# 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 = Au2Pd
# 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  4.361643829e+02 
1.16  4.031756597e+02 
1.18  3.727907932e+02 
1.20  3.447819635e+02 
1.22  3.189406694e+02 
1.24  2.950766472e+02 
1.26  2.730176639e+02 
1.28  2.526090816e+02 
1.30  2.337126768e+02 
1.32  2.162045454e+02 
1.34  1.999725746e+02 
1.36  1.849144379e+02 
1.38  1.709367886e+02 
1.40  1.579550499e+02 
1.42  1.458928179e+02 
1.44  1.346808015e+02 
1.46  1.242556724e+02 
1.48  1.145589397e+02 
1.50  1.055359726e+02 
1.52  9.713552780e+01 
1.54  8.930983766e+01 
1.56  8.201486622e+01 
1.58  7.521047591e+01 
1.60  6.888506541e+01 
1.62  6.302137450e+01 
1.64  5.759368529e+01 
1.66  5.258505150e+01 
1.68  4.796341128e+01 
1.70  4.369899099e+01 
1.72  3.976434309e+01 
1.74  3.613412802e+01 
1.76  3.278498080e+01 
1.78  2.969537899e+01 
1.80  2.684546782e+01 
1.82  2.421689985e+01 
1.84  2.179276149e+01 
1.86  1.955757473e+01 
1.88  1.749729274e+01 
1.90  1.559921515e+01 
1.92  1.385180540e+01 
1.94  1.224445005e+01 
1.96  1.076722847e+01 
1.98  9.410752008e+00 
2.00  8.166093626e+00 
2.02  7.024789336e+00 
2.04  5.978872960e+00 
2.06  5.020910170e+00 
2.08  4.144013860e+00 
2.10  3.341838111e+00 
2.12  2.608555673e+00 
2.14  1.938824934e+00 
2.16  1.327751243e+00 
2.18  7.708471923e-01 
2.20  2.639962511e-01 
2.22 -1.965776204e-01 
2.24 -6.143347669e-01 
2.26 -9.924417539e-01 
2.28 -1.333793364e+00 
2.30 -1.641036370e+00 
2.32 -1.916595271e+00 
2.34 -2.162699231e+00 
2.36 -2.381409171e+00 
2.38 -2.574644159e+00 
2.40 -2.744206707e+00 
2.42 -2.891806845e+00 
2.44 -3.019084486e+00 
2.46 -3.127628342e+00 
2.48 -3.219026587e+00 
2.50 -3.295014997e+00 
2.52 -3.356831156e+00 
2.54 -3.405631701e+00 
2.56 -3.442626265e+00 
2.58 -3.469392267e+00 
2.60 -3.486842262e+00 
2.62 -3.495702023e+00 
2.64 -3.496650063e+00 
2.66 -3.490299505e+00 
2.68 -3.477212465e+00 
2.70 -3.457898514e+00 
2.72 -3.432824408e+00 
2.74 -3.402463521e+00 
2.76 -3.367259598e+00 
2.78 -3.327612682e+00 
2.80 -3.283892468e+00 
2.82 -3.236449769e+00 
2.84 -3.185626159e+00 
2.86 -3.131761734e+00 
2.88 -3.075200738e+00 
2.90 -3.016294477e+00 
2.92 -2.955401135e+00 
2.94 -2.892882641e+00 
2.96 -2.829099574e+00 
2.98 -2.764405601e+00 
3.00 -2.699142733e+00 
3.02 -2.633637746e+00 
3.04 -2.568198991e+00 
3.06 -2.503112340e+00 
3.08 -2.438635469e+00 
3.10 -2.374991000e+00 
3.12 -2.312360092e+00 
3.14 -2.250878546e+00 
3.16 -2.190636795e+00 
3.18 -2.131684009e+00 
3.20 -2.074035316e+00 
3.22 -2.017680574e+00 
3.24 -1.962593109e+00 
3.26 -1.908737299e+00 
3.28 -1.856074433e+00 
3.30 -1.804566793e+00 
3.32 -1.754180175e+00 
3.34 -1.704885200e+00 
3.36 -1.656657762e+00 
3.38 -1.609478891e+00 
3.40 -1.563334260e+00 
3.42 -1.518213454e+00 
3.44 -1.474109120e+00 
3.46 -1.431016069e+00 
3.48 -1.388930373e+00 
3.50 -1.347848509e+00 
