# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2011--Zhou-X-W-Doty-F-P-Yang-P--Li-Na-K-Rb-Cs-F-Cl-Br-I
# implementation = 2011--Zhou-X-W--Li-Na-K-Rb-Cs-F-Cl-Br-I--LAMMPS--ipr1
# composition = FLi2
# 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  1.897552470e+04 
1.02  1.450949063e+04 
1.04  1.115054934e+04 
1.06  8.610501259e+03 
1.08  6.680052340e+03 
1.10  5.205367131e+03 
1.12  4.073543647e+03 
1.14  3.200949692e+03 
1.16  2.525162872e+03 
1.18  1.999551881e+03 
1.20  1.589095011e+03 
1.22  1.267283096e+03 
1.24  1.013864606e+03 
1.26  8.136450829e+02 
1.28  6.549318162e+02 
1.30  5.286802294e+02 
1.32  4.279003514e+02 
1.34  3.471430378e+02 
1.36  2.822785384e+02 
1.38  2.300221744e+02 
1.40  1.877958600e+02 
1.42  1.535732644e+02 
1.44  1.257568121e+02 
1.46  1.030781517e+02 
1.48  8.455220015e+01 
1.50  6.938280049e+01 
1.52  5.693101729e+01 
1.54  4.668806957e+01 
1.56  3.824478716e+01 
1.58  3.127149907e+01 
1.60  2.549109731e+01 
1.62  2.069301978e+01 
1.64  1.671392149e+01 
1.66  1.340959176e+01 
1.68  1.066202064e+01 
1.70  8.376061601e+00 
1.72  6.472359127e+00 
1.74  4.885525501e+00 
1.76  3.560791774e+00 
1.78  2.454659862e+00 
1.80  1.530370766e+00 
1.82  7.548562481e-01 
1.84  1.037300103e-01 
1.86 -4.413663333e-01 
1.88 -8.974313379e-01 
1.90 -1.278862459e+00 
1.92 -1.597873878e+00 
1.94 -1.864520544e+00 
1.96 -2.087125155e+00 
1.98 -2.272575780e+00 
2.00 -2.426532263e+00 
2.02 -2.553675459e+00 
2.04 -2.657884801e+00 
2.06 -2.742367421e+00 
2.08 -2.809849995e+00 
2.10 -2.862594298e+00 
2.12 -2.902509763e+00 
2.14 -2.931731528e+00 
2.16 -2.951989339e+00 
2.18 -2.964074881e+00 
2.20 -2.968125727e+00 
2.22 -2.965002741e+00 
2.24 -2.955603692e+00 
2.26 -2.940701917e+00 
2.28 -2.920965961e+00 
2.30 -2.896975761e+00 
2.32 -2.869236033e+00 
2.34 -2.838187368e+00 
2.36 -2.805110440e+00 
2.38 -2.769463547e+00 
2.40 -2.731265555e+00 
2.42 -2.690840525e+00 
2.44 -2.648469829e+00 
2.46 -2.604398413e+00 
2.48 -2.558840262e+00 
2.50 -2.511980314e+00 
2.52 -2.463983587e+00 
2.54 -2.415002526e+00 
2.56 -2.365168734e+00 
2.58 -2.314601330e+00 
2.60 -2.263409350e+00 
2.62 -2.211807683e+00 
2.64 -2.159928492e+00 
2.66 -2.107636901e+00 
2.68 -2.055037026e+00 
2.70 -2.002227843e+00 
2.72 -1.949304674e+00 
2.74 -1.896359806e+00 
2.76 -1.843483414e+00 
2.78 -1.790768819e+00 
2.80 -1.738306538e+00 
2.82 -1.686187114e+00 
2.84 -1.634551398e+00 
2.86 -1.583601545e+00 
2.88 -1.533253919e+00 
2.90 -1.483579012e+00 
2.92 -1.434661582e+00 
2.94 -1.386589305e+00 
2.96 -1.339445737e+00 
2.98 -1.293309444e+00 
3.00 -1.248253143e+00 
3.02 -1.204342876e+00 
3.04 -1.161807009e+00 
3.06 -1.120529521e+00 
3.08 -1.080506042e+00 
3.10 -1.041778216e+00 
3.12 -1.004376478e+00 
