# 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 = NiPt2
# 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  8.199275888e+06 
0.80  7.441397423e+06 
0.82  6.757379775e+06 
0.84  6.138571149e+06 
0.86  5.577537354e+06 
0.88  5.067839256e+06 
0.90  4.603868591e+06 
0.92  4.180755603e+06 
0.94  3.794201156e+06 
0.96  3.440431351e+06 
0.98  3.116154585e+06 
1.00  2.818466302e+06 
1.02  2.544790089e+06 
1.04  2.292846904e+06 
1.06  2.060589723e+06 
1.08  1.846221107e+06 
1.10  1.648128812e+06 
1.12  1.464847209e+06 
1.14  1.295073693e+06 
1.16  1.137633875e+06 
1.18  9.914873658e+05 
1.20  8.556928521e+05 
1.22  7.294055861e+05 
1.24  6.118546914e+05 
1.26  5.023434080e+05 
1.28  4.061544273e+05 
1.30  3.258204445e+05 
1.32  2.579500037e+05 
1.34  2.014605003e+05 
1.36  1.574049530e+05 
1.38  1.231216877e+05 
1.40  9.640570420e+04 
1.42  7.555927292e+04 
1.44  5.927075423e+04 
1.46  4.652753477e+04 
1.48  3.654787196e+04 
1.50  2.872478227e+04 
1.52  2.258647870e+04 
1.54  1.776658680e+04 
1.56  1.397945235e+04 
1.58  1.100193049e+04 
1.60  8.659446796e+03 
1.62  6.815526880e+03 
1.64  5.363570410e+03 
1.66  4.220017605e+03 
1.68  3.319254386e+03 
1.70  2.609718928e+03 
1.72  2.050850483e+03 
1.74  1.610632844e+03 
1.76  1.263939919e+03 
1.78  9.910005128e+02 
1.80  7.762188541e+02 
1.82  6.072735167e+02 
1.84  4.744399686e+02 
1.86  3.700749075e+02 
1.88  2.881428861e+02 
1.90  2.238781959e+02 
1.92  1.735182632e+02 
1.94  1.340909988e+02 
1.96  1.032544278e+02 
1.98  7.916449323e+01 
2.00  6.036738769e+01 
2.02  4.571772301e+01 
2.04  3.431391854e+01 
2.06  2.544703002e+01 
2.08  1.856022719e+01 
2.10  1.321670157e+01 
2.12  9.073896379e+00 
2.14  5.864296621e+00 
2.16  3.379207452e+00 
2.18  1.455575121e+00 
2.20 -3.291025931e-02 
2.22 -1.184381779e+00 
2.24 -2.074981048e+00 
2.26 -2.763646045e+00 
2.28 -3.295886768e+00 
2.30 -3.706758132e+00 
2.32 -4.023196764e+00 
2.34 -4.265854259e+00 
2.36 -4.450523467e+00 
2.38 -4.589260973e+00 
2.40 -4.691280012e+00 
2.42 -4.763615253e+00 
2.44 -4.811646973e+00 
2.46 -4.839505357e+00 
2.48 -4.850380892e+00 
2.50 -4.846761488e+00 
2.52 -4.830612622e+00 
2.54 -4.803505481e+00 
2.56 -4.766641528e+00 
2.58 -4.721069344e+00 
2.60 -4.667709135e+00 
2.62 -4.607369379e+00 
2.64 -4.540776149e+00 
2.66 -4.468593809e+00 
2.68 -4.391439322e+00 
2.70 -4.309891871e+00 
2.72 -4.224479605e+00 
2.74 -4.135673398e+00 
2.76 -4.043963257e+00 
2.78 -3.949817616e+00 
2.80 -3.853681630e+00 
2.82 -3.755977199e+00 
2.84 -3.657085458e+00 
2.86 -3.557335828e+00 
2.88 -3.457075070e+00 
2.90 -3.356628171e+00 
2.92 -3.256296339e+00 
2.94 -3.156357328e+00 
2.96 -3.057065895e+00 
2.98 -2.958646644e+00 
3.00 -2.861262954e+00 
3.02 -2.765094756e+00 
3.04 -2.670309765e+00 
3.06 -2.577056790e+00 
