# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2025--Sharifi-H-Wick-C-D--Co-Cu # implementation = 2025--Sharifi-H--Co-Cu--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 2025-07-01 r Co Co Co Cu Cu Cu 0.02 4.307816124e+05 4.620154743e+05 4.954943043e+05 0.04 1.801701080e+05 1.930217932e+05 2.067715918e+05 0.06 1.025931362e+05 1.098168620e+05 1.175313404e+05 0.08 6.660242451e+04 7.124088097e+04 7.618510859e+04 0.10 4.657294020e+04 4.978520131e+04 5.320232879e+04 0.12 3.417377209e+04 3.651023909e+04 3.899033190e+04 0.14 2.593965471e+04 2.769902295e+04 2.956217573e+04 0.16 2.019271284e+04 2.155240500e+04 2.298867779e+04 0.18 1.603076639e+04 1.710325916e+04 1.823308975e+04 0.20 1.292968224e+04 1.378984766e+04 1.469336997e+04 0.22 1.056621973e+04 1.126581090e+04 1.199838587e+04 0.24 8.731410747e+03 9.307283914e+03 9.908314076e+03 0.26 7.284927075e+03 7.763972083e+03 8.262186709e+03 0.28 6.129547928e+03 6.531779645e+03 6.948548224e+03 0.30 5.196158670e+03 5.536728806e+03 5.888216958e+03 0.32 4.434548282e+03 4.725095227e+03 5.023710898e+03 0.34 3.807559190e+03 4.057137252e+03 4.312525978e+03 0.36 3.287255585e+03 3.502988972e+03 3.722734097e+03 0.38 2.852342662e+03 3.039894338e+03 3.230018814e+03 0.40 2.486389463e+03 2.650302784e+03 2.815634660e+03 0.42 2.176580828e+03 2.320532092e+03 2.464974559e+03 0.44 1.912824018e+03 2.039811451e+03 2.166544845e+03 0.46 1.687100247e+03 1.799587068e+03 1.911221691e+03 0.48 1.492987289e+03 1.593011101e+03 1.691704041e+03 0.50 1.325303243e+03 1.414560454e+03 1.502105674e+03 0.52 1.179838313e+03 1.259749846e+03 1.337648283e+03 0.54 1.053150549e+03 1.124913396e+03 1.194427931e+03 0.56 9.424088246e+02 1.007036785e+03 1.069235663e+03 0.58 8.452713503e+02 9.036274549e+02 9.594188230e+02 0.60 7.597907505e+02 8.126132326e+02 8.627727970e+02 0.62 6.843394404e+02 7.322626647e+02 7.774559690e+02 0.64 6.175506291e+02 6.611220636e+02 7.019225457e+02 0.66 5.582712803e+02 5.979653309e+02 6.348690383e+02 0.68 5.055244638e+02 5.417538149e+02 5.751914621e+02 0.70 4.584790508e+02 4.916040107e+02 5.219509113e+02 0.72 4.164251474e+02 4.467613853e+02 4.743456724e+02 0.74 3.787541340e+02 4.065791180e+02 4.316885815e+02 0.76 3.449423452e+02 3.705007235e+02 3.933885230e+02 0.78 3.145376557e+02 3.380457740e+02 3.589352330e+02 0.80 2.871484355e+02 3.087981457e+02 3.278867924e+02 0.82 2.624343921e+02 2.823962770e+02 2.998592632e+02 0.84 2.400989552e+02 2.585250690e+02 2.745180749e+02 0.86 2.198829288e+02 2.369091347e+02 2.515708458e+02 0.88 2.015591625e+02 2.173071348e+02 2.307613616e+02 0.90 1.849280744e+02 1.995070181e+02 2.118645162e+02 0.92 1.698138758e+02 1.833221193e+02 1.946820473e+02 0.94 1.560613679e+02 