3.14 -9.683207210e-01 
3.16 -9.336205175e-01 
3.18 -9.002754978e-01 
3.20 -8.682758514e-01 
3.22 -8.376029511e-01 
3.24 -8.082300819e-01 
3.26 -7.801232564e-01 
3.28 -7.532420976e-01 
3.30 -7.275407691e-01 
3.32 -7.029689296e-01 
3.34 -6.794726930e-01 
3.36 -6.569955733e-01 
3.38 -6.354793966e-01 
3.40 -6.148651643e-01 
3.42 -5.950938539e-01 
3.44 -5.761071472e-01 
3.46 -5.578480772e-01 
3.48 -5.402615899e-01 
3.50 -5.232950167e-01 
3.52 -5.068984600e-01 
3.54 -4.910249682e-01 
3.56 -4.756309870e-01 
3.58 -4.606765980e-01 
3.60 -4.461251865e-01 
3.62 -4.319436530e-01 
3.64 -4.181023715e-01 
3.66 -4.045751030e-01 
3.68 -3.913416166e-01 
3.70 -3.785479104e-01 
3.72 -3.661879151e-01 
3.74 -3.540485872e-01 
3.76 -3.420676261e-01 
3.78 -3.302473287e-01 
3.80 -3.185904626e-01 
3.82 -3.071002433e-01 
3.84 -2.957803045e-01 
3.86 -2.846346625e-01 
3.88 -2.736676760e-01 
3.90 -2.628840004e-01 
3.92 -2.522885384e-01 
3.94 -2.418863872e-01 
3.96 -2.316827825e-01 
3.98 -2.216830405e-01 
4.00 -2.118924987e-01 
4.02 -2.023164562e-01 
4.04 -1.929601132e-01 
4.06 -1.838285127e-01 
4.08 -1.749264823e-01 
4.10 -1.662585791e-01 
4.12 -1.578290372e-01 
4.14 -1.496417185e-01 
4.16 -1.417000670e-01 
4.18 -1.340070684e-01 
4.20 -1.265652138e-01 
4.22 -1.193764686e-01 
4.24 -1.124422466e-01 
4.26 -1.057633902e-01 
4.28 -9.934015578e-02 
4.30 -9.317220473e-02 
4.32 -8.725857887e-02 
4.34 -8.159774091e-02 
4.36 -7.618759884e-02 
4.38 -7.102546570e-02 
4.40 -6.610808450e-02 
4.42 -6.143166243e-02 
4.44 -5.699189686e-02 
4.46 -5.278400487e-02 
4.48 -4.880275617e-02 
4.50 -4.504329432e-02 
4.52 -4.156503502e-02 
4.54 -3.828760198e-02 
4.56 -3.520443829e-02 
4.58 -3.230944341e-02 
4.60 -2.959623516e-02 
4.62 -2.705819703e-02 
4.64 -2.468852467e-02 
4.66 -2.248027115e-02 
4.68 -2.042639066e-02 
4.70 -1.851978039e-02 
4.72 -1.675332021e-02 
4.74 -1.511991005e-02 
4.76 -1.361250470e-02 
4.78 -1.222414591e-02 
4.80 -1.094799167e-02 
4.82 -9.777342701e-03 
4.84 -8.705665908e-03 
4.86 -7.726615026e-03 
4.88 -6.834048344e-03 
4.90 -6.022043634e-03 
4.92 -5.284910350e-03 
4.94 -4.617199213e-03 
4.96 -4.013709319e-03 
4.98 -3.469492898e-03 
5.00 -2.979857910e-03 
5.02 -2.540368624e-03 
5.04 -2.146844362e-03 
5.06 -1.795356597e-03 
5.08 -1.482224576e-03 
5.10 -1.204009645e-03 
5.12 -9.575084663e-04 
5.14 -7.397452808e-04 
5.16 -5.479633942e-04 
5.18 -3.796160338e-04 
5.20 -2.323567253e-04 
5.22 -1.040293250e-04 
5.24 -2.584271940e-08 
5.26 -2.898866590e-09 
5.28 -1.558858439e-09 
5.30 -7.367282329e-10 
5.32 -2.719071625e-10 
5.34 -4.251451823e-11 
5.36  4.241885503e-11 
5.38  4.937391186e-11 
5.40  2.561924879e-11 
5.42  3.518270315e-12 
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