# Diatom energy (eV) vs. radial distance (Angstrom).
# potential = 2024--Ito-K-Yokoi-T-Hyodo-K-Mori-H--Fe-22
# implementation = 2024--Ito-K--Fe-22--LAMMPS--ipr1
# NOTE: These values only provide a look at the purely pair interaction
# of the potential and therefore exclude multi-body interactions.

# Calculations from the NIST Interatomic Potential Repository Project:
# http://www.ctcms.nist.gov/potentials/

# Table generated 2026-06-16

r    Fe Fe            
0.02 -2.751603219e+07 
0.04 -2.275512605e+07 
0.06 -1.877768289e+07 
0.08 -1.546119155e+07 
0.10 -1.270131370e+07 
0.12 -1.040933354e+07 
0.14 -8.509944692e+06 
0.16 -6.939332625e+06 
0.18 -5.643515522e+06 
0.20 -4.576911020e+06 
0.22 -3.701099955e+06 
0.24 -2.983761698e+06 
0.26 -2.397758738e+06 
0.28 -1.920350859e+06 
0.30 -1.532521679e+06 
0.32 -1.218402466e+06 
0.34 -9.647800182e+05 
0.36 -7.606770851e+05 
0.38 -5.969952862e+05 
0.40 -4.662117678e+05 
0.42 -3.621220037e+05 
0.44 -2.796221406e+05 
0.46 -2.145251742e+05 
0.48 -1.634060159e+05 
0.50 -1.234711847e+05 
0.52 -9.244944773e+04 
0.54 -6.850024843e+04 
0.56 -5.013720660e+04 
0.58 -3.616436327e+04 
0.60 -2.562317974e+04 
0.62 -1.774859074e+04 
0.64 -1.193266355e+04 
0.66 -7.694631095e+03 
0.68 -4.656253932e+03 
0.70 -2.521625989e+03 
0.72 -1.060676216e+03 
0.74 -9.573582126e+01 
0.76  5.093590288e+02 
0.78  8.580737543e+02 
0.80  1.028263239e+03 
0.82  1.077851576e+03 
0.84  1.049362103e+03 
0.86  9.735121830e+02 
0.88  8.720501380e+02 
0.90  7.599806523e+02 
0.92  6.472989084e+02 
0.94  5.403319550e+02 
0.96  4.427676842e+02 
0.98  3.564367470e+02 
1.00  2.819002812e+02 
1.02  2.188860510e+02 
1.04  1.666071527e+02 
1.06  1.239905269e+02 
1.08  8.983687537e+01 
1.10  6.292900362e+01 
1.12  4.210190293e+01 
1.14  2.628491174e+01 
1.16  1.452390956e+01 
1.18  5.989602690e+00 
1.20 -2.353812382e-02 
1.22 -4.104303173e+00 
1.24 -6.735263138e+00 
1.26 -8.305018969e+00 
1.28 -9.120958092e+00 
1.30 -9.421699339e+00 
1.32 -9.388711206e+00 
1.34 -9.156808800e+00 
1.36 -8.823392442e+00 
1.38 -8.456400148e+00 
1.40 -8.101018939e+00 
1.42 -7.785245362e+00 
1.44 -7.524411075e+00 
1.46 -7.324800564e+00 
1.48 -7.186489344e+00 
1.50 -7.105525678e+00 
1.52 -7.075569473e+00 
1.54 -7.089090277e+00 
1.56 -7.138213705e+00 
1.58 -7.215292866e+00 
1.60 -7.313269255e+00 
1.62 -7.425876364e+00 
1.64 -7.547729212e+00 
1.66 -7.674334208e+00 
1.68 -7.802046195e+00 
