# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2012--Mendelev-M-I-Kramer-M-J-Hao-S-G-et-al--Ni-Zr
# implementation = 2012--Mendelev-M-I--Ni-Zr--LAMMPS--ipr1
# composition = Ni2Zr
# 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  nan             
1.04  nan             
1.06  nan             
1.08  nan             
1.10  3.402789210e+04 
1.12  3.019066605e+04 
1.14  2.662132548e+04 
1.16  2.329780487e+04 
1.18  2.019954546e+04 
1.20  1.730753654e+04 
1.22  1.460414846e+04 
1.24  1.207322853e+04 
1.26  9.830907769e+03 
1.28  8.025184756e+03 
1.30  6.568968229e+03 
1.32  5.391009493e+03 
1.34  4.435190327e+03 
1.36  3.657289987e+03 
1.38  3.022419282e+03 
1.40  2.502845017e+03 
1.42  2.076393009e+03 
1.44  1.725352211e+03 
1.46  1.435453073e+03 
1.48  1.195239310e+03 
1.50  9.955157632e+02 
1.52  8.288690347e+02 
1.54  6.892893361e+02 
1.56  5.719004539e+02 
1.58  4.733142147e+02 
1.60  3.917915674e+02 
1.62  3.243604739e+02 
1.64  2.685155288e+02 
1.66  2.222465767e+02 
1.68  1.839307239e+02 
1.70  1.521757977e+02 
1.72  1.258326478e+02 
1.74  1.039489726e+02 
1.76  8.573750665e+01 
1.78  7.055333824e+01 
1.80  5.787187154e+01 
1.82  4.726921714e+01 
1.84  3.840439232e+01 
1.86  3.100097441e+01 
1.88  2.482835032e+01 
1.90  1.969243784e+01 
1.92  1.542862105e+01 
1.94  1.189733390e+01 
1.96  8.980456426e+00 
1.98  6.577962504e+00 
2.00  4.604654415e+00 
2.02  2.983449135e+00 
2.04  1.646271271e+00 
2.06  5.378930121e-01 
2.08 -3.873478670e-01 
2.10 -1.165750200e+00 
2.12 -1.824989851e+00 
2.14 -2.385925146e+00 
2.16 -2.863832225e+00 
2.18 -3.269005122e+00 
2.20 -3.607113921e+00 
2.22 -3.881616807e+00 
2.24 -4.097898926e+00 
2.26 -4.264064657e+00 
2.28 -4.388741912e+00 
2.30 -4.480331168e+00 
2.32 -4.546796150e+00 
2.34 -4.595562680e+00 
2.36 -4.633342329e+00 
2.38 -4.665754904e+00 
2.40 -4.697065375e+00 
2.42 -4.729986048e+00 
2.44 -4.765646305e+00 
2.46 -4.803717054e+00 
2.48 -4.842656977e+00 
2.50 -4.880038163e+00 
2.52 -4.913047529e+00 
2.54 -4.939221079e+00 
2.56 -4.957136796e+00 
2.58 -4.966015366e+00 
2.60 -4.965654632e+00 
2.62 -4.956275425e+00 
2.64 -4.938005217e+00 
2.66 -4.911008541e+00 
2.68 -4.875729859e+00 
2.70 -4.833096863e+00 
2.72 -4.784962350e+00 
2.74 -4.733665230e+00 
2.76 -4.680412450e+00 
2.78 -4.625172844e+00 
2.80 -4.568585258e+00 
2.82 -4.512755083e+00 
2.84 -4.460145006e+00 
2.86 -4.412260104e+00 
2.88 -4.369373219e+00 
2.90 -4.330656090e+00 
2.92 -4.294960770e+00 
2.94 -4.261139232e+00 
2.96 -4.228135053e+00 
2.98 -4.195075613e+00 
3.00 -4.161372632e+00 
3.02 -4.126828798e+00 
3.04 -4.091773818e+00 
3.06 -4.056863344e+00 
3.08 -4.022724343e+00 
3.10 -3.989876191e+00 
3.12 -3.958705049e+00 
3.14 -3.929450083e+00 
3.16 -3.902199377e+00 
3.18 -3.876893913e+00 
3.20 -3.853338092e+00 
3.22 -3.831215387e+00 
3.24 -3.810107834e+00 
3.26 -3.789518163e+00 
3.28 -3.768893514e+00 
3.30 -3.747649762e+00 
3.32 -3.725195864e+00 
3.34 -3.700957967e+00 
3.36 -3.674401610e+00 
3.38 -3.645051423e+00 
3.40 -3.612508086e+00 
