# 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 = Pt2W
# 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  5.804544370e+02 
1.16  5.399731966e+02 
1.18  5.025599174e+02 
1.20  4.679818698e+02 
1.22  4.359753141e+02 
1.24  4.062692274e+02 
1.26  3.786142445e+02 
1.28  3.527996708e+02 
1.30  3.286550302e+02 
1.32  3.060443133e+02 
1.34  2.848619833e+02 
1.36  2.650283164e+02 
1.38  2.464801628e+02 
1.40  2.291609952e+02 
1.42  2.130123827e+02 
1.44  1.979663492e+02 
1.46  1.839428902e+02 
1.48  1.708558241e+02 
1.50  1.586215811e+02 
1.52  1.471638394e+02 
1.54  1.364133702e+02 
1.56  1.263066465e+02 
1.58  1.167852725e+02 
1.60  1.077958576e+02 
1.62  9.928979938e+01 
1.64  9.122332251e+01 
1.66  8.355826386e+01 
1.68  7.626366264e+01 
1.70  6.931716491e+01 
1.72  6.270380059e+01 
1.74  5.641471716e+01 
1.76  5.048090590e+01 
1.78  4.504120589e+01 
1.80  4.008314392e+01 
1.82  3.557616550e+01 
1.84  3.149027312e+01 
1.86  2.779617758e+01 
1.88  2.446485235e+01 
1.90  2.146685095e+01 
1.92  1.877188855e+01 
1.94  1.634915542e+01 
1.96  1.416842371e+01 
1.98  1.220147469e+01 
2.00  1.042320359e+01 
2.02  8.812052946e+00 
2.04  7.349831464e+00 
2.06  6.021185346e+00 
2.08  4.812978018e+00 
2.10  3.713734155e+00 
2.12  2.713219856e+00 
2.14  1.802182625e+00 
2.16  9.722406922e-01 
2.18  2.158765137e-01 
2.20 -4.735330198e-01 
2.22 -1.101710196e+00 
2.24 -1.673523631e+00 
2.26 -2.193086011e+00 
2.28 -2.663882015e+00 
2.30 -3.088903039e+00 
2.32 -3.470687871e+00 
2.34 -3.811655416e+00 
2.36 -4.114149448e+00 
2.38 -4.380442706e+00 
2.40 -4.612814154e+00 
2.42 -4.813602105e+00 
2.44 -4.985228943e+00 
2.46 -5.130196188e+00 
2.48 -5.251028790e+00 
2.50 -5.350078206e+00 
2.52 -5.432135752e+00 
2.54 -5.499841450e+00 
2.56 -5.554253632e+00 
2.58 -5.596448283e+00 
2.60 -5.627437073e+00 
2.62 -5.648105629e+00 
2.64 -5.659184222e+00 
2.66 -5.661251161e+00 
2.68 -5.654758836e+00 
2.70 -5.640068460e+00 
2.72 -5.617482265e+00 
2.74 -5.587267341e+00 
2.76 -5.549670372e+00 
2.78 -5.504925619e+00 
2.80 -5.453259844e+00 
2.82 -5.394897821e+00 
2.84 -5.330071507e+00 
2.86 -5.259034626e+00 
2.88 -5.182082709e+00 
2.90 -5.099576251e+00 
2.92 -5.011961985e+00 
2.94 -4.919785125e+00 
2.96 -4.823685087e+00 
2.98 -4.724369876e+00 
3.00 -4.622570049e+00 
3.02 -4.518980167e+00 
3.04 -4.414200744e+00 
3.06 -4.308694183e+00 
3.08 -4.202763526e+00 
3.10 -4.096555767e+00 
3.12 -3.990084724e+00 
3.14 -3.883265163e+00 
3.16 -3.775949795e+00 
3.18 -3.667963230e+00 
3.20 -3.559129833e+00 
3.22 -3.449294985e+00 
3.24 -3.338340736e+00 
3.26 -3.226197369e+00 
3.28 -3.112858928e+00 
3.30 -2.998606053e+00 
3.32 -2.884030977e+00 
3.34 -2.769759958e+00 
3.36 -2.656434854e+00 
3.38 -2.544705187e+00 
3.40 -2.435213748e+00 
3.42 -2.328577290e+00 
3.44 -2.225364479e+00 
3.46 -2.126073776e+00 
3.48 -2.031113960e+00 
3.50 -1.940789742e+00 
