# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2018--Farkas-D-Caro-A--Fe-Ni-Cr-Co-Cu
# implementation = 2018--Farkas-D--Fe-Ni-Cr-Co-Cu--LAMMPS--ipr2
# composition = Cr2Ni
# 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 -3.957699697e+02 
0.92 -3.676643997e+02 
0.94 -3.418572571e+02 
0.96 -3.180523838e+02 
0.98 -2.961720826e+02 
1.00 -2.760958841e+02 
1.02 -2.575301627e+02 
1.04 -2.402225977e+02 
1.06 -2.241011259e+02 
1.08 -2.092374804e+02 
1.10 -1.955540513e+02 
1.12 -1.828658890e+02 
1.14 -1.710471252e+02 
1.16 -1.599995243e+02 
1.18 -1.497266778e+02 
1.20 -1.402927539e+02 
1.22 -1.316960074e+02 
1.24 -1.238537458e+02 
1.26 -1.166251924e+02 
1.28 -1.098807713e+02 
1.30 -1.035079886e+02 
1.32 -9.743585104e+01 
1.34 -9.161006955e+01 
1.36 -8.598846407e+01 
1.38 -8.054913192e+01 
1.40 -7.527443497e+01 
1.42 -7.010570445e+01 
1.44 -6.497335379e+01 
1.46 -5.983536910e+01 
1.48 -5.467422155e+01 
1.50 -4.948088648e+01 
1.52 -4.426086953e+01 
1.54 -3.903147691e+01 
1.56 -3.381471318e+01 
1.58 -2.863104596e+01 
1.60 -2.350919432e+01 
1.62 -1.849511043e+01 
1.64 -1.364780971e+01 
1.66 -9.277731677e+00 
1.68 -6.122414706e+00 
1.70 -3.966849081e+00 
1.72 -2.540368992e+00 
1.74 -1.631398105e+00 
1.76 -1.079455514e+00 
1.78 -7.627849688e-01 
1.80 -5.907620827e-01 
1.82 -4.995958215e-01 
1.84 -4.528323886e-01 
1.86 -4.571518760e-01 
1.88 -5.201307412e-01 
1.90 -6.351985558e-01 
1.92 -7.927559805e-01 
1.94 -9.794959657e-01 
1.96 -1.181945856e+00 
1.98 -1.391305747e+00 
2.00 -1.601265902e+00 
2.02 -1.807329415e+00 
2.04 -2.006774731e+00 
2.06 -2.198380069e+00 
2.08 -2.381617414e+00 
2.10 -2.555831344e+00 
2.12 -2.720795434e+00 
2.14 -2.875922303e+00 
2.16 -3.019966983e+00 
2.18 -3.151081182e+00 
2.20 -3.266239813e+00 
2.22 -3.363405065e+00 
2.24 -3.443044861e+00 
2.26 -3.506388200e+00 
2.28 -3.554900338e+00 
2.30 -3.590304300e+00 
2.32 -3.614589824e+00 
2.34 -3.629463818e+00 
2.36 -3.636315953e+00 
2.38 -3.636264087e+00 
2.40 -3.630044346e+00 
2.42 -3.618256830e+00 
2.44 -3.601566792e+00 
2.46 -3.580685033e+00 
2.48 -3.556417646e+00 
2.50 -3.529569742e+00 
2.52 -3.500310572e+00 
2.54 -3.468368931e+00 
2.56 -3.433383391e+00 
2.58 -3.395064355e+00 
2.60 -3.353436877e+00 
2.62 -3.308639297e+00 
2.64 -3.260838186e+00 
2.66 -3.210053044e+00 
2.68 -3.156038377e+00 
2.70 -3.098561241e+00 
2.72 -3.037470143e+00 
2.74 -2.972701925e+00 
2.76 -2.904309617e+00 
2.78 -2.832534436e+00 
2.80 -2.757864718e+00 
2.82 -2.680886207e+00 
2.84 -2.602109669e+00 
2.86 -2.521852254e+00 
2.88 -2.440270177e+00 
2.90 -2.357620548e+00 
2.92 -2.274297196e+00 
2.94 -2.190511410e+00 
2.96 -2.106378052e+00 
2.98 -2.022099889e+00 
3.00 -1.937982886e+00 
3.02 -1.854416065e+00 
3.04 -1.771835195e+00 
3.06 -1.690571298e+00 
3.08 -1.610758783e+00 
3.10 -1.532536679e+00 
3.12 -1.456245724e+00 
3.14 -1.382213514e+00 
3.16 -1.310715931e+00 
3.18 -1.241964025e+00 
3.20 -1.176039042e+00 
3.22 -1.112949416e+00 
3.24 -1.052689347e+00 
3.26 -9.952332299e-01 
3.28 -9.405392405e-01 
3.30 -8.885462821e-01 
3.32 -8.391648407e-01 
3.34 -7.922662236e-01 