3.52 -1.307766590e+00 
3.54 -1.268679689e+00 
3.56 -1.230581294e+00 
3.58 -1.193462875e+00 
3.60 -1.157313587e+00 
3.62 -1.122120078e+00 
3.64 -1.087866425e+00 
3.66 -1.054534166e+00 
3.68 -1.022102438e+00 
3.70 -9.905482154e-01 
3.72 -9.598466276e-01 
3.74 -9.299713587e-01 
3.76 -9.008950994e-01 
3.78 -8.725900299e-01 
3.80 -8.450283021e-01 
3.82 -8.181824868e-01 
3.84 -7.920259539e-01 
3.86 -7.665331574e-01 
3.88 -7.416798100e-01 
3.90 -7.174429415e-01 
3.92 -6.938008516e-01 
3.94 -6.707329815e-01 
3.96 -6.482197257e-01 
3.98 -6.262422363e-01 
4.00 -6.047822454e-01 
4.02 -5.838219483e-01 
4.04 -5.633439757e-01 
4.06 -5.433314802e-01 
4.08 -5.237683493e-01 
4.10 -5.046395458e-01 
4.12 -4.859315744e-01 
4.14 -4.676330237e-01 
4.16 -4.497351714e-01 
4.18 -4.322325663e-01 
4.20 -4.151235173e-01 
4.22 -3.984103985e-01 
4.24 -3.820996784e-01 
4.26 -3.662015955e-01 
4.28 -3.507294353e-01 
4.30 -3.356984096e-01 
4.32 -3.211242050e-01 
4.34 -3.070213212e-01 
4.36 -2.934013741e-01 
4.38 -2.802715549e-01 
4.40 -2.676334252e-01 
4.42 -2.554821850e-01 
4.44 -2.438064809e-01 
4.46 -2.325887491e-01 
4.48 -2.218060248e-01 
4.50 -2.114311035e-01 
4.52 -2.014339226e-01 
4.54 -1.917830341e-01 
4.56 -1.824470599e-01 
4.58 -1.733960437e-01 
4.60 -1.646026421e-01 
4.62 -1.560431153e-01 
4.64 -1.476980896e-01 
4.66 -1.395530763e-01 
4.68 -1.315987301e-01 
4.70 -1.238308410e-01 
4.72 -1.162500603e-01 
4.74 -1.088613762e-01 
4.76 -1.016733725e-01 
4.78 -9.469732673e-02 
4.80 -8.794621722e-02 
4.82 -8.143373128e-02 
4.84 -7.517333145e-02 
4.86 -6.917748021e-02 
4.88 -6.345704449e-02 
4.90 -5.802090069e-02 
4.92 -5.287572476e-02 
4.94 -4.802561774e-02 
4.96 -4.347258222e-02 
4.98 -3.921702929e-02 
5.00 -3.525718312e-02 
5.02 -3.158921435e-02 
5.04 -2.820735323e-02 
5.06 -2.510399008e-02 
5.08 -2.226978605e-02 
5.10 -1.969380359e-02 
5.12 -1.736368294e-02 
5.14 -1.526585354e-02 
5.16 -1.338578663e-02 
5.18 -1.170828396e-02 
5.20 -1.021777045e-02 
5.22 -8.898486249e-03 
5.24 -7.735059820e-03 
5.26 -6.712596588e-03 
5.28 -5.816820318e-03 
5.30 -5.034240353e-03 
5.32 -4.352268661e-03 
5.34 -3.759290744e-03 
5.36 -3.244696544e-03 
5.38 -2.798878466e-03 
5.40 -2.413203790e-03 
5.42 -2.079968311e-03 
5.44 -1.792337264e-03 
5.46 -1.544278589e-03 
5.48 -1.330492621e-03 
5.50 -1.146341323e-03 
5.52 -9.877793425e-04 
5.54 -8.512884696e-04 
5.56 -7.338165064e-04 
5.58 -6.327210955e-04 
5.60 -5.457187380e-04 
5.62 -4.708389810e-04 
5.64 -4.063835875e-04 
5.66 -3.508903982e-04 
5.68 -3.031015283e-04 
5.70 -2.619355138e-04 
5.72 -2.264630156e-04 
5.74 -1.958856998e-04 
5.76 -1.695179289e-04 
5.78 -1.467709300e-04 
5.80 -1.271391307e-04 
5.82 -1.101883863e-04 
5.84 -9.554584941e-05 
5.86 -8.289126263e-05 
5.88 -7.194948196e-05 
5.90 -6.248406030e-05 
5.92 -5.429174438e-05 
5.94 -4.719775680e-05 
5.96 -4.105175227e-05 
5.98 -3.572435234e-05 
6.00 -3.110417603e-05