3.52 -1.855294159e+00 
3.54 -1.774708439e+00 
3.56 -1.699008976e+00 
3.58 -1.628080121e+00 
3.60 -1.561730917e+00 
3.62 -1.499713704e+00 
3.64 -1.441742682e+00 
3.66 -1.387510914e+00 
3.68 -1.336704770e+00 
3.70 -1.289015365e+00 
3.72 -1.244146911e+00 
3.74 -1.201822281e+00 
3.76 -1.161786184e+00 
3.78 -1.123806488e+00 
3.80 -1.087674164e+00 
3.82 -1.053202316e+00 
3.84 -1.020224643e+00 
3.86 -9.885936490e-01 
3.88 -9.581787991e-01 
3.90 -9.288647795e-01 
3.92 -9.005499661e-01 
3.94 -8.731451637e-01 
3.96 -8.465726203e-01 
3.98 -8.207653426e-01 
4.00 -7.956666545e-01 
4.02 -7.712299507e-01 
4.04 -7.474185530e-01 
4.06 -7.242055561e-01 
4.08 -7.015735284e-01 
4.10 -6.795139235e-01 
4.12 -6.580261123e-01 
4.14 -6.371158737e-01 
4.16 -6.167934564e-01 
4.18 -5.970712112e-01 
4.20 -5.779610149e-01 
4.22 -5.594717324e-01 
4.24 -5.416069940e-01 
4.26 -5.243635288e-01 
4.28 -5.077302080e-01 
4.30 -4.916878341e-01 
4.32 -4.762095994e-01 
4.34 -4.612620474e-01 
4.36 -4.468063380e-01 
4.38 -4.327996158e-01 
4.40 -4.191963253e-01 
4.42 -4.059493693e-01 
4.44 -3.930110575e-01 
4.46 -3.803338645e-01 
4.48 -3.678710469e-01 
4.50 -3.555770595e-01 
4.52 -3.434081822e-01 
4.54 -3.313247209e-01 
4.56 -3.192858267e-01 
4.58 -3.072538169e-01 
4.60 -2.951956983e-01 
4.62 -2.830836039e-01 
4.64 -2.708955762e-01 
4.66 -2.586165924e-01 
4.68 -2.462397272e-01 
4.70 -2.337673362e-01 
4.72 -2.212121281e-01 
4.74 -2.085979728e-01 
4.76 -1.959602896e-01 
4.78 -1.833458642e-01 
4.80 -1.708119781e-01 
4.82 -1.584247931e-01 
4.84 -1.462569958e-01 
4.86 -1.343848328e-01 
4.88 -1.228847207e-01 
4.90 -1.118297080e-01 
4.92 -1.012860944e-01 
4.94 -9.131050382e-02 
4.96 -8.194765284e-02 
4.98 -7.322897150e-02 
5.00 -6.517212524e-02 
5.02 -5.778138680e-02 
5.04 -5.104872411e-02 
5.06 -4.495541727e-02 
5.08 -3.947399905e-02 
5.10 -3.457032207e-02 
5.12 -3.020558678e-02 
5.14 -2.633820543e-02 
5.16 -2.292542179e-02 
5.18 -1.992464641e-02 
5.20 -1.729449797e-02 
5.22 -1.499557119e-02 
5.24 -1.299095791e-02 
5.26 -1.124648636e-02 
5.28 -9.730782086e-03 
5.30 -8.415891683e-03 
5.32 -7.276692872e-03 
5.34 -6.290740283e-03 
5.36 -5.438119323e-03 
5.38 -4.701261789e-03 
5.40 -4.064742565e-03 
5.42 -3.515071098e-03 
5.44 -3.040486891e-03 
5.46 -2.630764982e-03 
5.48 -2.277034975e-03 
5.50 -1.971615409e-03 
5.52 -1.707864096e-03 
5.54 -1.480044233e-03 
5.56 -1.283205569e-03 
5.58 -1.113079609e-03 
5.60 -9.659876872e-04 
5.62 -8.387606600e-04 
5.64 -7.286690021e-04 
5.66 -6.333621278e-04 
5.68 -5.508158451e-04 
5.70 -4.792869380e-04 
5.72 -4.172739716e-04 
5.74 -3.634835094e-04 
5.76 -3.168010227e-04 
5.78 -2.762658626e-04 
5.80 -2.410497369e-04 
5.82 -2.104382105e-04 
5.84 -1.838148090e-04 
5.86 -1.606473608e-04 
5.88 -1.404762640e-04 
5.90 -1.229044061e-04 
5.92 -1.075885031e-04 
5.94 -9.423165728e-05 
5.96 -8.257695942e-05 
5.98 -7.240198958e-05 
6.00 -6.351408692e-05