3.42 -3.576462183e+00 
3.44 -3.536704696e+00 
3.46 -3.493132095e+00 
3.48 -3.445743938e+00 
3.50 -3.394639791e+00 
3.52 -3.340014148e+00 
3.54 -3.282148152e+00 
3.56 -3.221398494e+00 
3.58 -3.158183950e+00 
3.60 -3.092970155e+00 
3.62 -3.026253290e+00 
3.64 -2.958543478e+00 
3.66 -2.890348801e+00 
3.68 -2.822160935e+00 
3.70 -2.754446947e+00 
3.72 -2.687654610e+00 
3.74 -2.622202405e+00 
3.76 -2.558459379e+00 
3.78 -2.496727164e+00 
3.80 -2.437225380e+00 
3.82 -2.380081292e+00 
3.84 -2.325324686e+00 
3.86 -2.272888961e+00 
3.88 -2.222619521e+00 
3.90 -2.174290617e+00 
3.92 -2.127631823e+00 
3.94 -2.082365451e+00 
3.96 -2.038256206e+00 
3.98 -1.995173463e+00 
4.00 -1.953103899e+00 
4.02 -1.912033415e+00 
4.04 -1.871924885e+00 
4.06 -1.832739922e+00 
4.08 -1.794439492e+00 
4.10 -1.756982244e+00 
4.12 -1.720322780e+00 
4.14 -1.684409854e+00 
4.16 -1.649184478e+00 
4.18 -1.614579857e+00 
4.20 -1.580533066e+00 
4.22 -1.546992331e+00 
4.24 -1.513915072e+00 
4.26 -1.481265775e+00 
4.28 -1.449014244e+00 
4.30 -1.417134174e+00 
4.32 -1.385602023e+00 
4.34 -1.354396140e+00 
4.36 -1.323496109e+00 
4.38 -1.292882297e+00 
4.40 -1.262535552e+00 
4.42 -1.232437047e+00 
4.44 -1.202568227e+00 
4.46 -1.172910846e+00 
4.48 -1.143447076e+00 
4.50 -1.114159641e+00 
4.52 -1.085032010e+00 
4.54 -1.056048610e+00 
4.56 -1.027194974e+00 
4.58 -9.984580104e-01 
4.60 -9.698261175e-01 
4.62 -9.412893470e-01 
4.64 -9.128395869e-01 
4.66 -8.844706314e-01 
4.68 -8.561783098e-01 
4.70 -8.279609937e-01 
4.72 -7.998199636e-01 
4.74 -7.717595559e-01 
4.76 -7.437872773e-01 
4.78 -7.159139415e-01 
4.80 -6.881534976e-01 
4.82 -6.605228802e-01 
4.84 -6.330416021e-01 
4.86 -6.057337182e-01 
4.88 -5.786244811e-01 
4.90 -5.517393003e-01 
4.92 -5.251139376e-01 
4.94 -4.987697519e-01 
4.96 -4.727570522e-01 
4.98 -4.470766591e-01 
5.00 -4.218164899e-01 
5.02 -3.966762677e-01 
5.04 -3.719157220e-01 
5.06 -3.484509121e-01 
5.08 -3.270487779e-01 
5.10 -3.067444942e-01 
5.12 -2.853004758e-01 
5.14 -2.619100054e-01 
5.16 -2.372550730e-01 
5.18 -2.120588648e-01 
5.20 -1.861270062e-01 
5.22 -1.596261562e-01 
5.24 -1.331182475e-01 
5.26 -1.076511219e-01 
5.28 -8.477374416e-02 
5.30 -6.524593763e-02 
5.32 -4.924868560e-02 
5.34 -3.663640051e-02 
5.36 -2.709842622e-02 
5.38 -2.025685755e-02 
5.40 -1.572138303e-02 
5.42 -1.311651669e-02 
5.44 -1.209222296e-02 
5.46 -1.232547470e-02 
5.48 -1.351762394e-02 
5.50 -1.539050254e-02 
5.52 -1.768436113e-02 
5.54 -2.017234995e-02 
5.56 -2.267588901e-02 
5.58 -2.506530934e-02 
5.60 -2.725974095e-02 
5.62 -2.922585051e-02 
5.64 -3.095962101e-02 
5.66 -3.246692299e-02 
5.68 -3.376040957e-02 
5.70 -3.485819007e-02 
5.72 -3.578262347e-02 
5.74 -3.655922598e-02 
5.76 -3.721568714e-02 
5.78 -3.778098891e-02 
5.80 -3.828462225e-02 
5.82 -3.875589619e-02 
5.84 -3.922333400e-02 
5.86 -3.971415147e-02 
5.88 -4.025381253e-02 
5.90 -4.086565727e-02 
5.92 -4.157059776e-02 
5.94 -4.238687717e-02 
5.96 -4.332988762e-02 
5.98 -4.441204262e-02 
6.00 -4.564269982e-02