# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2009--Do-E-C-Shin-Y-H-Lee-B-J--Ga-N
# implementation = 2009--Do-E-C--Ga-N--LAMMPS--ipr1
# composition = GaN2
# 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  5.819324086e+02 
0.80  5.355870334e+02 
0.82  4.925497266e+02 
0.84  4.526029631e+02 
0.86  4.155464754e+02 
0.88  3.811948667e+02 
0.90  3.493755088e+02 
0.92  3.199267688e+02 
0.94  2.926965697e+02 
0.96  2.675412694e+02 
0.98  2.443248207e+02 
1.00  2.229181649e+02 
1.02  2.031988074e+02 
1.04  1.850505257e+02 
1.06  1.683631664e+02 
1.08  1.530324945e+02 
1.10  1.389600678e+02 
1.12  1.260531145e+02 
1.14  1.142244044e+02 
1.16  1.033921025e+02 
1.18  9.347960434e+01 
1.20  8.441535274e+01 
1.22  7.613263681e+01 
1.24  6.856937757e+01 
1.26  6.166790327e+01 
1.28  5.537471843e+01 
1.30  4.964026988e+01 
1.32  4.441871364e+01 
1.34  3.966768440e+01 
1.36  3.534807106e+01 
1.38  3.142379889e+01 
1.40  2.786162071e+01 
1.42  2.463091715e+01 
1.44  2.170350732e+01 
1.46  1.905346970e+01 
1.48  1.665697366e+01 
1.50  1.449212140e+01 
1.52  1.253880014e+01 
1.54  1.077854431e+01 
1.56  9.194407133e+00 
1.58  7.770841559e+00 
1.60  6.493589566e+00 
1.62  5.349579859e+00 
1.64  4.326833055e+00 
1.66  3.414374169e+00 
1.68  2.602151732e+00 
1.70  1.880963184e+00 
1.72  1.242386087e+00 
1.74  6.787146816e-01 
1.76  1.829015087e-01 
1.78 -2.514964342e-01 
1.80 -6.303671703e-01 
1.82 -9.590893622e-01 
1.84 -1.242574210e+00 
1.86 -1.485304051e+00 
1.88 -1.691367819e+00 
1.90 -1.864493670e+00 
1.92 -2.008078974e+00 
1.94 -2.125217878e+00 
1.96 -2.218726653e+00 
1.98 -2.291166972e+00 
2.00 -2.344867320e+00 
2.02 -2.381942638e+00 
2.04 -2.404312403e+00 
2.06 -2.413717203e+00 
2.08 -2.411733986e+00 
2.10 -2.399790048e+00 
2.12 -2.379175880e+00 
2.14 -2.351056970e+00 
2.16 -2.316484622e+00 
2.18 -2.276405902e+00 
2.20 -2.231672751e+00 
2.22 -2.183050353e+00 
2.24 -2.131224804e+00 
2.26 -2.076810157e+00 
2.28 -2.020354866e+00 
2.30 -1.962347703e+00 
2.32 -1.903223177e+00 
2.34 -1.843366497e+00 
2.36 -1.783118123e+00 
2.38 -1.722777921e+00 
2.40 -1.662608981e+00 
2.42 -1.602841096e+00 
2.44 -1.543673956e+00 
2.46 -1.485280055e+00 
2.48 -1.427807361e+00 
2.50 -1.371381742e+00 
2.52 -1.316109190e+00 
2.54 -1.262077846e+00 
2.56 -1.209359845e+00 
2.58 -1.158013003e+00 
2.60 -1.108082347e+00 
2.62 -1.059601510e+00 
2.64 -1.012594006e+00 
2.66 -9.670743745e-01 
2.68 -9.230492346e-01 
2.70 -8.805182313e-01 
2.72 -8.394748981e-01 
2.74 -7.999074355e-01 
2.76 -7.617994167e-01 
2.78 -7.251304241e-01 
2.80 -6.898766238e-01 
2.82 -6.560112835e-01 
2.84 -6.235052375e-01 
2.86 -5.923273055e-01 
2.88 -5.624446669e-01 
2.90 -5.338231963e-01 
2.92 -5.064277633e-01 
2.94 -4.802224988e-01 
2.96 -4.551710318e-01 
2.98 -4.312366997e-01 
3.00 -4.083827332e-01 
3.02 -3.865724194e-01 
3.04 -3.657692445e-01 
3.06 -3.459370182e-01 
3.08 -3.270399816e-01 
3.10 -3.090428998e-01 
3.12 -2.919111420e-01 
3.14 -2.756107480e-01 
3.16 -2.601084846e-01 
3.18 -2.453718924e-01 
3.20 -2.313693232e-01 
