# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2006--Bere-A-Serra-A--Ga-N
# implementation = 2006--Bere-A--Ga-N--LAMMPS--ipr1
# composition = Ga2N
# 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 2024-11-27

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  1.212907422e+04 
0.72  1.019635787e+04 
0.74  8.602423506e+03 
0.76  7.286740189e+03 
0.78  6.202114035e+03 
0.80  5.311271694e+03 
0.82  4.576826389e+03 
0.84  3.961634179e+03 
0.86  3.438140100e+03 
0.88  2.990893243e+03 
0.90  2.608558047e+03 
0.92  2.279957357e+03 
0.94  1.994534308e+03 
0.96  1.743405000e+03 
0.98  1.521253508e+03 
1.00  1.326123788e+03 
1.02  1.156693467e+03 
1.04  1.011148752e+03 
1.06  8.870851404e+02 
1.08  7.815550147e+02 
1.10  6.912723939e+02 
1.12  6.130200159e+02 
1.14  5.441464179e+02 
1.16  4.828501980e+02 
1.18  4.280276428e+02 
1.20  3.788682083e+02 
1.22  3.347177237e+02 
1.24  2.951339975e+02 
1.26  2.598359268e+02 
1.28  2.285706519e+02 
1.30  2.010518789e+02 
1.32  1.769663092e+02 
1.34  1.559971175e+02 
1.36  1.378491450e+02 
1.38  1.222567289e+02 
1.40  1.089603073e+02 
1.42  9.767415658e+01 
1.44  8.807665153e+01 
1.46  7.982372839e+01 
1.48  7.258099684e+01 
1.50  6.607000966e+01 
1.52  6.010611686e+01 
1.54  5.459307691e+01 
1.56  4.947952470e+01 
1.58  4.473133582e+01 
1.60  4.032749825e+01 
1.62  3.625553338e+01 
1.64  3.250532916e+01 
1.66  2.906613521e+01 
1.68  2.592599130e+01 
1.70  2.307153038e+01 
1.72  2.048780375e+01 
1.74  1.815814647e+01 
1.76  1.606410739e+01 
1.78  1.418547962e+01 
1.80  1.250048279e+01 
1.82  1.098616356e+01 
1.84  9.619087399e+00 
1.86  8.376374054e+00 
1.88  7.237054398e+00 
1.90  6.183567452e+00 
1.92  5.202985404e+00 
1.94  4.287375754e+00 
1.96  3.432878290e+00 
1.98  2.637836219e+00 
2.00  1.901167565e+00 
2.02  1.221781000e+00 
2.04  5.985670138e-01 
2.06  3.040785421e-02 
2.08 -4.838375700e-01 
2.10 -9.453500312e-01 
2.12 -1.355365924e+00 
2.14 -1.715192737e+00 
2.16 -2.026223948e+00 
2.18 -2.289953210e+00 
2.20 -2.507987654e+00 
2.22 -2.682060072e+00 
2.24 -2.814039735e+00 
2.26 -2.905941510e+00 
2.28 -2.959932923e+00 
2.30 -2.978338760e+00 
2.32 -2.963642738e+00 
2.34 -2.918485776e+00 
2.36 -2.845660338e+00 
2.38 -2.748100337e+00 
2.40 -2.628866102e+00 
2.42 -2.491123962e+00 
2.44 -2.338120097e+00 
2.46 -2.173148458e+00 
2.48 -1.999512750e+00 
2.50 -1.820482791e+00 
2.52 -1.639245851e+00 
2.54 -1.458854080e+00 
2.56 -1.282169578e+00 
2.58 -1.111809262e+00 
2.60 -9.500922168e-01 
2.62 -7.989928046e-01 
2.64 -6.601031392e-01 
2.66 -5.346086135e-01 
2.68 -4.232795602e-01 
2.70 -3.264804747e-01 
2.72 -2.441950479e-01 
2.74 -1.760604755e-01 
2.76 -1.213994086e-01 
2.78 -7.923655961e-02 
2.80 -4.829618768e-02 
2.82 -2.699993635e-02 
2.84 -1.350816303e-02 
2.86 -5.841218410e-03 
2.88 -2.074443469e-03 
2.90 -5.595565968e-04 
2.92 -1.010751187e-04 
2.94 -9.844570411e-06 
2.96 -3.440825066e-07 
2.98 -1.815286587e-09 
3.00 -1.563111696e-13 
3.02 -7.632983677e-23 
3.04 -5.114865106e-66 
3.06  0.000000000e+00 
3.08  0.000000000e+00 
3.10  0.000000000e+00 
3.12  0.000000000e+00 
3.14  0.000000000e+00 
3.16  0.000000000e+00 
3.18  0.000000000e+00 
3.20  0.000000000e+00 
3.22  0.000000000e+00 
3.24  0.000000000e+00 
3.26  0.000000000e+00 
3.28  0.000000000e+00 
3.30  0.000000000e+00 
3.32  0.000000000e+00 
3.34  0.000000000e+00 
3.36  0.000000000e+00 
3.38  0.000000000e+00 
3.40  0.000000000e+00 
3.42  0.000000000e+00 
3.44  0.000000000e+00 
3.46  0.000000000e+00 
3.48  0.000000000e+00 
3.50  0.000000000e+00 
3.52  0.000000000e+00 
3.54  0.000000000e+00 
3.56  0.000000000e+00 
3.58  0.000000000e+00 
3.60  0.000000000e+00 
3.62  0.000000000e+00 
3.64  0.000000000e+00 
3.66  0.000000000e+00 
3.68  0.000000000e+00 
3.70  0.000000000e+00 
3.72  0.000000000e+00 
3.74  0.000000000e+00 
3.76  0.000000000e+00 
3.78  0.000000000e+00 
3.80  0.000000000e+00 
3.82  0.000000000e+00 
3.84  0.000000000e+00 
3.86  0.000000000e+00 
3.88  0.000000000e+00 
3.90  0.000000000e+00 
3.92  0.000000000e+00 
3.94  0.000000000e+00 
3.96  0.000000000e+00 
3.98  0.000000000e+00 
4.00  0.000000000e+00 
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