1.70 -7.927993166e+00 
1.72 -8.049983875e+00 
1.74 -8.166409330e+00 
1.76 -8.276145706e+00 
1.78 -8.378463608e+00 
1.80 -8.472946591e+00 
1.82 -8.559420312e+00 
1.84 -8.637892685e+00 
1.86 -8.708504606e+00 
1.88 -8.771490424e+00 
1.90 -8.827147011e+00 
1.92 -8.875810206e+00 
1.94 -8.917837388e+00 
1.96 -8.953595013e+00 
1.98 -8.983450029e+00 
2.00 -9.007764252e+00 
2.02 -9.026890918e+00 
2.04 -9.041172750e+00 
2.06 -9.050941054e+00 
2.08 -9.056515425e+00 
2.10 -9.058203803e+00 
2.12 -9.056302654e+00 
2.14 -9.051097173e+00 
2.16 -9.042861408e+00 
2.18 -9.031858297e+00 
2.20 -9.018339601e+00 
2.22 -9.002545750e+00 
2.24 -8.984705637e+00 
2.26 -8.965036392e+00 
2.28 -8.943743158e+00 
2.30 -8.921018916e+00 
2.32 -8.897044374e+00 
2.34 -8.871987938e+00 
2.36 -8.846005785e+00 
2.38 -8.819242035e+00 
2.40 -8.791829026e+00 
2.42 -8.763887690e+00 
2.44 -8.735528009e+00 
2.46 -8.706849557e+00 
2.48 -8.677942091e+00 
2.50 -8.648886196e+00 
2.52 -8.619753953e+00 
2.54 -8.590609626e+00 
2.56 -8.561510343e+00 
2.58 -8.532506773e+00 
2.60 -8.503643764e+00 
2.62 -8.474960963e+00 
2.64 -8.446493390e+00 
2.66 -8.418271960e+00 
2.68 -8.390323969e+00 
2.70 -8.362673523e+00 
2.72 -8.335341914e+00 
2.74 -8.308347960e+00 
2.76 -8.281708283e+00 
2.78 -8.255437561e+00 
2.80 -8.229548727e+00 
2.82 -8.204053143e+00 
2.84 -8.178960742e+00 
2.86 -8.154280139e+00 
2.88 -8.130018732e+00 
2.90 -8.106182772e+00 
2.92 -8.082777431e+00 
2.94 -8.059806855e+00 
2.96 -8.037274210e+00 
2.98 -8.015181726e+00 
3.00 -7.993530731e+00 
3.02 -7.972321697e+00 
3.04 -7.951554274e+00 
3.06 -7.931227334e+00 
3.08 -7.911339006e+00 
3.10 -7.891886730e+00 
3.12 -7.872867292e+00 
3.14 -7.854276879e+00 
3.16 -7.836111128e+00 
3.18 -7.818365168e+00 
3.20 -7.801033681e+00 
3.22 -7.784110946e+00 
3.24 -7.767590890e+00 
3.26 -7.751467137e+00 
3.28 -7.735733056e+00 
3.30 -7.720381805e+00 
3.32 -7.705406376e+00 
3.34 -7.690799633e+00 
3.36 -7.676554352e+00 
3.38 -7.662663251e+00 
3.40 -7.649119027e+00 
3.42 -7.635914381e+00 
3.44 -7.623042045e+00 
3.46 -7.610494802e+00 
3.48 -7.598265509e+00 
3.50 -7.586347110e+00 
3.52 -7.574732655e+00 
3.54 -7.563415305e+00 
3.56 -7.552388352e+00 
3.58 -7.541645218e+00 
3.60 -7.531179466e+00 
3.62 -7.520984805e+00 
3.64 -7.511055091e+00 
3.66 -7.501384332e+00 
3.68 -7.491966692e+00 
3.70 -7.482796483e+00 
3.72 -7.473868176e+00 
3.74 -7.465176393e+00 
3.76 -7.456715907e+00 
