# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr
# implementation = 2004--Zhou-X-W--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr--LAMMPS--ipr1
# composition = Mo2Pd
# 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 2024-04-11

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  nan             
0.98  nan             
1.00  nan             
1.02  nan             
1.04  nan             
1.06  nan             
1.08  nan             
1.10  nan             
1.12  nan             
1.14  3.974602229e+02 
1.16  3.667194244e+02 
1.18  3.384957210e+02 
1.20  3.125757440e+02 
1.22  2.887534797e+02 
1.24  2.668318924e+02 
1.26  2.466278359e+02 
1.28  2.279767226e+02 
1.30  2.107343042e+02 
1.32  1.947754247e+02 
1.34  1.799912448e+02 
1.36  1.662864456e+02 
1.38  1.535768007e+02 
1.40  1.417867447e+02 
1.42  1.308470840e+02 
1.44  1.206935375e+02 
1.46  1.112662475e+02 
1.48  1.025097471e+02 
1.50  9.437295636e+01 
1.52  8.680909593e+01 
1.54  7.977547072e+01 
1.56  7.323303780e+01 
1.58  6.714578034e+01 
1.60  6.148008610e+01 
1.62  5.620435369e+01 
1.64  5.129349358e+01 
1.66  4.672326932e+01 
1.68  4.246731719e+01 
1.70  3.851443547e+01 
1.72  3.485650358e+01 
1.74  3.147252379e+01 
1.76  2.834386784e+01 
1.78  2.545415666e+01 
1.80  2.278887288e+01 
1.82  2.033477030e+01 
1.84  1.807926702e+01 
1.86  1.601001032e+01 
1.88  1.411469605e+01 
1.90  1.238111115e+01 
1.92  1.079730824e+01 
1.94  9.351812465e+00 
1.96  8.033779171e+00 
1.98  6.833057415e+00 
2.00  5.740157991e+00 
2.02  4.746156898e+00 
2.04  3.842576260e+00 
2.06  3.021282623e+00 
2.08  2.274435934e+00 
2.10  1.594510713e+00 
2.12  9.743906045e-01 
2.14  4.075118468e-01 
2.16 -1.119884980e-01 
2.18 -5.891666342e-01 
2.20 -1.028239760e+00 
2.22 -1.432632974e+00 
2.24 -1.805087733e+00 
2.26 -2.147802420e+00 
2.28 -2.462576187e+00 
2.30 -2.750935743e+00 
2.32 -3.013981123e+00 
2.34 -3.252884748e+00 
2.36 -3.469301294e+00 
2.38 -3.664755210e+00 
2.40 -3.840682302e+00 
2.42 -3.998460390e+00 
2.44 -4.139425507e+00 
2.46 -4.264864508e+00 
2.48 -4.375659704e+00 
2.50 -4.472278941e+00 
2.52 -4.555221457e+00 
2.54 -4.624989900e+00 
2.56 -4.682042307e+00 
2.58 -4.726763312e+00 
2.60 -4.759456967e+00 
2.62 -4.780357851e+00 
2.64 -4.789653439e+00 
2.66 -4.787510127e+00 
2.68 -4.774097113e+00 
2.70 -4.749755807e+00 
2.72 -4.714989520e+00 
2.74 -4.669900089e+00 
2.76 -4.614645916e+00 
2.78 -4.549463530e+00 
2.80 -4.474670353e+00 
2.82 -4.390671666e+00 
2.84 -4.297971977e+00 
2.86 -4.197189470e+00 
2.88 -4.089088695e+00 
2.90 -3.974612775e+00 
2.92 -3.854835859e+00 
2.94 -3.730941134e+00 
2.96 -3.604190304e+00 
2.98 -3.475878545e+00 
3.00 -3.347279537e+00 
3.02 -3.219587213e+00 
3.04 -3.093861626e+00 
3.06 -2.970985479e+00 
3.08 -2.851635994e+00 
3.10 -2.736274209e+00 
3.12 -2.625151184e+00 
3.14 -2.518328459e+00 
3.16 -2.415708703e+00 
3.18 -2.317072116e+00 
3.20 -2.222114484e+00 
3.22 -2.130483664e+00 
3.24 -2.041812371e+00 
3.26 -1.955746093e+00 
3.28 -1.871965712e+00 
3.30 -1.790204828e+00 
3.32 -1.710261985e+00 
3.34 -1.632007969e+00 
