# 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 = Pd2W
# 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  4.985223547e+02 
1.16  4.607851674e+02 
1.18  4.260767076e+02 
1.20  3.941299858e+02 
1.22  3.646929860e+02 
1.24  3.375305420e+02 
1.26  3.124287888e+02 
1.28  2.891985624e+02 
1.30  2.676760493e+02 
1.32  2.477210187e+02 
1.34  2.292132305e+02 
1.36  2.120478701e+02 
1.38  1.961309943e+02 
1.40  1.813753444e+02 
1.42  1.676970874e+02 
1.44  1.550145812e+02 
1.46  1.432491554e+02 
1.48  1.323264789e+02 
1.50  1.221773945e+02 
1.52  1.127382033e+02 
1.54  1.039507466e+02 
1.56  9.576233037e+01 
1.58  8.812538058e+01 
1.60  8.099690324e+01 
1.62  7.433844159e+01 
1.64  6.811542635e+01 
1.66  6.229598503e+01 
1.68  5.685138214e+01 
1.70  5.177383895e+01 
1.72  4.707426389e+01 
1.74  4.272839843e+01 
1.76  3.871321299e+01 
1.78  3.500784935e+01 
1.80  3.159330986e+01 
1.82  2.845190954e+01 
1.84  2.556662038e+01 
1.86  2.292052687e+01 
1.88  2.049657307e+01 
1.90  1.827766371e+01 
1.92  1.624703889e+01 
1.94  1.438873870e+01 
1.96  1.268796771e+01 
1.98  1.113125710e+01 
2.00  9.706433081e+00 
2.02  8.402463717e+00 
2.04  7.209261121e+00 
2.06  6.117494168e+00 
2.08  5.118446072e+00 
2.10  4.203936820e+00 
2.12  3.366315481e+00 
2.14  2.598508723e+00 
2.16  1.894095467e+00 
2.18  1.247484339e+00 
2.20  6.537194307e-01 
2.22  1.082949143e-01 
2.24 -3.925631577e-01 
2.26 -8.520178184e-01 
2.28 -1.272759892e+00 
2.30 -1.657089236e+00 
2.32 -2.006674331e+00 
2.34 -2.323007840e+00 
2.36 -2.607692734e+00 
2.38 -2.862421162e+00 
2.40 -3.088954107e+00 
2.42 -3.289101268e+00 
2.44 -3.464701017e+00 
2.46 -3.617600850e+00 
2.48 -3.749636428e+00 
2.50 -3.862605083e+00 
2.52 -3.958231208e+00 
2.54 -4.038126870e+00 
2.56 -4.103756901e+00 
2.58 -4.156418694e+00 
2.60 -4.197241742e+00 
2.62 -4.227204387e+00 
2.64 -4.247621081e+00 
2.66 -4.259732021e+00 
2.68 -4.263781868e+00 
2.70 -4.260031809e+00 
2.72 -4.248771712e+00 
2.74 -4.230315270e+00 
2.76 -4.204994777e+00 
2.78 -4.173157049e+00 
2.80 -4.135177081e+00 
2.82 -4.091543258e+00 
2.84 -4.042782656e+00 
2.86 -3.989415869e+00 
2.88 -3.931962062e+00 
2.90 -3.870938960e+00 
2.92 -3.806856056e+00 
2.94 -3.740200914e+00 
2.96 -3.671420808e+00 
2.98 -3.600903921e+00 
3.00 -3.528964882e+00 
3.02 -3.455838199e+00 
3.04 -3.381680691e+00 
3.06 -3.306581472e+00 
3.08 -3.230576533e+00 
3.10 -3.153664700e+00 
3.12 -3.075822458e+00 
3.14 -2.997016316e+00 
3.16 -2.917212344e+00 
3.18 -2.836383316e+00 
3.20 -2.754514175e+00 
3.22 -2.671606640e+00 
3.24 -2.587683624e+00 
3.26 -2.502793885e+00 
3.28 -2.417017057e+00 
3.30 -2.330468842e+00 
3.32 -2.243305937e+00 
3.34 -2.155729980e+00 
3.36 -2.067989722e+00 
3.38 -1.980380623e+00 
3.40 -1.893241196e+00 
3.42 -1.806945734e+00 
3.44 -1.721893453e+00 
3.46 -1.638494537e+00 
3.48 -1.557154091e+00 
3.50 -1.478255308e+00 