3.78 -7.448481644e+00 
3.80 -7.440468675e+00 
3.82 -7.432672221e+00 
3.84 -7.425087640e+00 
3.86 -7.417710436e+00 
3.88 -7.410536244e+00 
3.90 -7.403560834e+00 
3.92 -7.396780102e+00 
3.94 -7.390190068e+00 
3.96 -7.383786869e+00 
3.98 -7.377566755e+00 
4.00 -7.371526084e+00 
4.02 -7.365661314e+00 
4.04 -7.359968998e+00 
4.06 -7.354445779e+00 
4.08 -7.349088379e+00 
4.10 -7.343893596e+00 
4.12 -7.338858297e+00 
4.14 -7.333979409e+00 
4.16 -7.329253913e+00 
4.18 -7.324678835e+00 
4.20 -7.320251244e+00 
4.22 -7.315968240e+00 
4.24 -7.311826949e+00 
4.26 -7.307824518e+00 
4.28 -7.303958106e+00 
4.30 -7.300224884e+00 
4.32 -7.296622023e+00 
4.34 -7.293146694e+00 
4.36 -7.289796061e+00 
4.38 -7.286567280e+00 
4.40 -7.283457494e+00 
4.42 -7.280463830e+00 
4.44 -7.277583400e+00 
4.46 -7.274813297e+00 
4.48 -7.272150597e+00 
4.50 -7.269592356e+00 
4.52 -7.267135615e+00 
4.54 -7.264777396e+00 
4.56 -7.262514709e+00 
4.58 -7.260344553e+00 
4.60 -7.258263915e+00 
4.62 -7.256269782e+00 
4.64 -7.254359136e+00 
4.66 -7.252528964e+00 
4.68 -7.250776262e+00 
4.70 -7.249098038e+00 
4.72 -7.247491319e+00 
4.74 -7.245953155e+00 
4.76 -7.244480629e+00 
4.78 -7.243070854e+00 
4.80 -7.241720988e+00 
4.82 -7.240428235e+00 
4.84 -7.239189849e+00 
4.86 -7.238003144e+00 
4.88 -7.236865496e+00 
4.90 -7.235774349e+00 
4.92 -7.234727220e+00 
4.94 -7.233721703e+00 
4.96 -7.232755473e+00 
4.98 -7.231826291e+00 
5.00 -7.230932008e+00 
5.02 -7.230070564e+00 
5.04 -7.229239996e+00 
5.06 -7.228438435e+00 
5.08 -7.227664113e+00 
5.10 -7.226915361e+00 
5.12 -7.226190610e+00 
5.14 -7.225488391e+00 
5.16 -7.224807338e+00 
5.18 -7.224146184e+00 
5.20 -7.223503762e+00 
5.22 -7.222879002e+00 
5.24 -7.222270931e+00 
5.26 -7.221678670e+00 
5.28 -7.221101430e+00 
5.30 -7.220538511e+00 
5.32 -7.219989298e+00 
5.34 -7.219453255e+00 
5.36 -7.218929923e+00 
5.38 -7.218418916e+00 
5.40 -7.217919914e+00 
5.42 -7.217432659e+00 
5.44 -7.216956947e+00 
5.46 -7.216492628e+00 
5.48 -7.216039594e+00 
5.50 -7.215597774e+00 
5.52 -7.215167132e+00 
5.54 -7.214747652e+00 
5.56 -7.214339340e+00 
5.58 -7.213942210e+00 
5.60 -7.213556282e+00 
5.62 -7.213181570e+00 
5.64 -7.212818082e+00 
5.66 -7.212465805e+00 
5.68 -7.212124704e+00 
5.70 -7.211794712e+00 
5.72 -7.211475726e+00 
5.74 -7.211167599e+00 
5.76 -7.210870137e+00 
5.78 -7.210583090e+00 
5.80 -7.210306151e+00 
5.82 -7.210038951e+00 
5.84 -7.209781054e+00 
