# Diatom energy (eV) vs. radial distance (Angstrom).
# potential = 2026--Bose-S-Rajendiran-M-D'Aguanno-B--Au
# implementation = 2026--Bose-S--Au--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 2026-08-31

r    Au Au            
0.02  2.704225961e+03 
0.04  2.528914100e+03 
0.06  2.364921046e+03 
0.08  2.211517517e+03 
0.10  2.068021174e+03 
0.12  1.933793596e+03 
0.14  1.808237455e+03 
0.16  1.690793875e+03 
0.18  1.580939956e+03 
0.20  1.478186462e+03 
0.22  1.382075650e+03 
0.24  1.292179250e+03 
0.26  1.208096567e+03 
0.28  1.129452702e+03 
0.30  1.055896899e+03 
0.32  9.871009889e+02 
0.34  9.227579341e+02 
0.36  8.625804718e+02 
0.38  8.062998398e+02 
0.40  7.536645867e+02 
0.42  7.044394574e+02 
0.44  6.584043513e+02 
0.46  6.153533468e+02 
0.48  5.750937884e+02 
0.50  5.374454336e+02 
0.52  5.022396535e+02 
0.54  4.693186853e+02 
0.56  4.385349329e+02 
0.58  4.097503128e+02 
0.60  3.828356411e+02 
0.62  3.576700614e+02 
0.64  3.341405079e+02 
0.66  3.121412044e+02 
0.68  2.915731947e+02 
0.70  2.723439035e+02 
0.72  2.543667256e+02 
0.74  2.375606416e+02 
0.76  2.218498578e+02 
0.78  2.071634702e+02 
0.80  1.934351490e+02 
0.82  1.806028445e+02 
0.84  1.686085111e+02 
0.86  1.573978495e+02 
0.88  1.469200655e+02 
0.90  1.371276437e+02 
0.92  1.279761369e+02 
0.94  1.194239679e+02 
0.96  1.114322450e+02 
0.98  1.039645885e+02 
1.00  9.698696908e+01 
1.02  9.046755630e+01 
1.04  8.437657678e+01 
1.06  7.868618165e+01 
1.08  7.337032247e+01 
1.10  6.840463516e+01 
1.12  6.376633136e+01 
1.14  5.943409685e+01 
1.16  5.538799646e+01 
1.18  5.160938514e+01 
1.20  4.808082470e+01 
1.22  4.478600599e+01 
1.24  4.170967605e+01 
1.26  3.883756992e+01 
1.28  3.615634692e+01 
1.30  3.365353095e+01 
1.32  3.131745473e+01 
1.34  2.913720753e+01 
1.36  2.710258634e+01 
1.38  2.520405016e+01 
1.40  2.343267725e+01 
1.42  2.178012511e+01 
1.44  2.023859306e+01 
1.46  1.880078724e+01 
1.48  1.745988783e+01 
1.50  1.620951842e+01 
1.52  1.504371731e+01 
1.54  1.395691076e+01 
1.56  1.294388781e+01 
1.58  1.199977688e+01 
1.60  1.112002376e+01 
1.62  1.030037109e+01 
1.64  9.536839158e+00 
1.66  8.825707883e+00 
1.68  8.163500026e+00 
1.70  7.546965453e+00 
1.72  6.973066411e+00 
1.74  6.438963767e+00 
1.76  5.942004129e+00 
1.78  5.479707797e+00 
1.80  5.049757495e+00 
1.82  4.649987835e+00 
1.84  4.278375447e+00 
1.86  3.933029768e+00 
1.88  3.612184406e+00 
1.90  3.314189073e+00 
1.92  3.037502042e+00 
1.94  2.780683078e+00 
1.96  2.542386844e+00 
1.98  2.321356720e+00 
2.00  2.116419026e+00 
2.02  1.926477621e+00 
2.04  1.750508850e+00 
2.06  1.587556817e+00 
2.08  1.436728964e+00 
2.10  1.297191938e+00 
2.12  1.168167729e+00 
2.14  1.048930045e+00 
2.16  9.388009413e-01 
2.18  8.371476517e-01 
2.20  7.433796342e-01 
2.22  6.569458054e-01 
2.24  5.773319549e-01 
2.26  5.040583274e-01 
2.28  4.366773619e-01 
2.30  3.747715778e-01 
2.32  3.179515981e-01 
2.34  2.658543013e-01 