3.52 -1.402143407e+00 
3.54 -1.329111811e+00 
3.56 -1.259391782e+00 
3.58 -1.193146273e+00 
3.60 -1.130468229e+00 
3.62 -1.071383020e+00 
3.64 -1.015854330e+00 
3.66 -9.637925169e-01 
3.68 -9.150644165e-01 
3.70 -8.695036139e-01 
3.72 -8.269203799e-01 
3.74 -7.871106896e-01 
3.76 -7.498639724e-01 
3.78 -7.149694432e-01 
3.80 -6.822210285e-01 
3.82 -6.514210128e-01 
3.84 -6.223825994e-01 
3.86 -5.949316086e-01 
3.88 -5.689075393e-01 
3.90 -5.441641972e-01 
3.92 -5.205700603e-01 
3.94 -4.980085108e-01 
3.96 -4.763780042e-01 
3.98 -4.555922058e-01 
4.00 -4.355800552e-01 
4.02 -4.162856791e-01 
4.04 -3.976680290e-01 
4.06 -3.797001022e-01 
4.08 -3.623676185e-01 
4.10 -3.456670753e-01 
4.12 -3.296031909e-01 
4.14 -3.141858458e-01 
4.16 -2.994267592e-01 
4.18 -2.853361991e-01 
4.20 -2.719200578e-01 
4.22 -2.591775702e-01 
4.24 -2.470999129e-01 
4.26 -2.356697053e-01 
4.28 -2.248613564e-01 
4.30 -2.146420373e-01 
4.32 -2.049731279e-01 
4.34 -1.958116928e-01 
4.36 -1.871123528e-01 
4.38 -1.788292272e-01 
4.40 -1.709166434e-01 
4.42 -1.633302304e-01 
4.44 -1.560277626e-01 
4.46 -1.489697788e-01 
4.48 -1.421200356e-01 
4.50 -1.354458515e-01 
4.52 -1.289183919e-01 
4.54 -1.225129347e-01 
4.56 -1.162091391e-01 
4.58 -1.099913241e-01 
4.60 -1.038487464e-01 
4.62 -9.777585056e-02 
4.64 -9.177244805e-02 
4.66 -8.584377398e-02 
4.68 -8.000036399e-02 
4.70 -7.425769977e-02 
4.72 -6.863558662e-02 
4.74 -6.315725206e-02 
4.76 -5.784818836e-02 
4.78 -5.273479860e-02 
4.80 -4.784293930e-02 
4.82 -4.319647824e-02 
4.84 -3.881598449e-02 
4.86 -3.471767064e-02 
4.88 -3.091266285e-02 
4.90 -2.740664377e-02 
4.92 -2.419986590e-02 
4.94 -2.128749429e-02 
4.96 -1.866020651e-02 
4.98 -1.630496686e-02 
5.00 -1.420588649e-02 
5.02 -1.234509050e-02 
5.04 -1.070334262e-02 
5.06 -9.261072468e-03 
5.08 -7.999130533e-03 
5.10 -6.898870395e-03 
5.12 -5.942533738e-03 
5.14 -5.113511678e-03 
5.16 -4.396500605e-03 
5.18 -3.777573804e-03 
5.20 -3.244188937e-03 
5.22 -2.785149077e-03 
5.24 -2.390532143e-03 
5.26 -2.051600634e-03 
5.28 -1.760700839e-03 
5.30 -1.511158342e-03 
5.32 -1.297174644e-03 
5.34 -1.113728187e-03 
5.36 -9.564818033e-04 
5.38 -8.216977351e-04 
5.40 -7.061607028e-04 
5.42 -6.071090312e-04 
5.44 -5.221735498e-04 
5.46 -4.493237869e-04 
5.48 -3.868208732e-04 
5.50 -3.331765211e-04 
5.52 -2.871174453e-04 
5.54 -2.475546051e-04 
5.56 -2.135566918e-04 
5.58 -1.843273262e-04 
5.60 -1.591854853e-04 
5.62 -1.375487269e-04 
5.64 -1.189188299e-04 
5.66 -1.028695137e-04 
5.68 -8.903594560e-05 
5.70 -7.710577946e-05 
5.72 -6.681150609e-05 
5.74 -5.792392539e-05 
5.76 -5.024657629e-05 
5.78 -4.361098447e-05 
5.80 -3.787260769e-05 
5.82 -3.290737590e-05 
5.84 -2.860873845e-05 
5.86 -2.488514351e-05 
5.88 -2.165788574e-05 
5.90 -1.885926802e-05 
5.92 -1.643103063e-05 
5.94 -1.432300862e-05 
5.96 -1.249198373e-05 
5.98 -1.090070209e-05 
6.00 -9.517033632e-06