# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2015--Purja-Pun-G-P-Yamakov-V-Mishin-Y--Ni-Al-Co
# implementation = 2015--Purja-Pun-G-P--Ni-Al-Co--LAMMPS--ipr1
# composition = Al2Ni
# 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 2022-05-24

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  6.186009940e+04 
1.00  5.645660339e+04 
1.02  5.127862287e+04 
1.04  4.646941519e+04 
1.06  4.201021230e+04 
1.08  3.788367521e+04 
1.10  3.407292498e+04 
1.12  3.056148094e+04 
1.14  2.733312183e+04 
1.16  2.437197955e+04 
1.18  2.166272090e+04 
1.20  1.919053035e+04 
1.22  1.694127775e+04 
1.24  1.490137714e+04 
1.26  1.305688124e+04 
1.28  1.138997073e+04 
1.30  9.888449451e+03 
1.32  8.541500780e+03 
1.34  7.338493043e+03 
1.36  6.269148608e+03 
1.38  5.323477893e+03 
1.40  4.491678369e+03 
1.42  3.764202295e+03 
1.44  3.131844529e+03 
1.46  2.585788088e+03 
1.48  2.117619962e+03 
1.50  1.719343457e+03 
1.52  1.383347874e+03 
1.54  1.102435348e+03 
1.56  8.698696693e+02 
1.58  6.793622832e+02 
1.60  5.250733014e+02 
1.62  4.016330627e+02 
1.64  3.041486710e+02 
1.66  2.281915855e+02 
1.68  1.697921426e+02 
1.70  1.254436909e+02 
1.72  9.210388647e+01 
1.74  6.719049299e+01 
1.76  4.857709390e+01 
1.78  3.459146843e+01 
1.80  2.401761624e+01 
1.82  1.608305806e+01 
1.84  1.027570121e+01 
1.86  6.155617680e+00 
1.88  3.336043684e+00 
1.90  1.481084983e+00 
1.92  3.053178976e-01 
1.94 -4.251766910e-01 
1.96 -8.927614577e-01 
1.98 -1.228291249e+00 
2.00 -1.511023673e+00 
2.02 -1.770683497e+00 
2.04 -2.010433760e+00 
2.06 -2.229846853e+00 
2.08 -2.427518550e+00 
2.10 -2.602429978e+00 
2.12 -2.756769966e+00 
2.14 -2.895331506e+00 
2.16 -3.023978402e+00 
2.18 -3.147224591e+00 
2.20 -3.266222634e+00 
2.22 -3.378811349e+00 
2.24 -3.482477731e+00 
2.26 -3.575468741e+00 
2.28 -3.656777462e+00 
2.30 -3.725620574e+00 
2.32 -3.781806177e+00 
2.34 -3.826165382e+00 
2.36 -3.860008945e+00 
2.38 -3.884733248e+00 
2.40 -3.901517884e+00 
2.42 -3.911270728e+00 
2.44 -3.914682421e+00 
2.46 -3.912282131e+00 
2.48 -3.904650655e+00 
2.50 -3.892278548e+00 
2.52 -3.875581899e+00 
2.54 -3.854935441e+00 
2.56 -3.830704760e+00 
2.58 -3.803282864e+00 
2.60 -3.773108939e+00 
2.62 -3.740630522e+00 
2.64 -3.706189123e+00 
2.66 -3.670004128e+00 
2.68 -3.632137636e+00 
2.70 -3.592457937e+00 
2.72 -3.550636609e+00 
2.74 -3.506262077e+00 
2.76 -3.459075664e+00 
2.78 -3.409263039e+00 
2.80 -3.357645979e+00 
2.82 -3.305570126e+00 
2.84 -3.254419609e+00 
2.86 -3.205001554e+00 
2.88 -3.157299250e+00 
2.90 -3.110736469e+00 
2.92 -3.064561769e+00 
2.94 -3.018131242e+00 
2.96 -2.971065036e+00 
2.98 -2.923288499e+00 
3.00 -2.874914092e+00 
3.02 -2.826118362e+00 
3.04 -2.777119800e+00 
3.06 -2.728143211e+00 
3.08 -2.679260042e+00 
3.10 -2.630448252e+00 
3.12 -2.581711654e+00 
3.14 -2.533074256e+00 
3.16 -2.484579676e+00 
3.18 -2.436302096e+00 
3.20 -2.388332974e+00 
3.22 -2.340718066e+00 
3.24 -2.293432144e+00 
3.26 -2.246425128e+00 
3.28 -2.199654494e+00 
3.30 -2.153091243e+00 
3.32 -2.106710455e+00 
3.34 -2.060477663e+00 