2.36  2.181410935e-01 
2.38  1.744962926e-01 
2.40  1.346256184e-01 
2.42  9.825477974e-02 
2.44  6.512815489e-02 
2.46  3.500755727e-02 
2.48  7.671081777e-03 
2.50 -1.708797361e-02 
2.52 -3.946211593e-02 
2.54 -5.963059942e-02 
2.56 -7.776030629e-02 
2.58 -9.400656978e-02 
2.60 -1.085139435e-01 
2.62 -1.214169205e-01 
2.64 -1.328406050e-01 
2.66 -1.429013403e-01 
2.68 -1.517072956e-01 
2.70 -1.593590142e-01 
2.72 -1.659499258e-01 
2.74 -1.715668247e-01 
2.76 -1.762903176e-01 
2.78 -1.801952408e-01 
2.80 -1.833510505e-01 
2.82 -1.858221873e-01 
2.84 -1.876684168e-01 
2.86 -1.889451475e-01 
2.88 -1.897037274e-01 
2.90 -1.899917219e-01 
2.92 -1.898531724e-01 
2.94 -1.893288381e-01 
2.96 -1.884564219e-01 
2.98 -1.872707810e-01 
3.00 -1.858041237e-01 
3.02 -1.840861931e-01 
3.04 -1.821444383e-01 
3.06 -1.800041745e-01 
3.08 -1.776887325e-01 
3.10 -1.752195972e-01 
3.12 -1.726165386e-01 
3.14 -1.698977322e-01 
3.16 -1.670798721e-01 
3.18 -1.641782772e-01 
3.20 -1.612069884e-01 
3.22 -1.581788614e-01 
3.24 -1.551056514e-01 
3.26 -1.519980931e-01 
3.28 -1.488659750e-01 
3.30 -1.457182084e-01 
3.32 -1.425628922e-01 
3.34 -1.394073725e-01 
3.36 -1.362582993e-01 
3.38 -1.331216776e-01 
3.40 -1.300029171e-01 
3.42 -1.269068762e-01 
3.44 -1.238379050e-01 
3.46 -1.207998838e-01 
3.48 -1.177962598e-01 
3.50 -1.148300809e-01 
3.52 -1.119040271e-01 
3.54 -1.090204398e-01 
3.56 -1.061813491e-01 
3.58 -1.033884990e-01 
3.60 -1.006433708e-01 
3.62 -9.794720501e-02 
3.64 -9.530102165e-02 
3.66 -9.270563886e-02 
3.68 -9.016169044e-02 
3.70 -8.766964197e-02 
3.72 -8.522980583e-02 
3.74 -8.284235504e-02 
3.76 -8.050733612e-02 
3.78 -7.822468102e-02 
3.80 -7.599421813e-02 
3.82 -7.381568243e-02 
3.84 -7.168872493e-02 
3.86 -6.961292141e-02 
3.88 -6.758778037e-02 
3.90 -6.561275051e-02 
3.92 -6.368722754e-02 
3.94 -6.181056047e-02 
3.96 -5.998205740e-02 
3.98 -5.820099091e-02 
4.00 -5.646660289e-02 
4.02 -5.477810908e-02 
4.04 -5.313470318e-02 
4.06 -5.153556067e-02 
4.08 -4.997984224e-02 
4.10 -4.846669696e-02 
4.12 -4.699526517e-02 
4.14 -4.556468115e-02 
4.16 -4.417407545e-02 
4.18 -4.282257712e-02 
4.20 -4.150931568e-02 
4.22 -4.023342286e-02 
4.24 -3.899403428e-02 
4.26 -3.779029085e-02 
4.28 -3.662134009e-02 
4.30 -3.548633728e-02 
4.32 -3.438444652e-02 
4.34 -3.331484164e-02 
4.36 -3.227670702e-02 
4.38 -3.126923829e-02 
4.40 -3.029164294e-02 
4.42 -2.934314090e-02 
4.44 -2.842296498e-02 
4.46 -2.753036124e-02 
4.48 -2.666458934e-02 
4.50 -2.582492281e-02 
4.52 -2.501064925e-02 
4.54 -2.422107046e-02 
4.56 -2.345550264e-02 
4.58 -2.271327639e-02 
4.60 -2.199373676e-02 
4.62 -2.129624329e-02 
4.64 -2.062016995e-02 
4.66 -1.996490510e-02 
4.68 -1.932985139e-02 
4.70 -1.871442570e-02 
4.72 -1.811805898e-02 
4.74 -1.754019611e-02 
4.76 -1.698029577e-02 
4.78 -1.643783026e-02 
4.80 -1.591228528e-02 
4.82 -1.540315980e-02 
4.84 -1.490996582e-02 
4.86 -1.443222815e-02 
4.88 -1.396948422e-02 
4.90 -1.352128383e-02 