3.08 -2.485466717e+00 
3.10 -2.395653521e+00 
3.12 -2.307715291e+00 
3.14 -2.221735244e+00 
3.16 -2.137782747e+00 
3.18 -2.055914305e+00 
3.20 -1.976174535e+00 
3.22 -1.898597111e+00 
3.24 -1.823205669e+00 
3.26 -1.750014680e+00 
3.28 -1.679030282e+00 
3.30 -1.610251068e+00 
3.32 -1.543660320e+00 
3.34 -1.479146178e+00 
3.36 -1.416665984e+00 
3.38 -1.356201165e+00 
3.40 -1.297728814e+00 
3.42 -1.241222202e+00 
3.44 -1.186651258e+00 
3.46 -1.133983005e+00 
3.48 -1.083181972e+00 
3.50 -1.034210570e+00 
3.52 -9.870294383e-01 
3.54 -9.415977579e-01 
3.56 -8.978735457e-01 
3.58 -8.558139148e-01 
3.60 -8.153753146e-01 
3.62 -7.765137469e-01 
3.64 -7.391849603e-01 
3.66 -7.033446256e-01 
3.68 -6.689484917e-01 
3.70 -6.359525246e-01 
3.72 -6.043130312e-01 
3.74 -5.739867674e-01 
3.76 -5.449310332e-01 
3.78 -5.171037555e-01 
3.80 -4.904635594e-01 
3.82 -4.649698291e-01 
3.84 -4.405827592e-01 
3.86 -4.172633978e-01 
3.88 -3.949736813e-01 
3.90 -3.736764626e-01 
3.92 -3.533355326e-01 
3.94 -3.339156360e-01 
3.96 -3.153824821e-01 
3.98 -2.977027509e-01 
4.00 -2.808440949e-01 
4.02 -2.647751378e-01 
4.04 -2.494654695e-01 
4.06 -2.348856385e-01 
4.08 -2.210071413e-01 
4.10 -2.078024109e-01 
4.12 -1.952448020e-01 
4.14 -1.833085752e-01 
4.16 -1.719688807e-01 
4.18 -1.612017389e-01 
4.20 -1.509840222e-01 
4.22 -1.412934348e-01 
4.24 -1.321084919e-01 
4.26 -1.234085011e-01 
4.28 -1.151735358e-01 
4.30 -1.073844165e-01 
4.32 -1.000226901e-01 
4.34 -9.307060839e-02 
4.36 -8.651110628e-02 
4.38 -8.032766595e-02 
4.40 -7.450384547e-02 
4.42 -6.902481620e-02 
4.44 -6.387640719e-02 
4.46 -5.904489330e-02 
4.48 -5.451700780e-02 
4.50 -5.027994900e-02 
4.52 -4.632138206e-02 
4.54 -4.262943676e-02 
4.56 -3.919270228e-02 
4.58 -3.600021937e-02 
4.60 -3.304147062e-02 
4.62 -3.030636924e-02 
4.64 -2.778524673e-02 
4.66 -2.546883984e-02 
4.68 -2.334827685e-02 
4.70 -2.140405391e-02 
4.72 -1.960122879e-02 
4.74 -1.793259247e-02 
4.76 -1.639255259e-02 
4.78 -1.497574430e-02 
4.80 -1.367702159e-02 
4.82 -1.249144898e-02 
4.84 -1.141429332e-02 
4.86 -1.043585421e-02 
4.88 -9.521308231e-03 
4.90 -8.662842495e-03 
4.92 -7.858199304e-03 
4.94 -7.105186057e-03 
4.96 -6.401677403e-03 
4.98 -5.745617195e-03 
5.00 -5.135019594e-03 
5.02 -4.567969480e-03 
5.04 -4.042622283e-03 
5.06 -3.557203350e-03 
5.08 -3.110006929e-03 
5.10 -2.699394865e-03 
5.12 -2.323795045e-03 
5.14 -1.981699680e-03 
5.16 -1.671663445e-03 
5.18 -1.392301521e-03 
5.20 -1.142287586e-03 
5.22 -9.203517575e-04 
5.24 -7.252785278e-04 
5.26 -5.559047038e-04 
5.28 -4.111173628e-04 
5.30 -2.898518397e-04 
5.32 -1.910897538e-04 
5.34 -1.138570827e-04 
5.36 -5.722228837e-05 
5.38 -2.029449915e-05 
5.40 -2.221751676e-06 
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