5.86 -7.209531961e+00 
5.88 -7.209291101e+00 
5.90 -7.209057837e+00 
5.92 -7.208831467e+00 
5.94 -7.208611225e+00 
5.96 -7.208396287e+00 
5.98 -7.208185778e+00 
6.00 -7.207978779e+00 
6.02 -7.207774338e+00 
6.04 -7.207571487e+00 
6.06 -7.207369250e+00 
6.08 -7.207166667e+00 
6.10 -7.206962813e+00 
6.12 -7.206756819e+00 
6.14 -7.206547907e+00 
6.16 -7.206335410e+00 
6.18 -7.206118816e+00 
6.20 -7.205897797e+00 
6.22 -7.205672258e+00 
6.24 -7.205442380e+00 
6.26 -7.205208670e+00 
6.28 -7.204972017e+00 
6.30 -7.204733753e+00 
6.32 -7.204495714e+00 
6.34 -7.204260315e+00 
6.36 -7.204030625e+00 
6.38 -7.203810445e+00 
6.40 -7.203604398e+00 
6.42 -7.203418024e+00 
6.44 -7.203257878e+00 
6.46 -7.203131637e+00 
6.48 -7.203048216e+00 
6.50 -7.203017883e+00 
6.52 -7.203017883e+00 
6.54 -7.203017883e+00 
6.56 -7.203017883e+00 
6.58 -7.203017883e+00 
6.60 -7.203017883e+00 
6.62 -7.203017883e+00 
6.64 -7.203017883e+00 
6.66 -7.203017883e+00 
6.68 -7.203017883e+00 
6.70 -7.203017883e+00 
6.72 -7.203017883e+00 
6.74 -7.203017883e+00 
6.76 -7.203017883e+00 
6.78 -7.203017883e+00 
6.80 -7.203017883e+00 
6.82 -7.203017883e+00 
6.84 -7.203017883e+00 
6.86 -7.203017883e+00 
6.88 -7.203017883e+00 
6.90 -7.203017883e+00 
6.92 -7.203017883e+00 
6.94 -7.203017883e+00 
6.96 -7.203017883e+00 
6.98 -7.203017883e+00 
7.00 -7.203017883e+00 
7.02 -7.203017883e+00 
7.04 -7.203017883e+00 
7.06 -7.203017883e+00 
7.08 -7.203017883e+00 
7.10 -7.203017883e+00 
7.12 -7.203017883e+00 
7.14 -7.203017883e+00 
7.16 -7.203017883e+00 
7.18 -7.203017883e+00 
7.20 -7.203017883e+00 
7.22 -7.203017883e+00 
7.24 -7.203017883e+00 
7.26 -7.203017883e+00 
7.28 -7.203017883e+00 
7.30 -7.203017883e+00 
7.32 -7.203017883e+00 
7.34 -7.203017883e+00 
7.36 -7.203017883e+00 
7.38 -7.203017883e+00 
7.40 -7.203017883e+00 
7.42 -7.203017883e+00 
7.44 -7.203017883e+00 
7.46 -7.203017883e+00 
7.48 -7.203017883e+00 
7.50 -7.203017883e+00 
7.52 -7.203017883e+00 
7.54 -7.203017883e+00 
7.56 -7.203017883e+00 
7.58 -7.203017883e+00 
7.60 -7.203017883e+00 
7.62 -7.203017883e+00 
7.64 -7.203017883e+00 
7.66 -7.203017883e+00 
7.68 -7.203017883e+00 
7.70 -7.203017883e+00 
7.72 -7.203017883e+00 
7.74 -7.203017883e+00 
7.76 -7.203017883e+00 
7.78 -7.203017883e+00 
7.80 -7.203017883e+00 
7.82 -7.203017883e+00 
7.84 -7.203017883e+00 
7.86 -7.203017883e+00 
7.88 -7.203017883e+00 
7.90 -7.203017883e+00 
7.92 -7.203017883e+00 