4.92 -1.308718894e-02 
4.94 -1.266677342e-02 
4.96 -1.225962285e-02 
4.98 -1.186533423e-02 
5.00 -1.148351577e-02 
5.02 -1.111378667e-02 
5.04 -1.075577683e-02 
5.06 -1.040912666e-02 
5.08 -1.007348680e-02 
5.10 -9.748517900e-03 
5.12 -9.433890401e-03 
5.14 -9.129284268e-03 
5.16 -8.834388772e-03 
5.18 -8.548902265e-03 
5.20 -8.272531943e-03 
5.22 -8.004993629e-03 
5.24 -7.746011549e-03 
5.26 -7.495318113e-03 
5.28 -7.252653703e-03 
5.30 -7.017766461e-03 
5.32 -6.790412083e-03 
5.34 -6.570353615e-03 
5.36 -6.357361253e-03 
5.38 -6.151212148e-03 
5.40 -5.951690215e-03 
5.42 -5.758585944e-03 
5.44 -5.571696219e-03 
5.46 -5.390824134e-03 
5.48 -5.215778821e-03 
5.50 -5.046375277e-03 
5.52 -4.882434198e-03 
5.54 -4.723781812e-03 
5.56 -4.570249720e-03 
5.58 -4.421674742e-03 
5.60 -4.277898764e-03 
5.62 -4.138768589e-03 
5.64 -4.004135792e-03 
5.66 -3.873856580e-03 
5.68 -3.747791654e-03 
5.70 -3.625806077e-03 
5.72 -3.507769142e-03 
5.74 -3.393554245e-03 
5.76 -3.283038763e-03 
5.78 -3.176103935e-03 
5.80 -3.072634740e-03 
5.82 -2.972519791e-03 
5.84 -2.875651219e-03 
5.86 -2.781924568e-03 
5.88 -2.691238691e-03 
5.90 -2.603495648e-03 
5.92 -2.518600605e-03 
5.94 -2.436461744e-03 
5.96 -2.356990166e-03 
5.98 -2.280099800e-03 
6.00 -2.205707321e-03 
6.02 -2.133732056e-03 
6.04 -2.064095911e-03 
6.06 -1.996723282e-03 
6.08 -1.931540987e-03 
6.10 -1.868478179e-03 
6.12 -1.807466284e-03 
6.14 -1.748438921e-03 
6.16 -1.691331838e-03 
6.18 -1.636082845e-03 
6.20 -1.582631746e-03 
6.22 -1.530920281e-03 
6.24 -1.480892059e-03 
6.26 -1.432492504e-03 
6.28 -1.385668796e-03 
6.30 -1.340369813e-03 
6.32 -1.296546082e-03 
6.34 -1.254149723e-03 
6.36 -1.213134397e-03 
6.38 -1.173455264e-03 
6.40 -1.135068926e-03 
6.42 -1.097933390e-03 
6.44 -1.062008015e-03 
6.46 -1.027253476e-03 
6.48 -9.936317165e-04 
6.50 -9.611059124e-04 
6.52 -9.296404292e-04 
6.54 -8.992007855e-04 
6.56 -8.697536157e-04 
6.58 -8.412666344e-04 
6.60 -8.137086018e-04 
6.62 -7.870492899e-04 
6.64 -7.612594502e-04 
6.66 -7.363107821e-04 
6.68 -7.121759027e-04 
6.70 -6.888283170e-04 
6.72 -6.662423893e-04 
6.74 -6.443933158e-04 
6.76 -6.232570976e-04 
6.78 -6.028105148e-04 
6.80 -5.830311015e-04 
6.82 -5.638971213e-04 
6.84 -5.453875437e-04 
6.86 -5.274820217e-04 
6.88 -5.101608692e-04 
6.90 -4.934050402e-04 
6.92 -4.771961076e-04 
6.94 -4.615162435e-04 
6.96 -4.463481996e-04 
6.98 -4.316752887e-04 
7.00 -4.174813663e-04 
7.02 -4.037508134e-04 
7.04 -3.904685188e-04 
7.06 -3.776198635e-04 
7.08 -3.651907039e-04 
7.10 -3.531673570e-04 
7.12 -3.415365854e-04 
7.14 -3.302855825e-04 
7.16 -3.194019588e-04 
7.18 -3.088737282e-04 
7.20 -2.986892953e-04 
7.22 -2.888374422e-04 
7.24 -2.793073164e-04 
7.26 -2.700884191e-04 
7.28 -2.611705938e-04 
7.30 -2.525440146e-04 
7.32 -2.441991762e-04 
7.34 -2.361268828e-04 
7.36 -2.283182386e-04 
7.38 -2.207646377e-04 
7.40 -2.134577548e-04 
7.42 -2.063895360e-04 
7.44 -1.995521902e-04 
