# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2009--Bonny-G-Pasianot-R-C-Malerba-L--Fe-Ni
# implementation = 2009--Bonny-G--Fe-Ni--LAMMPS--ipr1
# composition = FeNi2
# 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  3.370975093e+02 
0.90  3.028182735e+02 
0.92  2.720687117e+02 
0.94  2.446719796e+02 
0.96  2.204186725e+02 
0.98  1.989904681e+02 
1.00  1.799979578e+02 
1.02  1.630884616e+02 
1.04  1.480068888e+02 
1.06  1.345236624e+02 
1.08  1.224267074e+02 
1.10  1.114996829e+02 
1.12  1.015497307e+02 
1.14  9.243289794e+01 
1.16  8.398863976e+01 
1.18  7.614145827e+01 
1.20  6.887482032e+01 
1.22  6.218317708e+01 
1.24  5.605464328e+01 
1.26  5.043008673e+01 
1.28  4.526396380e+01 
1.30  4.049908454e+01 
1.32  3.608088344e+01 
1.34  3.198779968e+01 
1.36  2.820373193e+01 
1.38  2.470148853e+01 
1.40  2.145808632e+01 
1.42  1.845925803e+01 
1.44  1.568493096e+01 
1.46  1.311842592e+01 
1.48  1.074609085e+01 
1.50  8.557066048e+00 
1.52  6.538341054e+00 
1.54  4.681502659e+00 
1.56  2.978981191e+00 
1.58  1.420601940e+00 
1.60 -5.304193699e-03 
1.62  1.737750342e+01 
1.64  1.570194835e+01 
1.66  1.412504605e+01 
1.68  1.264406816e+01 
1.70  1.124570664e+01 
1.72  9.930249953e+00 
1.74  8.695494076e+00 
1.76  7.537759695e+00 
1.78  6.453217116e+00 
1.80  5.437835040e+00 
1.82  4.487420859e+00 
1.84  3.599734357e+00 
1.86  2.773686322e+00 
1.88  2.010951289e+00 
1.90  1.311287956e+00 
1.92  6.731619254e-01 
1.94  9.494311743e-02 
1.96 -4.257040504e-01 
1.98 -8.937008556e-01 
2.00 -1.311559408e+00 
2.02 -1.682051671e+00 
2.04 -2.008259669e+00 
2.06 -2.292724069e+00 
2.08 -2.537936048e+00 
2.10 -2.746174045e+00 
2.12 -2.921129343e+00 
2.14 -3.067627516e+00 
2.16 -3.190610554e+00 
2.18 -3.295826485e+00 
2.20 -3.388963592e+00 
2.22 -3.474173129e+00 
2.24 -3.551371416e+00 
2.26 -3.619453173e+00 
2.28 -3.677374929e+00 
2.30 -3.724377411e+00 
2.32 -3.759867713e+00 
2.34 -3.783266101e+00 
2.36 -3.794037769e+00 
2.38 -3.792647136e+00 
2.40 -3.780521640e+00 
2.42 -3.758634310e+00 
2.44 -3.728151287e+00 
2.46 -3.690365431e+00 
2.48 -3.646502570e+00 
2.50 -3.598462916e+00 
2.52 -3.548961496e+00 
2.54 -3.498220326e+00 
2.56 -3.446174541e+00 
2.58 -3.392756660e+00 
2.60 -3.337861572e+00 
2.62 -3.281341896e+00 
2.64 -3.223194614e+00 
2.66 -3.163588369e+00 
2.68 -3.102700227e+00 
2.70 -3.040705971e+00 
2.72 -2.977780219e+00 
2.74 -2.914096510e+00 
2.76 -2.849827692e+00 
2.78 -2.785146184e+00 
2.80 -2.720224359e+00 
2.82 -2.655235247e+00 
2.84 -2.590353076e+00 
2.86 -2.525754006e+00 
2.88 -2.461616860e+00 
2.90 -2.398117592e+00 
2.92 -2.335435191e+00 
2.94 -2.273687152e+00 
2.96 -2.212228676e+00 
2.98 -2.150900315e+00 
3.00 -2.089746106e+00 
3.02 -2.028944483e+00 
3.04 -1.968975539e+00 
3.06 -1.909910735e+00 
3.08 -1.851790170e+00 
3.10 -1.794652160e+00 
3.12 -1.738533231e+00 
3.14 -1.683468286e+00 
3.16 -1.629490632e+00 
3.18 -1.576632020e+00 
3.20 -1.524922736e+00 
3.22 -1.474391617e+00 
3.24 -1.425065876e+00 
3.26 -1.376971580e+00 
3.28 -1.330135263e+00 
3.30 -1.284583175e+00 
3.32 -1.240340444e+00 
3.34 -1.197431018e+00 
