# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr
# implementation = 2004--Zhou-X-W--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr--LAMMPS--ipr1
# composition = Fe2Ta
# 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 2024-04-11

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  nan             
1.02  nan             
1.04  nan             
1.06  nan             
1.08  nan             
1.10  nan             
1.12  nan             
1.14  3.139948304e+02 
1.16  2.868943097e+02 
1.18  2.621807841e+02 
1.20  2.396283422e+02 
1.22  2.190371897e+02 
1.24  2.002265470e+02 
1.26  1.830287310e+02 
1.28  1.672869193e+02 
1.30  1.528570143e+02 
1.32  1.396111679e+02 
1.34  1.274395152e+02 
1.36  1.162487264e+02 
1.38  1.059586604e+02 
1.40  9.649900756e+01 
1.42  8.780680245e+01 
1.44  7.982473021e+01 
1.46  7.249984303e+01 
1.48  6.578240447e+01 
1.50  5.962486732e+01 
1.52  5.398126350e+01 
1.54  4.880728537e+01 
1.56  4.406099130e+01 
1.58  3.970367935e+01 
1.60  3.570052926e+01 
1.62  3.202667329e+01 
1.64  2.865775719e+01 
1.66  2.556840451e+01 
1.68  2.273616173e+01 
1.70  2.014091027e+01 
1.72  1.776444636e+01 
1.74  1.559014156e+01 
1.76  1.360267534e+01 
1.78  1.178787433e+01 
1.80  1.013263798e+01 
1.82  8.624895958e+00 
1.84  7.253548094e+00 
1.86  6.008362735e+00 
1.88  4.879830501e+00 
1.90  3.858982503e+00 
1.92  2.937193115e+00 
1.94  2.106001640e+00 
1.96  1.357000552e+00 
1.98  6.818388754e-01 
2.00  7.236635060e-02 
2.02 -4.791030229e-01 
2.04 -9.794819658e-01 
2.06 -1.434656412e+00 
2.08 -1.849369716e+00 
2.10 -2.227270910e+00 
2.12 -2.571093259e+00 
2.14 -2.882896079e+00 
2.16 -3.164304820e+00 
2.18 -3.416708888e+00 
2.20 -3.641334909e+00 
2.22 -3.839348279e+00 
2.24 -4.012419902e+00 
2.26 -4.162342328e+00 
2.28 -4.291011415e+00 
2.30 -4.400425928e+00 
2.32 -4.492255796e+00 
2.34 -4.567416733e+00 
2.36 -4.627021483e+00 
2.38 -4.672449134e+00 
2.40 -4.705233845e+00 
2.42 -4.726940225e+00 
2.44 -4.739049337e+00 
2.46 -4.742876198e+00 
2.48 -4.739528815e+00 
2.50 -4.729906117e+00 
2.52 -4.714723356e+00 
2.54 -4.694550695e+00 
2.56 -4.669852921e+00 
2.58 -4.641022685e+00 
2.60 -4.608412510e+00 
2.62 -4.572331028e+00 
2.64 -4.533053420e+00 
2.66 -4.490836745e+00 
2.68 -4.445920748e+00 
2.70 -4.398528526e+00 
2.72 -4.348868003e+00 
2.74 -4.297134464e+00 
2.76 -4.243442814e+00 
2.78 -4.187599717e+00 
2.80 -4.129391614e+00 
2.82 -4.068687730e+00 
2.84 -4.005438114e+00 
2.86 -3.939668423e+00 
2.88 -3.871470767e+00 
2.90 -3.800990850e+00 
2.92 -3.728412587e+00 
2.94 -3.653941985e+00 
2.96 -3.577792173e+00 
2.98 -3.500171124e+00 
3.00 -3.421272982e+00 
3.02 -3.341273272e+00 
3.04 -3.260327740e+00 
3.06 -3.178574305e+00 
3.08 -3.096137439e+00 
3.10 -3.013134325e+00 
3.12 -2.929682094e+00 
3.14 -2.845905467e+00 
3.16 -2.761944044e+00 
3.18 -2.677958411e+00 
3.20 -2.594134183e+00 
3.22 -2.510683141e+00 
3.24 -2.427840813e+00 
3.26 -2.345860185e+00 
3.28 -2.265001745e+00 
3.30 -2.185520659e+00 
3.32 -2.107652365e+00 
3.34 -2.031598288e+00 
3.36 -1.957513359e+00 
