# 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 = Cu2Ni
# 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  2.986153702e+06 
0.80  2.667744168e+06 
0.82  2.380200425e+06 
0.84  2.119930004e+06 
0.86  1.883790921e+06 
0.88  1.669054075e+06 
0.90  1.473382112e+06 
0.92  1.294784713e+06 
0.94  1.131498537e+06 
0.96  9.819456600e+05 
0.98  8.447136753e+05 
1.00  7.186032523e+05 
1.02  6.025208520e+05 
1.04  4.955155351e+05 
1.06  3.967512994e+05 
1.08  3.082092321e+05 
1.10  2.356076341e+05 
1.12  1.805053906e+05 
1.14  1.386231789e+05 
1.16  1.066914621e+05 
1.18  8.227771693e+04 
1.20  6.356679391e+04 
1.22  4.919242189e+04 
1.24  3.812408335e+04 
1.26  2.958670184e+04 
1.28  2.299069399e+04 
1.30  1.788680260e+04 
1.32  1.393089145e+04 
1.34  1.085958596e+04 
1.36  8.471983275e+03 
1.38  6.613767388e+03 
1.40  5.165847423e+03 
1.42  4.036798184e+03 
1.44  3.155659349e+03 
1.46  2.467212388e+03 
1.48  1.928770442e+03 
1.50  1.507459234e+03 
1.52  1.177772000e+03 
1.54  9.197827685e+02 
1.56  7.178935252e+02 
1.58  5.599520569e+02 
1.60  4.364382761e+02 
1.62  3.398899445e+02 
1.64  2.644431228e+02 
1.66  2.055149692e+02 
1.68  1.595054174e+02 
1.70  1.235986256e+02 
1.72  9.559969840e+01 
1.74  7.378075602e+01 
1.76  5.679118426e+01 
1.78  4.356841441e+01 
1.80  3.328184493e+01 
1.82  2.528615013e+01 
1.84  1.907505576e+01 
1.86  1.425190916e+01 
1.88  1.050641186e+01 
1.90  7.596225143e+00 
1.92  5.332434167e+00 
1.94  3.567854263e+00 
1.96  2.188024724e+00 
1.98  1.105419982e+00 
2.00  2.521828441e-01 
2.02 -4.239469859e-01 
2.04 -9.631765966e-01 
2.06 -1.396461086e+00 
2.08 -1.747545268e+00 
2.10 -2.034574235e+00 
2.12 -2.271348238e+00 
2.14 -2.468326754e+00 
2.16 -2.633425291e+00 
2.18 -2.772562112e+00 
2.20 -2.890204003e+00 
2.22 -2.989735714e+00 
2.24 -3.073713033e+00 
2.26 -3.144077076e+00 
2.28 -3.202317909e+00 
2.30 -3.249598588e+00 
2.32 -3.286848345e+00 
2.34 -3.314831903e+00 
2.36 -3.334200366e+00 
2.38 -3.345528001e+00 
2.40 -3.349338309e+00 
2.42 -3.346122006e+00 
2.44 -3.336348981e+00 
2.46 -3.320475832e+00 
2.48 -3.298950192e+00 
2.50 -3.272197572e+00 
2.52 -3.240559523e+00 
2.54 -3.204436314e+00 
2.56 -3.164150868e+00 
2.58 -3.120081020e+00 
2.60 -3.072619546e+00 
2.62 -3.022058354e+00 
2.64 -2.968658579e+00 
2.66 -2.912766742e+00 
2.68 -2.854714252e+00 
2.70 -2.794816749e+00 
2.72 -2.733373711e+00 
2.74 -2.670668194e+00 
2.76 -2.606966711e+00 
2.78 -2.542519236e+00 
2.80 -2.477559329e+00 
2.82 -2.412304365e+00 
2.84 -2.346955854e+00 
2.86 -2.281699846e+00 
2.88 -2.216707396e+00 
2.90 -2.152135095e+00 
2.92 -2.088125629e+00 
2.94 -2.024808387e+00 
2.96 -1.962300081e+00 
2.98 -1.900695182e+00 
3.00 -1.840025788e+00 
3.02 -1.780364683e+00 
3.04 -1.721785021e+00 
3.06 -1.664318054e+00 