3.36 -1.155877864e+00 
3.38 -1.115702861e+00 
3.40 -1.076926841e+00 
3.42 -1.039569403e+00 
3.44 -1.003649428e+00 
3.46 -9.691846470e-01 
3.48 -9.361918234e-01 
3.50 -9.046866988e-01 
3.52 -8.746713101e-01 
3.54 -8.460967874e-01 
3.56 -8.189004131e-01 
3.58 -7.930179917e-01 
3.60 -7.683853818e-01 
3.62 -7.449366643e-01 
3.64 -7.226044878e-01 
3.66 -7.013218549e-01 
3.68 -6.810201075e-01 
3.70 -6.616297213e-01 
3.72 -6.430806277e-01 
3.74 -6.253017436e-01 
3.76 -6.082196840e-01 
3.78 -5.917598697e-01 
3.80 -5.758605841e-01 
3.82 -5.604513327e-01 
3.84 -5.454161657e-01 
3.86 -5.308297953e-01 
3.88 -5.163456252e-01 
3.90 -5.021211633e-01 
3.92 -4.877857874e-01 
3.94 -4.734362571e-01 
3.96 -4.591694578e-01 
3.98 -4.450577726e-01 
4.00 -4.311443667e-01 
4.02 -4.174656786e-01 
4.04 -4.040957460e-01 
4.06 -3.910780394e-01 
4.08 -3.785343896e-01 
4.10 -3.665343699e-01 
4.12 -3.551007198e-01 
4.14 -3.442403009e-01 
4.16 -3.338135742e-01 
4.18 -3.232502674e-01 
4.20 -3.124815385e-01 
4.22 -3.015026579e-01 
4.24 -2.903411858e-01 
4.26 -2.790326214e-01 
4.28 -2.676123000e-01 
4.30 -2.561153917e-01 
4.32 -2.445768965e-01 
4.34 -2.330316344e-01 
4.36 -2.215142397e-01 
4.38 -2.100592190e-01 
4.40 -1.987009146e-01 
4.42 -1.874734107e-01 
4.44 -1.764102815e-01 
4.46 -1.655453868e-01 
4.48 -1.549132197e-01 
4.50 -1.445440006e-01 
4.52 -1.344647400e-01 
4.54 -1.246629695e-01 
4.56 -1.149937864e-01 
4.58 -1.056048674e-01 
4.60 -9.728504940e-02 
4.62 -8.959822608e-02 
4.64 -8.036652577e-02 
4.66 -6.864674723e-02 
4.68 -5.547329624e-02 
4.70 -4.314148072e-02 
4.72 -3.292822268e-02 
4.74 -2.532267113e-02 
4.76 -2.037060182e-02 
4.78 -1.795156649e-02 
4.80 -1.764515703e-02 
4.82 -1.770084871e-02 
4.84 -1.785569366e-02 
4.86 -1.809505459e-02 
4.88 -1.840429423e-02 
4.90 -1.876877532e-02 
4.92 -1.917386056e-02 
4.94 -1.960491270e-02 
4.96 -2.004729445e-02 
4.98 -2.048636854e-02 
5.00 -2.090749768e-02 
5.02 -2.129870141e-02 
5.04 -2.165862620e-02 
5.06 -2.198857536e-02 
5.08 -2.228985218e-02 
5.10 -2.256375994e-02 
5.12 -2.281160194e-02 
5.14 -2.303468145e-02 
5.16 -2.323430178e-02 
5.18 -2.341176621e-02 
5.20 -2.356837802e-02 
5.22 -2.370544051e-02 
5.24 -2.382425696e-02 
5.26 -2.392613067e-02 
5.28 -2.401236491e-02 
5.30 -2.408426298e-02 
5.32 -2.414312817e-02 
5.34 -2.419026376e-02 
5.36 -2.422697305e-02 
5.38 -2.425455932e-02 
5.40 -2.427432586e-02 
5.42 -2.428757596e-02 
5.44 -2.429561290e-02 
5.46 -2.429973998e-02 
5.48 -2.430126049e-02 
5.50 -2.430147770e-02 
5.52 -2.430147770e-02 
5.54 -2.430147770e-02 
5.56 -2.430147770e-02 
5.58 -2.430147770e-02 
5.60 -2.430147770e-02 
5.62 -2.430147770e-02 
5.64 -2.430147770e-02 
5.66 -2.430147770e-02 
5.68 -2.430147770e-02 
5.70 -2.430147770e-02 
5.72 -2.430147770e-02 
5.74 -2.430147770e-02 
5.76 -2.430147770e-02 
5.78 -2.430147770e-02 
5.80 -2.430147770e-02 
5.82 -2.430147770e-02 
5.84 -2.430147770e-02 
5.86 -2.430147770e-02 
5.88 -2.430147770e-02 
5.90 -2.430147770e-02 
5.92 -2.430147770e-02 
5.94 -2.430147770e-02 
5.96 -2.430147770e-02 
5.98 -2.430147770e-02 
6.00 -2.430147770e-02