3.36 -2.014361181e+00 
3.38 -1.968335184e+00 
3.40 -1.922380193e+00 
3.42 -1.876484021e+00 
3.44 -1.830643306e+00 
3.46 -1.784865771e+00 
3.48 -1.739177043e+00 
3.50 -1.693648689e+00 
3.52 -1.648379302e+00 
3.54 -1.603456813e+00 
3.56 -1.558981373e+00 
3.58 -1.515073088e+00 
3.60 -1.471868910e+00 
3.62 -1.429517820e+00 
3.64 -1.388155539e+00 
3.66 -1.347884147e+00 
3.68 -1.308760125e+00 
3.70 -1.270793443e+00 
3.72 -1.233974539e+00 
3.74 -1.198286606e+00 
3.76 -1.163701529e+00 
3.78 -1.130188813e+00 
3.80 -1.097720863e+00 
3.82 -1.066274381e+00 
3.84 -1.035828632e+00 
3.86 -1.006360565e+00 
3.88 -9.778499256e-01 
3.90 -9.502794925e-01 
3.92 -9.236281676e-01 
3.94 -8.978709802e-01 
3.96 -8.729794091e-01 
3.98 -8.489216935e-01 
4.00 -8.256631212e-01 
4.02 -8.031662979e-01 
4.04 -7.813913923e-01 
4.06 -7.602964208e-01 
4.08 -7.398428442e-01 
4.10 -7.199998954e-01 
4.12 -7.007361013e-01 
4.14 -6.820184384e-01 
4.16 -6.638124502e-01 
4.18 -6.460823443e-01 
4.20 -6.287910783e-01 
4.22 -6.119004270e-01 
4.24 -5.953727566e-01 
4.26 -5.791756210e-01 
4.28 -5.632807665e-01 
4.30 -5.476730428e-01 
4.32 -5.323407958e-01 
4.34 -5.172730339e-01 
4.36 -5.024673914e-01 
4.38 -4.879304237e-01 
4.40 -4.736696585e-01 
4.42 -4.596932179e-01 
4.44 -4.460098169e-01 
4.46 -4.326287583e-01 
4.48 -4.195599224e-01 
4.50 -4.068137650e-01 
4.52 -3.943998889e-01 
4.54 -3.823186253e-01 
4.56 -3.705657236e-01 
4.58 -3.591371061e-01 
4.60 -3.480291296e-01 
4.62 -3.372385495e-01 
4.64 -3.267625444e-01 
4.66 -3.165986783e-01 
4.68 -3.067449404e-01 
4.70 -2.971997149e-01 
4.72 -2.879611245e-01 
4.74 -2.790207501e-01 
4.76 -2.703662335e-01 
4.78 -2.619851836e-01 
4.80 -2.538653374e-01 
4.82 -2.459946916e-01 
4.84 -2.383617163e-01 
4.86 -2.309556308e-01 
4.88 -2.237667294e-01 
4.90 -2.167867557e-01 
4.92 -2.100093463e-01 
4.94 -2.034304930e-01 
4.96 -1.970489954e-01 
4.98 -1.908671484e-01 
5.00 -1.848889174e-01 
5.02 -1.791219311e-01 
5.04 -1.735810996e-01 
5.06 -1.682866594e-01 
5.08 -1.632576121e-01 
5.10 -1.585060444e-01 
5.12 -1.540318810e-01 
5.14 -1.498238085e-01 
5.16 -1.458593155e-01 
5.18 -1.421034253e-01 
5.20 -1.385102497e-01 
5.22 -1.350262557e-01 
5.24 -1.315952113e-01 
5.26 -1.281642854e-01 
5.28 -1.246905791e-01 
5.30 -1.211472728e-01 
5.32 -1.175280929e-01 
5.34 -1.138489638e-01 
5.36 -1.101459505e-01 
5.38 -1.064695386e-01 
5.40 -1.028758020e-01 
5.42 -9.941630615e-02 
5.44 -9.612911859e-02 
5.46 -9.303330465e-02 
5.48 -9.012859798e-02 
5.50 -8.739636531e-02 
5.52 -8.480374351e-02 
5.54 -8.230958424e-02 
5.56 -7.986953264e-02 
5.58 -7.744030875e-02 
5.60 -7.498344755e-02 
5.62 -7.246651249e-02 
5.64 -6.986340450e-02 
5.66 -6.715678461e-02 
5.68 -6.433669562e-02 
5.70 -6.139847533e-02 
5.72 -5.834370996e-02 
5.74 -5.517196843e-02 
5.76 -5.188731587e-02 
5.78 -4.850800196e-02 
5.80 -4.506300695e-02 
5.82 -4.153024835e-02 
5.84 -3.789080974e-02 
5.86 -3.417869728e-02 
5.88 -3.051586792e-02 
5.90 -2.702431826e-02 
5.92 -2.379553360e-02 
5.94 -2.083518390e-02 
5.96 -1.821539781e-02 
5.98 -1.598807823e-02 
6.00 -1.416100398e-02