# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2004--Mishin-Y--Ni-Al
# implementation = 2004--Mishin-Y--Ni-Al--LAMMPS--ipr2
# 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  nan             
1.00  nan             
1.02  2.106614269e+02 
1.04  1.967464248e+02 
1.06  1.838159009e+02 
1.08  1.717837125e+02 
1.10  1.605740628e+02 
1.12  1.501196048e+02 
1.14  1.403613166e+02 
1.16  1.312484183e+02 
1.18  1.227368578e+02 
1.20  1.147861573e+02 
1.22  1.073568826e+02 
1.24  1.004111348e+02 
1.26  9.391278590e+01 
1.28  8.782906773e+01 
1.30  8.213258602e+01 
1.32  7.682696463e+01 
1.34  7.189290612e+01 
1.36  6.729535018e+01 
1.38  6.265276837e+01 
1.40  5.789924822e+01 
1.42  5.322431783e+01 
1.44  4.876493630e+01 
1.46  4.460606401e+01 
1.48  4.074399794e+01 
1.50  3.715547812e+01 
1.52  3.382028452e+01 
1.54  3.072158470e+01 
1.56  2.784505460e+01 
1.58  2.517782721e+01 
1.60  2.270753687e+01 
1.62  2.042222136e+01 
1.64  1.831109611e+01 
1.66  1.636443631e+01 
1.68  1.457273853e+01 
1.70  1.292651411e+01 
1.72  1.141631060e+01 
1.74  1.003262004e+01 
1.76  8.766110209e+00 
1.78  7.607980341e+00 
1.80  6.549905258e+00 
1.82  5.583795183e+00 
1.84  4.701738832e+00 
1.86  3.896237092e+00 
1.88  3.160371625e+00 
1.90  2.487567047e+00 
1.92  1.871491137e+00 
1.94  1.306271841e+00 
1.96  7.869295736e-01 
1.98  3.094105888e-01 
2.00 -1.296276819e-01 
2.02 -5.330856580e-01 
2.04 -9.035574248e-01 
2.06 -1.243386289e+00 
2.08 -1.554688213e+00 
2.10 -1.839383464e+00 
2.12 -2.099245096e+00 
2.14 -2.335925905e+00 
2.16 -2.550973376e+00 
2.18 -2.745843092e+00 
2.20 -2.921927890e+00 
2.22 -3.080499054e+00 
2.24 -3.222638304e+00 
2.26 -3.349246002e+00 
2.28 -3.461107620e+00 
2.30 -3.558964323e+00 
2.32 -3.643524747e+00 
2.34 -3.715464417e+00 
2.36 -3.775420772e+00 
2.38 -3.823984636e+00 
2.40 -3.861695202e+00 
2.42 -3.889082989e+00 
2.44 -3.906711278e+00 
2.46 -3.915176289e+00 
2.48 -3.915102105e+00 
2.50 -3.907133989e+00 
2.52 -3.891931055e+00 
2.54 -3.870159179e+00 
2.56 -3.842485173e+00 
2.58 -3.809573164e+00 
2.60 -3.772082161e+00 
2.62 -3.730637823e+00 
2.64 -3.685812006e+00 
2.66 -3.638127484e+00 
2.68 -3.588036987e+00 
2.70 -3.535929207e+00 
2.72 -3.482158864e+00 
2.74 -3.427051807e+00 
2.76 -3.370898855e+00 
2.78 -3.313957518e+00 
2.80 -3.256455130e+00 
2.82 -3.198592935e+00 
2.84 -3.140551397e+00 
2.86 -3.082497644e+00 
2.88 -3.024595469e+00 
2.90 -2.967007093e+00 
2.92 -2.909866152e+00 
2.94 -2.853263553e+00 
2.96 -2.797250706e+00 
2.98 -2.741843337e+00 
3.00 -2.687026202e+00 
3.02 -2.632760205e+00 
3.04 -2.578991431e+00 
3.06 -2.525661324e+00 
3.08 -2.472717157e+00 
3.10 -2.420121967e+00 
3.12 -2.367863349e+00 
3.14 -2.315960740e+00 
3.16 -2.264471140e+00 
3.18 -2.213493251e+00 
3.20 -2.163166710e+00 
3.22 -2.113659040e+00 
3.24 -2.065133669e+00 
3.26 -2.017735983e+00 
3.28 -1.971592365e+00 
3.30 -1.926810179e+00 
3.32 -1.883478307e+00 
3.34 -1.841668106e+00 
3.36 -1.801434707e+00 
3.38 -1.762818689e+00 
3.40 -1.725849978e+00 
