# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2013--Zhou-X-W-Ward-D-K-Martin-J-E-et-al--Zn-Cd-Hg-S-Se-Te
# implementation = 2013--Zhou-X-W--Zn-Cd-Hg-S-Se-Te--LAMMPS--ipr1
# composition = Cd2Zn
# 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  1.534004612e+04 
0.80  1.315943281e+04 
0.82  1.133230588e+04 
0.84  9.802747870e+03 
0.86  8.514570256e+03 
0.88  7.418306347e+03 
0.90  6.478743904e+03 
0.92  5.669148660e+03 
0.94  4.968670201e+03 
0.96  4.362973461e+03 
0.98  3.840251259e+03 
1.00  3.388840416e+03 
1.02  2.998274715e+03 
1.04  2.660058568e+03 
1.06  2.366902011e+03 
1.08  2.111792434e+03 
1.10  1.887932514e+03 
1.12  1.689573844e+03 
1.14  1.512842496e+03 
1.16  1.355448105e+03 
1.18  1.215687049e+03 
1.20  1.091968479e+03 
1.22  9.826766541e+02 
1.24  8.860775775e+02 
1.26  8.003750248e+02 
1.28  7.239407211e+02 
1.30  6.555305279e+02 
1.32  5.942492546e+02 
1.34  5.393705071e+02 
1.36  4.902749383e+02 
1.38  4.464213901e+02 
1.40  4.072752396e+02 
1.42  3.722626898e+02 
1.44  3.407837693e+02 
1.46  3.122540478e+02 
1.48  2.861532410e+02 
1.50  2.620631267e+02 
1.52  2.396824799e+02 
1.54  2.188229101e+02 
1.56  1.993828187e+02 
1.58  1.812986024e+02 
1.60  1.645127323e+02 
1.62  1.489699664e+02 
1.64  1.346200965e+02 
1.66  1.214192533e+02 
1.68  1.093281195e+02 
1.70  9.830756898e+01 
1.72  8.831469283e+01 
1.74  7.930126831e+01 
1.76  7.121370356e+01 
1.78  6.399339609e+01 
1.80  5.757735098e+01 
1.82  5.189908062e+01 
1.84  4.688977703e+01 
1.86  4.247969454e+01 
1.88  3.859960227e+01 
1.90  3.518208516e+01 
1.92  3.216250738e+01 
1.94  2.947976107e+01 
1.96  2.707748506e+01 
1.98  2.490652947e+01 
2.00  2.292810862e+01 
2.02  2.111534696e+01 
2.04  1.945130836e+01 
2.06  1.792451918e+01 
2.08  1.652545284e+01 
2.10  1.524529660e+01 
2.12  1.407543116e+01 
2.14  1.300701283e+01 
2.16  1.203083743e+01 
2.18  1.113743492e+01 
2.20  1.031723817e+01 
2.22  9.560799049e+00 
2.24  8.859071327e+00 
2.26  8.203740764e+00 
2.28  7.587581408e+00 
2.30  7.004763665e+00 
2.32  6.451029646e+00 
2.34  5.923642334e+00 
2.36  5.421072709e+00 
2.38  4.942510214e+00 
2.40  4.487404443e+00 
2.42  4.055226798e+00 
2.44  3.645438327e+00 
2.46  3.257511983e+00 
2.48  2.890937424e+00 
2.50  2.545217995e+00 
2.52  2.219867389e+00 
2.54  1.914406219e+00 
2.56  1.628358934e+00 
2.58  1.361250753e+00 
2.60  1.112604757e+00 
2.62  8.819391230e-01 
2.64  6.687646095e-01 
2.66  4.725817255e-01 
2.68  2.928789150e-01 
2.70  1.291304641e-01 
2.72 -1.920566515e-02 
2.74 -1.526890619e-01 
2.76 -2.718984002e-01 
2.78 -3.774319704e-01 
2.80 -4.699086720e-01 
2.82 -5.499678299e-01 
2.84 -6.182688817e-01 
2.86 -6.754904542e-01 
2.88 -7.223288394e-01 
2.90 -7.594958132e-01 
2.92 -7.877157463e-01 
2.94 -8.077219360e-01 
2.96 -8.202521427e-01 
2.98 -8.260432805e-01 
3.00 -8.258252628e-01 
3.02 -8.203140232e-01 
3.04 -8.102037781e-01 
3.06 -7.961586522e-01 
3.08 -7.788038701e-01 
3.10 -7.587168075e-01 
3.12 -7.364183228e-01 
3.14 -7.123649313e-01 
3.16 -6.869425359e-01 
3.18 -6.604625834e-01 
3.20 -6.331616176e-01 
3.22 -6.052052133e-01 
3.24 -5.766970903e-01 
3.26 -5.476937435e-01 
3.28 -5.182240683e-01 
3.30 -4.883122086e-01 
3.32 -4.580003723e-01 
3.34 -4.273671585e-01 
3.36 -3.965368859e-01 
3.38 -3.656774518e-01 
3.40 -3.349884234e-01 
3.42 -3.046853625e-01 
3.44 -2.749871168e-01 
3.46 -2.461086311e-01 
3.48 -2.182571716e-01 
3.50 -1.916293447e-01 
3.52 -1.664079753e-01 
3.54 -1.427587515e-01 
3.56 -1.208266723e-01 
3.58 -1.007323634e-01 
3.60 -8.256835362e-02 
3.62 -6.639544290e-02 
3.64 -5.223933966e-02 
3.66 -4.008780752e-02 
3.68 -2.988863132e-02 
3.70 -2.154879365e-02 
3.72 -1.493533033e-02 
3.74 -9.878386071e-03 
3.76 -6.176980746e-03 
3.78 -3.607863663e-03 
3.80 -1.937500757e-03 
3.82 -9.366370817e-04 
3.84 -3.959889236e-04 
3.86 -1.405860204e-04 
3.88 -3.951671496e-05 
3.90 -8.047770269e-06 
3.92 -1.032174273e-06 
3.94 -6.589225923e-08 
3.96 -1.365352519e-09 
3.98 -3.860397154e-12 
4.00 -1.890835962e-16 
4.02 -2.612356402e-25 
4.04 -5.741699213e-54 
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