7.46 -1.929381802e-04 
7.48 -1.865402145e-04 
7.50 -1.803512397e-04 
7.52 -1.743644322e-04 
7.54 -1.685731912e-04 
7.56 -1.629711311e-04 
7.58 -1.575520746e-04 
7.60 -1.523100460e-04 
7.62 -1.472392646e-04 
7.64 -1.423341381e-04 
7.66 -1.375892569e-04 
7.68 -1.329993880e-04 
7.70 -1.285594688e-04 
7.72 -1.242646023e-04 
7.74 -1.201100512e-04 
7.76 -1.160912327e-04 
7.78 -1.122037137e-04 
7.80 -1.084432058e-04 
7.82 -1.048055605e-04 
7.84 -1.012867648e-04 
7.86 -9.788293673e-05 
7.88 -9.459032093e-05 
7.90 -9.140528474e-05 
7.92 -8.832431407e-05 
7.94 -8.534400956e-05 
7.96 -8.246108285e-05 
7.98 -7.967235293e-05 
8.00 -7.697474269e-05 
8.02 -7.436527546e-05 
8.04 -7.184107181e-05 
8.06 -6.939934630e-05 
8.08 -6.703740447e-05 
8.10 -6.475263985e-05 
8.12 -6.254253110e-05 
8.14 -6.040463921e-05 
8.16 -5.833660483e-05 
8.18 -5.633614567e-05 
8.20 -5.440105397e-05 
8.22 -5.252919409e-05 
8.24 -5.071850013e-05 
8.26 -4.896697368e-05 
8.28 -4.727268161e-05 
8.30 -4.563375391e-05 
8.32 -4.404838168e-05 
8.34 -4.251481508e-05 
8.36 -4.103136145e-05 
8.38 -3.959638341e-05 
8.40 -3.820829708e-05 
8.42 -3.686557030e-05 
8.44 -3.556672099e-05 
8.46 -3.431031545e-05 
8.48 -3.309496686e-05 
8.50 -3.191933366e-05 
8.52 -3.078211816e-05 
8.54 -2.968206502e-05 
8.56 -2.861795996e-05 
8.58 -2.758862834e-05 
8.60 -2.659293389e-05 
8.62 -2.562977749e-05 
8.64 -2.469809592e-05 
8.66 -2.379686068e-05 
8.68 -2.292507689e-05 
8.70 -2.208178217e-05 
8.72 -2.126604559e-05 
8.74 -2.047696663e-05 
8.76 -1.971367419e-05 
8.78 -1.897532563e-05 
8.80 -1.826110585e-05 
8.82 -1.757022638e-05 
8.84 -1.690192452e-05 
8.86 -1.625546247e-05 
8.88 -1.563012655e-05 
8.90 -1.502522641e-05 
8.92 -1.444009424e-05 
8.94 -1.387408406e-05 
8.96 -1.332657099e-05 
8.98 -1.279695058e-05 
9.00 -1.228463811e-05 
9.02 -1.178906800e-05 
9.04 -1.130969311e-05 
9.06 -1.084598422e-05 
9.08 -1.039742937e-05 
9.10 -9.963533341e-06 
9.12 -9.543817104e-06 
9.14 -9.137817273e-06 
9.16 -8.745085607e-06 
9.18 -8.365188513e-06 
9.20 -7.997706566e-06 
9.22 -7.642234046e-06 
9.24 -7.298378493e-06 
9.26 -6.965760269e-06 
9.28 -6.644012145e-06 
9.30 -6.332778889e-06 
9.32 -6.031716879e-06 
9.34 -5.740493723e-06 
9.36 -5.458787887e-06 
9.38 -5.186288349e-06 
9.40 -4.922694248e-06 
9.42 -4.667714556e-06 
9.44 -4.421067752e-06 
9.46 -4.182481521e-06 
9.48 -3.951692440e-06 
9.50 -3.728445699e-06 
9.52 -3.512494814e-06 
9.54 -3.303601355e-06 
9.56 -3.101534684e-06 
9.58 -2.906071701e-06 
9.60 -2.716996594e-06 
9.62 -2.534100606e-06 
9.64 -2.357181803e-06 
9.66 -2.186044847e-06 
9.68 -2.020500786e-06 
9.70 -1.860366841e-06 
9.72 -1.705466208e-06 
9.74 -1.555627860e-06 
9.76 -1.410686359e-06 
9.78 -1.270481673e-06 
9.80 -1.134859001e-06 
9.82 -1.003668600e-06 
9.84 -8.767656204e-07 
9.86 -7.540099476e-07 
9.88 -6.352660448e-07 
9.90 -5.204028046e-07 
9.92 -4.092934045e-07 
9.94 -3.018151665e-07 
9.96 -1.978494217e-07 
9.98 -9.728137936e-08 
10.00  0.000000000e+00