# 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 = CuNi2
# 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  3.790111176e+06 
0.80  3.391549427e+06 
0.82  3.031726039e+06 
0.84  2.706141613e+06 
0.86  2.410844175e+06 
0.88  2.142444001e+06 
0.90  1.898029975e+06 
0.92  1.675075185e+06 
0.94  1.471313669e+06 
0.96  1.284773727e+06 
0.98  1.113710630e+06 
1.00  9.566030247e+05 
1.02  8.120858734e+05 
1.04  6.789457743e+05 
1.06  5.561281926e+05 
1.08  4.427060719e+05 
1.10  3.423062252e+05 
1.12  2.619326546e+05 
1.14  2.000306006e+05 
1.16  1.530733098e+05 
1.18  1.173611566e+05 
1.20  9.013428213e+04 
1.22  6.933326814e+04 
1.24  5.340754551e+04 
1.26  4.119364261e+04 
1.28  3.181099647e+04 
1.30  2.459115566e+04 
1.32  1.902787673e+04 
1.34  1.473513974e+04 
1.36  1.141834667e+04 
1.38  8.853025468e+03 
1.40  6.866993412e+03 
1.42  5.328061891e+03 
1.44  4.134452934e+03 
1.46  3.208151135e+03 
1.48  2.488879430e+03 
1.50  1.930159665e+03 
1.52  1.496124068e+03 
1.54  1.158989670e+03 
1.56  8.971645573e+02 
1.58  6.939051308e+02 
1.60  5.361877578e+02 
1.62  4.138776533e+02 
1.64  3.190662045e+02 
1.66  2.456190379e+02 
1.68  1.887594276e+02 
1.70  1.447755523e+02 
1.72  1.107893316e+02 
1.74  8.455057083e+01 
1.76  6.431656476e+01 
1.78  4.872958875e+01 
1.80  3.673460586e+01 
1.82  2.751554826e+01 
1.84  2.043779974e+01 
1.86  1.500859435e+01 
1.88  1.084595630e+01 
1.90  7.653746100e+00 
1.92  5.204155718e+00 
1.94  3.321985305e+00 
1.96  1.872284604e+00 
1.98  7.520201112e-01 
2.00 -1.176586293e-01 
2.02 -7.967928356e-01 
2.04 -1.331034482e+00 
2.06 -1.754993316e+00 
2.08 -2.094787569e+00 
2.10 -2.370032326e+00 
2.12 -2.595354148e+00 
2.14 -2.781620344e+00 
2.16 -2.936900073e+00 
2.18 -3.067120818e+00 
2.20 -3.176643361e+00 
2.22 -3.268682442e+00 
2.24 -3.345609088e+00 
2.26 -3.409186373e+00 
2.28 -3.460745785e+00 
2.30 -3.501317901e+00 
2.32 -3.531728073e+00 
2.34 -3.552665476e+00 
2.36 -3.564732036e+00 
2.38 -3.568476265e+00 
2.40 -3.564415908e+00 
2.42 -3.553052387e+00 
2.44 -3.534855022e+00 
2.46 -3.510253399e+00 
2.48 -3.479730295e+00 
2.50 -3.443768325e+00 
2.52 -3.402845935e+00 
2.54 -3.357427910e+00 
2.56 -3.307892582e+00 
2.58 -3.254666708e+00 
2.60 -3.198187266e+00 
2.62 -3.138765447e+00 
2.64 -3.076672770e+00 
2.66 -3.012286526e+00 
2.68 -2.945965705e+00 
2.70 -2.878050190e+00 
2.72 -2.808860317e+00 
2.74 -2.738696661e+00 
2.76 -2.667839997e+00 
2.78 -2.596551447e+00 
2.80 -2.525072770e+00 
2.82 -2.453626784e+00 
2.84 -2.382417899e+00 
