4.50 -1.468591158e-01 
4.52 -1.390949961e-01 
4.54 -1.316580342e-01 
4.56 -1.245383000e-01 
4.58 -1.177261104e-01 
4.60 -1.112120276e-01 
4.62 -1.049868562e-01 
4.64 -9.904164059e-02 
4.66 -9.336766202e-02 
4.68 -8.795643521e-02 
4.70 -8.279970485e-02 
4.72 -7.788944197e-02 
4.74 -7.321784013e-02 
4.76 -6.877731138e-02 
4.78 -6.456048330e-02 
4.80 -6.056019278e-02 
4.82 -5.676948191e-02 
4.84 -5.318159484e-02 
4.86 -4.978997335e-02 
4.88 -4.658825249e-02 
4.90 -4.355822578e-02 
4.92 -4.066816073e-02 
4.94 -3.791266519e-02 
4.96 -3.528743262e-02 
4.98 -3.278806616e-02 
5.00 -3.041048996e-02 
5.02 -2.815088402e-02 
5.04 -2.600552239e-02 
5.06 -2.397077481e-02 
5.08 -2.204310715e-02 
5.10 -2.021908136e-02 
5.12 -1.849535504e-02 
5.14 -1.686868075e-02 
5.16 -1.533585170e-02 
5.18 -1.389362522e-02 
5.20 -1.253911991e-02 
5.22 -1.126954681e-02 
5.24 -1.008217935e-02 
5.26 -8.974356293e-03 
5.28 -7.943483992e-03 
5.30 -6.987037889e-03 
5.32 -6.102563472e-03 
5.34 -5.287676718e-03 
5.36 -4.540064106e-03 
5.38 -3.857482277e-03 
5.40 -3.237757378e-03 
5.42 -2.678784167e-03 
5.44 -2.178524890e-03 
5.46 -1.735008004e-03 
5.48 -1.346326752e-03 
5.50 -1.010637630e-03 
5.52 -7.261587745e-04 
5.54 -4.911682862e-04 
5.56 -3.040025095e-04 
5.58 -1.630542876e-04 
5.60 -6.677120460e-05 
5.62 -1.365382504e-05 
5.64  2.932126768e-11 
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