3.36 -7.476930050e-01 
3.38 -7.052553211e-01 
3.40 -6.647670973e-01 
3.42 -6.261550666e-01 
3.44 -5.893562546e-01 
3.46 -5.543069353e-01 
3.48 -5.209532364e-01 
3.50 -4.892561919e-01 
3.52 -4.591924635e-01 
3.54 -4.307523149e-01 
3.56 -4.039351851e-01 
3.58 -3.787037833e-01 
3.60 -3.549514600e-01 
3.62 -3.325664313e-01 
3.64 -3.114432684e-01 
3.66 -2.915060784e-01 
3.68 -2.726911577e-01 
3.70 -2.549372809e-01 
3.72 -2.381857011e-01 
3.74 -2.223801304e-01 
3.76 -2.074668690e-01 
3.78 -1.933945135e-01 
3.80 -1.801141596e-01 
3.82 -1.675791685e-01 
3.84 -1.557452371e-01 
3.86 -1.445718761e-01 
3.88 -1.340345778e-01 
3.90 -1.241162263e-01 
3.92 -1.147998646e-01 
3.94 -1.060634673e-01 
3.96 -9.785259470e-02 
3.98 -9.011913035e-02 
4.00 -8.283029928e-02 
4.02 -7.596433469e-02 
4.04 -6.950725313e-02 
4.06 -6.344982302e-02 
4.08 -5.778554750e-02 
4.10 -5.250865027e-02 
4.12 -4.761281318e-02 
4.14 -4.308008165e-02 
4.16 -3.887419736e-02 
4.18 -3.495281574e-02 
4.20 -3.117090183e-02 
4.22 -2.732994026e-02 
4.24 -2.327527841e-02 
4.26 -1.888807545e-02 
4.28 -1.408338558e-02 
4.30 -8.807881358e-03 
4.32 -3.037766302e-03 
4.34  3.223767129e-03 
4.36  9.948982391e-03 
4.38  1.708800289e-02 
4.40  2.457159054e-02 
4.42  3.231394409e-02 
4.44  4.021533466e-02 
4.46  4.816507134e-02 
4.48  5.604429972e-02 
4.50  6.372891973e-02 
4.52  7.109194675e-02 
4.54  7.800957201e-02 
4.56  8.438612768e-02 
4.58  9.014370584e-02 
4.60  9.521744261e-02 
4.62  9.955622542e-02 
4.64  1.031223396e-01 
4.66  1.058920632e-01 
4.68  1.078550631e-01 
4.70  1.090143969e-01 
4.72  1.093853727e-01 
4.74  1.089947457e-01 
4.76  1.078791729e-01 
4.78  1.060952411e-01 
4.80  1.037116396e-01 
4.82  1.007878961e-01 
4.84  9.738469630e-02 
4.86  9.356524151e-02 
4.88  8.939373033e-02 
4.90  8.493481006e-02 
4.92  8.025212978e-02 
4.94  7.540758414e-02 
4.96  7.046088728e-02 
4.98  6.546856594e-02 
5.00  6.048338594e-02 
5.02  5.555424808e-02 
5.04  5.072614164e-02 
5.06  4.604615784e-02 
5.08  4.156045966e-02 
5.10  3.730962652e-02 
5.12  3.332818056e-02 
5.14  2.964411649e-02 
5.16  2.627860439e-02 
5.18  2.324542730e-02 
5.20  2.055063108e-02 
5.22  1.819138917e-02 
5.24  1.615345713e-02 
5.26  1.441560622e-02 
5.28  1.295102949e-02 
5.30  1.172752213e-02 
5.32  1.070804460e-02 
5.34  9.852203344e-03 
5.36  9.118191167e-03 
5.38  8.465370919e-03 
5.40  7.857017438e-03 
5.42  7.262989090e-03 
5.44  6.661886586e-03 
5.46  6.042372818e-03 
5.48  5.403635263e-03 
5.50  4.754765167e-03 
5.52  4.113376182e-03 
5.54  3.497061078e-03 
5.56  2.912777874e-03 
5.58  2.368087241e-03 
5.60  1.871191614e-03 
5.62  1.429567128e-03 
5.64  1.048859473e-03 
5.66  7.321810904e-04 
5.68  4.798229477e-04 
5.70  2.891642800e-04 
5.72  1.548987873e-04 
5.74  6.928675939e-05 
5.76  2.262183076e-05 
5.78  3.640513587e-06 
5.80  1.420456003e-08 
5.82  0.000000000e+00 
5.84  0.000000000e+00 
5.86  0.000000000e+00 
5.88  0.000000000e+00 
5.90  0.000000000e+00 
5.92  0.000000000e+00 
5.94  0.000000000e+00 
5.96  0.000000000e+00 
5.98  0.000000000e+00 
6.00  0.000000000e+00