3.36 -1.555388327e+00 
3.38 -1.480421205e+00 
3.40 -1.407190693e+00 
3.42 -1.335836051e+00 
3.44 -1.266537528e+00 
3.46 -1.199499798e+00 
3.48 -1.134934371e+00 
3.50 -1.073042468e+00 
3.52 -1.013999831e+00 
3.54 -9.579446813e-01 
3.56 -9.049695952e-01 
3.58 -8.551175894e-01 
3.60 -8.083821875e-01 
3.62 -7.647108492e-01 
3.64 -7.240108943e-01 
3.66 -6.861569639e-01 
3.68 -6.509991180e-01 
3.70 -6.183708133e-01 
3.72 -5.880962104e-01 
3.74 -5.599964589e-01 
3.76 -5.338947990e-01 
3.78 -5.096204586e-01 
3.80 -4.870114283e-01 
3.82 -4.659162576e-01 
3.84 -4.461950418e-01 
3.86 -4.277197752e-01 
3.88 -4.103742309e-01 
3.90 -3.940535083e-01 
3.92 -3.786633653e-01 
3.94 -3.641194116e-01 
3.96 -3.503462552e-01 
3.98 -3.372766414e-01 
4.00 -3.248506110e-01 
4.02 -3.130146726e-01 
4.04 -3.017210499e-01 
4.06 -2.909269195e-01 
4.08 -2.805938363e-01 
4.10 -2.706873926e-01 
4.12 -2.611764297e-01 
4.14 -2.520325955e-01 
4.16 -2.432299572e-01 
4.18 -2.347446473e-01 
4.20 -2.265545465e-01 
4.22 -2.186390018e-01 
4.24 -2.109785771e-01 
4.26 -2.035548348e-01 
4.28 -1.963501469e-01 
4.30 -1.893475343e-01 
4.32 -1.825305349e-01 
4.34 -1.758831000e-01 
4.36 -1.693895227e-01 
4.38 -1.630343991e-01 
4.40 -1.568026271e-01 
4.42 -1.506794482e-01 
4.44 -1.446505359e-01 
4.46 -1.387021384e-01 
4.48 -1.328212791e-01 
4.50 -1.269960193e-01 
4.52 -1.212157845e-01 
4.54 -1.154717498e-01 
4.56 -1.097572753e-01 
4.58 -1.040683737e-01 
4.60 -9.840418174e-02 
4.62 -9.276739817e-02 
4.64 -8.716463988e-02 
4.66 -8.160666241e-02 
4.68 -7.610838879e-02 
4.70 -7.068869737e-02 
4.72 -6.536993367e-02 
4.74 -6.017714319e-02 
4.76 -5.513704800e-02 
4.78 -5.027681561e-02 
4.80 -4.562272575e-02 
4.82 -4.119884672e-02 
4.84 -3.702581876e-02 
4.86 -3.311989761e-02 
4.88 -2.949230222e-02 
4.90 -2.614890851e-02 
4.92 -2.309029114e-02 
4.94 -2.031162187e-02 
4.96 -1.780417219e-02 
4.98 -1.555599201e-02 
5.00 -1.355221325e-02 
5.02 -1.177593606e-02 
5.04 -1.020905135e-02 
5.06 -8.832959608e-03 
5.08 -7.629164715e-03 
5.10 -6.579737434e-03 
5.12 -5.667654410e-03 
5.14 -4.877026167e-03 
5.16 -4.193231340e-03 
5.18 -3.602975528e-03 
5.20 -3.094292414e-03 
5.22 -2.656502901e-03 
5.24 -2.280145624e-03 
5.26 -1.956889637e-03 
5.28 -1.679437637e-03 
5.30 -1.441426012e-03 
5.32 -1.237326150e-03 
5.34 -1.062350032e-03 
5.36 -9.123620147e-04 
5.38 -7.837978496e-04 
5.40 -6.735913688e-04 
5.42 -5.791088572e-04 
5.44 -4.980908265e-04 
5.46 -4.286007366e-04 
5.48 -3.689801059e-04 
5.50 -3.178094103e-04 
5.52 -2.738741638e-04 
5.54 -2.361355958e-04 
5.56 -2.037053706e-04 
5.58 -1.758238450e-04 
5.60 -1.518414031e-04 
5.62 -1.312024584e-04 
5.64 -1.134317582e-04 
5.66 -9.812267203e-05 
5.68 -8.492718303e-05 
5.70 -7.354734110e-05 
5.72 -6.372796627e-05 
5.74 -5.525042198e-05 
5.76 -4.792730194e-05 
5.78 -4.159789697e-05 
5.80 -3.612432722e-05 
5.82 -3.138824175e-05 
5.84 -2.728800179e-05 
5.86 -2.373627624e-05 
5.88 -2.065798860e-05 
5.90 -1.798856327e-05 
5.92 -1.567242714e-05 
5.94 -1.366172885e-05 
5.96 -1.191524347e-05 
5.98 -1.039743562e-05 
6.00 -9.077657455e-06