3.42 -1.690549837e+00 
3.44 -1.656917809e+00 
3.46 -1.624925599e+00 
3.48 -1.594519309e+00 
3.50 -1.565621862e+00 
3.52 -1.538135300e+00 
3.54 -1.511945373e+00 
3.56 -1.486932886e+00 
3.58 -1.462979251e+00 
3.60 -1.439968021e+00 
3.62 -1.417786119e+00 
3.64 -1.396324914e+00 
3.66 -1.375481092e+00 
3.68 -1.355157382e+00 
3.70 -1.335263102e+00 
3.72 -1.315714595e+00 
3.74 -1.296435504e+00 
3.76 -1.277356950e+00 
3.78 -1.258417600e+00 
3.80 -1.239563639e+00 
3.82 -1.220748665e+00 
3.84 -1.201933515e+00 
3.86 -1.183086023e+00 
3.88 -1.164180738e+00 
3.90 -1.145198392e+00 
3.92 -1.126124618e+00 
3.94 -1.106949077e+00 
3.96 -1.087664967e+00 
3.98 -1.068268546e+00 
4.00 -1.048758635e+00 
4.02 -1.029136131e+00 
4.04 -1.009403508e+00 
4.06 -9.895643440e-01 
4.08 -9.696228250e-01 
4.10 -9.495832978e-01 
4.12 -9.294498041e-01 
4.14 -9.092258622e-01 
4.16 -8.889159154e-01 
4.18 -8.685266016e-01 
4.20 -8.480667040e-01 
4.22 -8.275469981e-01 
4.24 -8.069800963e-01 
4.26 -7.863802674e-01 
4.28 -7.657632678e-01 
4.30 -7.451461552e-01 
4.32 -7.245471054e-01 
4.34 -7.039852239e-01 
4.36 -6.834803497e-01 
4.38 -6.630528575e-01 
4.40 -6.427234630e-01 
4.42 -6.225130475e-01 
4.44 -6.024424598e-01 
4.46 -5.825323948e-01 
4.48 -5.628034343e-01 
4.50 -5.432760796e-01 
4.52 -5.239704780e-01 
4.54 -5.049061604e-01 
4.56 -4.861024876e-01 
4.58 -4.675777477e-01 
4.60 -4.493498607e-01 
4.62 -4.314351699e-01 
4.64 -4.138500280e-01 
4.66 -3.966095479e-01 
4.68 -3.797284125e-01 
4.70 -3.632167197e-01 
4.72 -3.470852398e-01 
4.74 -3.313462195e-01 
4.76 -3.160125704e-01 
4.78 -3.010960651e-01 
4.80 -2.865979113e-01 
4.82 -2.725112884e-01 
4.84 -2.588346466e-01 
4.86 -2.455721657e-01 
4.88 -2.327415080e-01 
4.90 -2.203593051e-01 
4.92 -2.084366382e-01 
4.94 -1.969860873e-01 
4.96 -1.859818014e-01 
4.98 -1.753946349e-01 
5.00 -1.651936506e-01 
5.02 -1.553594698e-01 
5.04 -1.458835952e-01 
5.06 -1.367621726e-01 
5.08 -1.279948597e-01 
5.10 -1.195832476e-01 
5.12 -1.115297858e-01 
5.14 -1.038370282e-01 
5.16 -9.650715295e-02 
5.18 -8.954269282e-02 
5.20 -8.294514630e-02 
5.22 -7.671037369e-02 
5.24 -7.083335157e-02 
5.26 -6.530809698e-02 
5.28 -6.012429597e-02 
5.30 -5.525895893e-02 
5.32 -5.071518792e-02 
5.34 -4.649252227e-02 
5.36 -4.258388431e-02 
5.38 -3.897777031e-02 
5.40 -3.565995508e-02 
5.42 -3.261471918e-02 
5.44 -2.982549655e-02 
5.46 -2.727575436e-02 
5.48 -2.494917425e-02 
5.50 -2.283003377e-02 
5.52 -2.090273551e-02 
5.54 -1.915302126e-02 
5.56 -1.756784210e-02 
5.58 -1.613480767e-02 
5.60 -1.484021615e-02 
5.62 -1.367061846e-02 
5.64 -1.261620467e-02 
5.66 -1.167104189e-02 
5.68 -1.083230253e-02 
5.70 -1.008718265e-02 
5.72 -9.418212229e-03 
5.74 -8.804447412e-03 
5.76 -8.238634187e-03 
5.78 -7.720452823e-03 
5.80 -7.270581368e-03 
5.82 -6.894632333e-03 
5.84 -6.611847152e-03 
5.86 -6.412804084e-03 
5.88 -6.249486247e-03 
5.90 -6.089748278e-03 
5.92 -5.911530578e-03 
5.94 -5.694650120e-03 
5.96 -5.431773430e-03 
5.98 -5.125818494e-03 
6.00 -4.782382797e-03