3.22 -2.180699697e-01 
3.24 -2.054438884e-01 
3.26 -1.934620158e-01 
3.28 -1.820961796e-01 
3.30 -1.713191042e-01 
3.32 -1.611044130e-01 
3.34 -1.514266254e-01 
3.36 -1.422611516e-01 
3.38 -1.335842845e-01 
3.40 -1.253731877e-01 
3.42 -1.176058835e-01 
3.44 -1.102612368e-01 
3.46 -1.033189391e-01 
3.48 -9.675949046e-02 
3.50 -9.056418045e-02 
3.52 -8.471506825e-02 
3.54 -7.919496210e-02 
3.56 -7.398739831e-02 
3.58 -6.907661968e-02 
3.60 -6.444755390e-02 
3.62 -6.008579170e-02 
3.64 -5.597756503e-02 
3.66 -5.210972525e-02 
3.68 -4.846972156e-02 
3.70 -4.504557956e-02 
3.72 -4.182588013e-02 
3.74 -3.879973865e-02 
3.76 -3.595678451e-02 
3.78 -3.328714114e-02 
3.80 -3.078140639e-02 
3.82 -2.843063342e-02 
3.84 -2.622631205e-02 
3.86 -2.416035061e-02 
3.88 -2.222505833e-02 
3.90 -2.041312821e-02 
3.92 -1.932511286e-02 
3.94 -2.621373363e-02 
3.96 -5.290963836e-02 
3.98 -7.426888195e-02 
4.00 -1.138250498e-22 
4.02  0.000000000e+00 
4.04  0.000000000e+00 
4.06  0.000000000e+00 
4.08  0.000000000e+00 
4.10  0.000000000e+00 
4.12  0.000000000e+00 
4.14  0.000000000e+00 
4.16  0.000000000e+00 
4.18  0.000000000e+00 
4.20  0.000000000e+00 
4.22  0.000000000e+00 
4.24  0.000000000e+00 
4.26  0.000000000e+00 
4.28  0.000000000e+00 
4.30  0.000000000e+00 
4.32  0.000000000e+00 
4.34  0.000000000e+00 
4.36  0.000000000e+00 
4.38  0.000000000e+00 
4.40  0.000000000e+00 
4.42  0.000000000e+00 
4.44  0.000000000e+00 
4.46  0.000000000e+00 
4.48  0.000000000e+00 
4.50  0.000000000e+00 
4.52  0.000000000e+00 
4.54  0.000000000e+00 
4.56  0.000000000e+00 
4.58  0.000000000e+00 
4.60  0.000000000e+00 
4.62  0.000000000e+00 
4.64  0.000000000e+00 
4.66  0.000000000e+00 
4.68  0.000000000e+00 
4.70  0.000000000e+00 
4.72  0.000000000e+00 
4.74  0.000000000e+00 
4.76  0.000000000e+00 
4.78  0.000000000e+00 
4.80  0.000000000e+00 
4.82  0.000000000e+00 
4.84  0.000000000e+00 
4.86  0.000000000e+00 
4.88  0.000000000e+00 
4.90  0.000000000e+00 
4.92  0.000000000e+00 
4.94  0.000000000e+00 
4.96  0.000000000e+00 
4.98  0.000000000e+00 
5.00  0.000000000e+00 
5.02  0.000000000e+00 
5.04  0.000000000e+00 
5.06  0.000000000e+00 
5.08  0.000000000e+00 
5.10  0.000000000e+00 
5.12  0.000000000e+00 
5.14  0.000000000e+00 
5.16  0.000000000e+00 
5.18  0.000000000e+00 
5.20  0.000000000e+00 
5.22  0.000000000e+00 
5.24  0.000000000e+00 
5.26  0.000000000e+00 
5.28  0.000000000e+00 
5.30  0.000000000e+00 
5.32  0.000000000e+00 
5.34  0.000000000e+00 
5.36  0.000000000e+00 
5.38  0.000000000e+00 
5.40  0.000000000e+00 
5.42  0.000000000e+00 
5.44  0.000000000e+00 
5.46  0.000000000e+00 
5.48  0.000000000e+00 
5.50  0.000000000e+00 
5.52  0.000000000e+00 
5.54  0.000000000e+00 
5.56  0.000000000e+00 
5.58  0.000000000e+00 
5.60  0.000000000e+00 
5.62  0.000000000e+00 
5.64  0.000000000e+00 
5.66  0.000000000e+00 
5.68  0.000000000e+00 
5.70  0.000000000e+00 
5.72  0.000000000e+00 
5.74  0.000000000e+00 
5.76  0.000000000e+00 
5.78  0.000000000e+00 
5.80  0.000000000e+00 
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