3.38 -1.885496846e+00 
3.40 -1.815587418e+00 
3.42 -1.747762746e+00 
3.44 -1.681943340e+00 
3.46 -1.617999793e+00 
3.48 -1.555762420e+00 
3.50 -1.495032220e+00 
3.52 -1.435592229e+00 
3.54 -1.377218626e+00 
3.56 -1.319691157e+00 
3.58 -1.262802706e+00 
3.60 -1.206367990e+00 
3.62 -1.150231395e+00 
3.64 -1.094273971e+00 
3.66 -1.038419555e+00 
3.68 -9.826398265e-01 
3.70 -9.269579465e-01 
3.72 -8.714504426e-01 
3.74 -8.162465350e-01 
3.76 -7.615260008e-01 
3.78 -7.075130582e-01 
3.80 -6.544672276e-01 
3.82 -6.026720415e-01 
3.84 -5.524217066e-01 
3.86 -5.040066716e-01 
3.88 -4.576992464e-01 
3.90 -4.137404671e-01 
3.92 -3.723292779e-01 
3.94 -3.336148279e-01 
3.96 -2.976923047e-01 
3.98 -2.646023226e-01 
4.00 -2.343335154e-01 
4.02 -2.068277103e-01 
4.04 -1.819869087e-01 
4.06 -1.596812674e-01 
4.08 -1.397573455e-01 
4.10 -1.220460171e-01 
4.12 -1.063696183e-01 
4.14 -9.254806204e-02 
4.16 -8.040380686e-02 
4.18 -6.976567840e-02 
4.20 -6.047162476e-02 
4.22 -5.237053705e-02 
4.24 -4.532328898e-02 
4.26 -3.920315531e-02 
4.28 -3.389574465e-02 
4.30 -2.929859405e-02 
4.32 -2.532053190e-02 
4.34 -2.188084530e-02 
4.36 -1.890750580e-02 
4.38 -1.633861054e-02 
4.40 -1.412034804e-02 
4.42 -1.220553831e-02 
4.44 -1.055300270e-02 
4.46 -9.126926104e-03 
4.48 -7.896242582e-03 
4.50 -6.834062044e-03 
4.52 -5.917146491e-03 
4.54 -5.125438778e-03 
4.56 -4.441643302e-03 
4.58 -3.850855978e-03 
4.60 -3.340239763e-03 
4.62 -2.898741512e-03 
4.64 -2.516845829e-03 
4.66 -2.186361718e-03 
4.68 -1.900238083e-03 
4.70 -1.652404483e-03 
4.72 -1.437633869e-03 
4.74 -1.251424400e-03 
4.76 -1.089897780e-03 
4.78 -9.497118492e-04 
4.80 -8.279853942e-04 
4.82 -7.222339635e-04 
4.84 -6.303139171e-04 
4.86 -5.503751950e-04 
4.88 -4.808203416e-04 
4.90 -4.202693933e-04 
4.92 -3.675297141e-04 
4.94 -3.215700784e-04 
4.96 -2.814983954e-04 
4.98 -2.465425598e-04 
5.00 -2.160339836e-04 
5.02 -1.893934283e-04 
5.04 -1.661188130e-04 
5.06 -1.457747170e-04 
5.08 -1.279833385e-04 
5.10 -1.124167044e-04 
5.12 -9.878995408e-05 
5.14 -8.685554679e-05 
5.16 -7.639826403e-05 
5.18 -6.723089475e-05 
5.20 -5.919050881e-05 
5.22 -5.213523690e-05 
5.24 -4.594148663e-05 
5.26 -4.050153455e-05 
5.28 -3.572144235e-05 
5.30 -3.151925267e-05 
5.32 -2.782342616e-05 
5.34 -2.457148704e-05 
5.36 -2.170884847e-05 
5.38 -1.918779371e-05 
5.40 -1.696659159e-05 
5.42 -1.500872857e-05 
5.44 -1.328224139e-05 
5.46 -1.175913706e-05 
5.48 -1.041488840e-05 
5.50 -9.227995103e-06 
5.52 -8.179601676e-06 
5.54 -7.253164623e-06 
5.56 -6.434162486e-06 
5.58 -5.709843057e-06 
5.60 -5.069002892e-06 
5.62 -4.501794923e-06 
5.64 -3.999560506e-06 
5.66 -3.554682724e-06 
5.68 -3.160458209e-06 
5.70 -2.810985079e-06 
5.72 -2.501064942e-06 
5.74 -2.226117133e-06 
5.76 -1.982103655e-06 
5.78 -1.765463428e-06 
5.80 -1.573054696e-06 
5.82 -1.402104532e-06 
5.84 -1.250164568e-06 
5.86 -1.115072150e-06 
5.88 -9.949162458e-07 
5.90 -8.880075172e-07 
5.92 -7.928520215e-07 
5.94 -7.081281075e-07 
5.96 -6.326661014e-07 
5.98 -5.654304410e-07 
6.00 -5.055039567e-07