3.08 -1.607839092e+00 
3.10 -1.552371615e+00 
3.12 -1.497960259e+00 
3.14 -1.444643170e+00 
3.16 -1.392452459e+00 
3.18 -1.341414650e+00 
3.20 -1.291551101e+00 
3.22 -1.242878402e+00 
3.24 -1.195408764e+00 
3.26 -1.149150374e+00 
3.28 -1.104107740e+00 
3.30 -1.060282014e+00 
3.32 -1.017671294e+00 
3.34 -9.762709105e-01 
3.36 -9.360736933e-01 
3.38 -8.970702220e-01 
3.40 -8.592490595e-01 
3.42 -8.225969703e-01 
3.44 -7.870991235e-01 
3.46 -7.527392807e-01 
3.48 -7.194999712e-01 
3.50 -6.873626538e-01 
3.52 -6.563078659e-01 
3.54 -6.263153620e-01 
3.56 -5.973642397e-01 
3.58 -5.694330571e-01 
3.60 -5.424999392e-01 
3.62 -5.165426755e-01 
3.64 -4.915388099e-01 
3.66 -4.674657213e-01 
3.68 -4.443006976e-01 
3.70 -4.220210028e-01 
3.72 -4.006039370e-01 
3.74 -3.800268910e-01 
3.76 -3.602673952e-01 
3.78 -3.413031628e-01 
3.80 -3.231121293e-01 
3.82 -3.056724862e-01 
3.84 -2.889627116e-01 
3.86 -2.729615968e-01 
3.88 -2.576482692e-01 
3.90 -2.430022123e-01 
3.92 -2.290032825e-01 
3.94 -2.156317233e-01 
3.96 -2.028681774e-01 
3.98 -1.906936958e-01 
4.00 -1.790897456e-01 
4.02 -1.680382157e-01 
4.04 -1.575214206e-01 
4.06 -1.475221028e-01 
4.08 -1.380234342e-01 
4.10 -1.290090153e-01 
4.12 -1.204628747e-01 
4.14 -1.123694660e-01 
4.16 -1.047136655e-01 
4.18 -9.748076872e-02 
4.20 -9.065648289e-02 
4.22 -8.422692302e-02 
4.24 -7.817860708e-02 
4.26 -7.249844959e-02 
4.28 -6.717375488e-02 
4.30 -6.219220994e-02 
4.32 -5.753653427e-02 
4.34 -5.313761848e-02 
4.36 -4.897087867e-02 
4.38 -4.502852623e-02 
4.40 -4.130297875e-02 
4.42 -3.778686196e-02 
4.44 -3.447301050e-02 
4.46 -3.135446749e-02 
4.48 -2.842448326e-02 
4.50 -2.567651330e-02 
4.52 -2.310421667e-02 
4.54 -2.070144993e-02 
4.56 -1.846226482e-02 
4.58 -1.638090511e-02 
4.60 -1.445180234e-02 
4.62 -1.266957135e-02 
4.64 -1.102877531e-02 
4.66 -9.524197432e-03 
4.68 -8.151248489e-03 
4.70 -6.905415515e-03 
4.72 -5.782271218e-03 
4.74 -4.777487526e-03 
4.76 -3.886845914e-03 
4.78 -3.106244997e-03 
4.80 -2.431705811e-03 
4.82 -1.859375144e-03 
4.84 -1.385527237e-03 
4.86 -1.003095864e-03 
4.88 -6.882353955e-04 
4.90 -4.352181450e-04 
4.92 -2.419095951e-04 
4.94 -1.062497884e-04 
4.96 -2.625183446e-05 
4.98 -2.180046032e-10 
5.00  0.000000000e+00 
5.02  0.000000000e+00 
5.04  0.000000000e+00 
5.06  0.000000000e+00 
5.08  0.000000000e+00 
5.10  0.000000000e+00 
5.12  0.000000000e+00 
5.14  0.000000000e+00 
5.16  0.000000000e+00 
5.18  0.000000000e+00 
5.20  0.000000000e+00 
5.22  0.000000000e+00 
5.24  0.000000000e+00 
5.26  0.000000000e+00 
5.28  0.000000000e+00 
5.30  0.000000000e+00 
5.32  0.000000000e+00 
5.34  0.000000000e+00 
5.36  0.000000000e+00 
5.38  0.000000000e+00 
5.40  0.000000000e+00 
5.42  0.000000000e+00 
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