2.86 -2.311632734e+00 
2.88 -2.241440808e+00 
2.90 -2.171995286e+00 
2.92 -2.103433763e+00 
2.94 -2.035879070e+00 
2.96 -1.969440101e+00 
2.98 -1.904188452e+00 
3.00 -1.840063549e+00 
3.02 -1.777116631e+00 
3.04 -1.715413094e+00 
3.06 -1.654993204e+00 
3.08 -1.595817738e+00 
3.10 -1.537913824e+00 
3.12 -1.481314795e+00 
3.14 -1.426047320e+00 
3.16 -1.372131952e+00 
3.18 -1.319583641e+00 
3.20 -1.268412224e+00 
3.22 -1.218622886e+00 
3.24 -1.170216594e+00 
3.26 -1.123190498e+00 
3.28 -1.077538318e+00 
3.30 -1.033250692e+00 
3.32 -9.903155073e-01 
3.34 -9.487182111e-01 
3.36 -9.084420909e-01 
3.38 -8.694685395e-01 
3.40 -8.317772980e-01 
3.42 -7.953466802e-01 
3.44 -7.601537782e-01 
3.46 -7.261746524e-01 
3.48 -6.933845042e-01 
3.50 -6.617578345e-01 
3.52 -6.312685884e-01 
3.54 -6.018902863e-01 
3.56 -5.735961428e-01 
3.58 -5.463591751e-01 
3.60 -5.201522998e-01 
3.62 -4.949484205e-01 
3.64 -4.707205065e-01 
3.66 -4.474416624e-01 
3.68 -4.250851908e-01 
3.70 -4.036246474e-01 
3.72 -3.830338896e-01 
3.74 -3.632871193e-01 
3.76 -3.443589197e-01 
3.78 -3.262242878e-01 
3.80 -3.088586612e-01 
3.82 -2.922379420e-01 
3.84 -2.763385155e-01 
3.86 -2.611372666e-01 
3.88 -2.466115919e-01 
3.90 -2.327394103e-01 
3.92 -2.194991693e-01 
3.94 -2.068698507e-01 
3.96 -1.948309729e-01 
3.98 -1.833625917e-01 
4.00 -1.724453001e-01 
4.02 -1.620602254e-01 
4.04 -1.521890259e-01 
4.06 -1.428138860e-01 
4.08 -1.339175107e-01 
4.10 -1.254831182e-01 
4.12 -1.174944332e-01 
4.14 -1.099356781e-01 
4.16 -1.027915646e-01 
4.18 -9.604728444e-02 
4.20 -8.968850012e-02 
4.22 -8.366705059e-02 
4.24 -7.793577425e-02 
4.26 -7.248476428e-02 
4.28 -6.730442247e-02 
4.30 -6.238544760e-02 
4.32 -5.771882924e-02 
4.34 -5.329584054e-02 
4.36 -4.910803198e-02 
4.38 -4.514722192e-02 
4.40 -4.140549180e-02 
4.42 -3.787517993e-02 
4.44 -3.454887465e-02 
4.46 -3.141923118e-02 
4.48 -2.847926713e-02 
4.50 -2.572240635e-02 
4.52 -2.314179075e-02 
4.54 -2.073125581e-02 
4.56 -1.848504163e-02 
4.58 -1.639750001e-02 
4.60 -1.446310818e-02 
4.62 -1.267647940e-02 
4.64 -1.103237068e-02 
4.66 -9.525688357e-03 
4.68 -8.151491582e-03 
4.70 -6.904994253e-03 
4.72 -5.781565557e-03 
4.74 -4.776729389e-03 
4.76 -3.886162854e-03 
4.78 -3.105694002e-03 
4.80 -2.431298978e-03 
4.82 -1.859098684e-03 
4.84 -1.385355077e-03 
4.86 -1.002998917e-03 
4.88 -6.881873147e-04 
4.90 -4.351981338e-04 
4.92 -2.419032277e-04 
4.94 -1.062485352e-04 
4.96 -2.625175706e-05 
4.98 -2.180046037e-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