7.94 -7.203017883e+00 
7.96 -7.203017883e+00 
7.98 -7.203017883e+00 
8.00 -7.203017883e+00 
8.02 -7.203017883e+00 
8.04 -7.203017883e+00 
8.06 -7.203017883e+00 
8.08 -7.203017883e+00 
8.10 -7.203017883e+00 
8.12 -7.203017883e+00 
8.14 -7.203017883e+00 
8.16 -7.203017883e+00 
8.18 -7.203017883e+00 
8.20 -7.203017883e+00 
8.22 -7.203017883e+00 
8.24 -7.203017883e+00 
8.26 -7.203017883e+00 
8.28 -7.203017883e+00 
8.30 -7.203017883e+00 
8.32 -7.203017883e+00 
8.34 -7.203017883e+00 
8.36 -7.203017883e+00 
8.38 -7.203017883e+00 
8.40 -7.203017883e+00 
8.42 -7.203017883e+00 
8.44 -7.203017883e+00 
8.46 -7.203017883e+00 
8.48 -7.203017883e+00 
8.50 -7.203017883e+00 
8.52 -7.203017883e+00 
8.54 -7.203017883e+00 
8.56 -7.203017883e+00 
8.58 -7.203017883e+00 
8.60 -7.203017883e+00 
8.62 -7.203017883e+00 
8.64 -7.203017883e+00 
8.66 -7.203017883e+00 
8.68 -7.203017883e+00 
8.70 -7.203017883e+00 
8.72 -7.203017883e+00 
8.74 -7.203017883e+00 
8.76 -7.203017883e+00 
8.78 -7.203017883e+00 
8.80 -7.203017883e+00 
8.82 -7.203017883e+00 
8.84 -7.203017883e+00 
8.86 -7.203017883e+00 
8.88 -7.203017883e+00 
8.90 -7.203017883e+00 
8.92 -7.203017883e+00 
8.94 -7.203017883e+00 
8.96 -7.203017883e+00 
8.98 -7.203017883e+00 
9.00 -7.203017883e+00 
9.02 -7.203017883e+00 
9.04 -7.203017883e+00 
9.06 -7.203017883e+00 
9.08 -7.203017883e+00 
9.10 -7.203017883e+00 
9.12 -7.203017883e+00 
9.14 -7.203017883e+00 
9.16 -7.203017883e+00 
9.18 -7.203017883e+00 
9.20 -7.203017883e+00 
9.22 -7.203017883e+00 
9.24 -7.203017883e+00 
9.26 -7.203017883e+00 
9.28 -7.203017883e+00 
9.30 -7.203017883e+00 
9.32 -7.203017883e+00 
9.34 -7.203017883e+00 
9.36 -7.203017883e+00 
9.38 -7.203017883e+00 
9.40 -7.203017883e+00 
9.42 -7.203017883e+00 
9.44 -7.203017883e+00 
9.46 -7.203017883e+00 
9.48 -7.203017883e+00 
9.50 -7.203017883e+00 
9.52 -7.203017883e+00 
9.54 -7.203017883e+00 
9.56 -7.203017883e+00 
9.58 -7.203017883e+00 
9.60 -7.203017883e+00 
9.62 -7.203017883e+00 
9.64 -7.203017883e+00 
9.66 -7.203017883e+00 
9.68 -7.203017883e+00 
9.70 -7.203017883e+00 
9.72 -7.203017883e+00 
9.74 -7.203017883e+00 
9.76 -7.203017883e+00 
9.78 -7.203017883e+00 
9.80 -7.203017883e+00 
9.82 -7.203017883e+00 
9.84 -7.203017883e+00 
9.86 -7.203017883e+00 
9.88 -7.203017883e+00 
9.90 -7.203017883e+00 
9.92 -7.203017883e+00 
9.94 -7.203017883e+00 
9.96 -7.203017883e+00 
9.98 -7.203017883e+00 
10.00 -7.203017883e+00