1.685237620e+02 1.790389199e+02 0.96 1.435332248e+02 1.547991251e+02 1.647802584e+02 0.98 1.321076774e+02 1.420238860e+02 1.517687326e+02 1.00 1.216765299e+02 1.301114864e+02 1.398823195e+02 1.02 1.121434630e+02 1.189960194e+02 1.290123884e+02 1.04 1.034225496e+02 1.086260252e+02 1.190620447e+02 1.06 9.530980908e+01 9.895983151e+01 1.098778159e+02 1.08 8.715041994e+01 8.996212925e+01 1.006654129e+02 1.10 7.907839665e+01 8.160151819e+01 9.146379971e+01 1.12 7.127829029e+01 7.384880881e+01 8.251005063e+01 1.14 6.387210674e+01 6.667589963e+01 7.396440465e+01 1.16 5.693485110e+01 6.005508564e+01 6.592898332e+01 1.18 5.050670284e+01 5.395868241e+01 5.846237608e+01 1.20 4.460243868e+01 4.835887429e+01 5.159102094e+01 1.22 3.921868632e+01 4.322771583e+01 4.531804184e+01 1.24 3.433946678e+01 3.853723198e+01 3.963006341e+01 1.26 2.994040276e+01 3.425957630e+01 3.450243739e+01 1.28 2.599188080e+01 3.036721692e+01 2.990321313e+01 1.30 2.246139952e+01 2.683312807e+01 2.579612199e+01 1.32 1.931528857e+01 2.363097180e+01 2.214279285e+01 1.34 1.651994089e+01 2.073526720e+01 1.890436756e+01 1.36 1.404267358e+01 1.812153375e+01 1.604265299e+01 1.38 1.185230548e+01 1.576640672e+01 1.352091593e+01 1.40 9.919522037e+00 1.364772540e+01 1.130440623e+01 1.42 8.217081914e+00 1.174459502e+01 9.360675047e+00 1.44 6.719906842e+00 1.003742372e+01 7.659739491e+00 1.46 5.405088406e+00 8.507937641e+00 6.174135775e+00 1.48 4.251835952e+00 7.139176388e+00 4.878891588e+00 1.50 3.241384692e+00 5.915471876e+00 3.751442094e+00 1.52 2.356879051e+00 4.822413735e+00 2.771509060e+00 1.54 1.583240951e+00 3.846803451e+00 1.920956091e+00 1.56 9.070315153e-01 2.976600104e+00 1.183631264e+00 1.58 3.163119369e-01 2.200860085e+00 5.452050601e-01 1.60 -1.994931640e-01 1.509672323e+00 -6.991532406e-03 1.62 -6.497264730e-01 8.940912585e-01 -4.841239578e-01 1.64 -1.042621397e+00 3.460688472e-01 -8.960037601e-01 1.66 -1.385417333e+00 -1.416133666e-01 -1.251229513e+00 1.68 -1.684465835e+00 -5.754107148e-01 -1.557317467e+00 1.70 -1.945327976e+00 -9.610799445e-01 -1.820821962e+00 1.72 -2.172862963e+00 -1.303741157e+00 -2.047445458e+00 1.74 -2.371308166e+00 -1.607936520e+00 -2.242138160e+00 1.76 -2.544351324e+00 -1.877685740e+00 -2.409188076e+00 1.78 -2.695195276e+00 -2.116537921e+00 -2.552301787e+00 1.80 -2.826615835e+00 -2.327619722e+00 -2.674676553e+00 1.82 -2.941013364e+00 -2.513679612e+00 -2.779064578e+00 1.84 -3.040458520e+00 -2.677121382e+00 -2.867828641e+00 1.86 -3.126732922e+00 -2.820044338e+00 -2.942992938e+00 1.88 -3.201365227e+00 -2.944299451e+00 -3.006289148e+00 1.90 -3.265662976e+00 -3.051560829e+00 -3.059195460e+00 1.92 -3.320740758e+00 -3.143358148e+00 -3.102970808e+00 1.94 -3.367545087e+00 -3.221089533e+00 -3.138684849e+00 1.96 -3.406876320e+00 -3.286032981e+00 -3.167244128e+00 1.98 -3.439408023e+00 -3.339356821e+00 -3.189414935e+00 2.00 -3.465704055e+00 -3.382129224e+00 -3.205843216e+00 2.02 -3.486233635e+00 -3.415326875e+00 -3.217071860e+00 2.04 -3.501388153e+00 -3.439842889e+00 -3.223555765e+00 2.06 -3.511515029e+00 -3.456494023e+00 -3.225674884e+00 2.08 -3.516938222e+00 -3.466027236e+00 -3.223747986e+00 2.10 -3.517960964e+00 -3.469125693e+00 -3.218060140e+00 2.12 -3.514867478e+00 -3.466414216e+00 -3.208880312e+00 2.14 -3.507924619e+00 -3.458464255e+00 -3.196463067e+00 2.16 -3.497383438e+00 -3.445798434e+00 -3.181049242e+00 2.18 -3.483480657e+00 -3.428894665e+00 -3.162866597e+00 2.20 -3.466440049e+00 -3.408189921e+00 -3.142130428e+00 2.22 -3.446473714e+00 -3.384083661e+00 -3.119044162e+00 2.24 -3.423783248e+00 -3.356940945e+00 -3.093799923e+00 2.26 -3.398560795e+00 -3.327095283e+00 -3.066579069e+00 2.28 -3.370989970e+00 -3.294851210e+00 -3.037552713e+00 2.30 -3.341246660e+00 -3.260486644e+00 -3.006882211e+00 2.32 -3.309499698e+00 -3.224254779e+00 -2.974719632e+00 2.34 -3.275911408e+00 -3.186370675e+00 -2.941208209e+00 2.36 -3.240638025e+00 -3.147007626e+00 -2.906482761e+00 2.38 -3.203830010e+00 -3.106325286e+00 -2.870670103e+00 2.40 -3.165632244e+00 -3.064472645e+00 -2.833889425e+00 2.42 -3.126184148e+00 -3.021588398e+00 -2.796252669e+00 2.44 -3.085619711e+00 -2.977801286e+00 -2.757864871e+00 2.46 -3.044067470e+00 -2.933230415e+00 -2.718824496e+00 2.48 -3.001650435e+00 -2.887985563e+00 -2.679223756e+00 2.50 -2.958485995e+00 -2.842167462e+00 -2.639148909e+00 2.52 -2.914685615e+00 -2.795868080e+00 -2.598680549e+00 2.54 -2.870354222e+00 -2.749170880e+00 -2.557893879e+00 2.56 -2.825590835e+00 -2.702151092e+00 -2.516858972e+00 2.58 -2.780488716e+00 -2.654875973e+00 -2.475642308e+00 2.60 -2.735135327e+00 -2.607405083e+00 -2.434310160e+00 2.62 -2.689612355e+00 -2.559790567e+00 -2.392924399e+00 2.64 -2.643995766e+00 -2.512077469e+00 -2.351541571e+00 2.66 -2.598355920e+00 -2.464304066e+00 -2.310213259e+00 2.68 -2.552757730e+00 -2.416502240e+00 -2.268986419e+00 2.70 -2.507260861e+00 -2.368697899e+00 -2.227903696e+00 2.72 -2.461919961e+00 -2.320911444e+00 -2.187003729e+00 2.74 -2.416784927e+00 -2.273158301e+00 -2.146321435e+00 2.76 -2.371901178e+00 -2.225449516e+00 -2.105888286e+00 2.78 -2.327309949e+00 -2.177792421e+00 -2.065732565e+00 2.80 -2.283048583e+00 -2.130191371e+00 -2.025879617e+00 2.82 -2.239150822e+00 -2.082648552e+00 -1.986352083e+00 2.84 -2.195647085e+00 -2.035164862e+00 -1.947170131e+00 2.86 -2.152564730e+00 -1.987740837e+00 -1.908351666e+00 2.88 -2.109928310e+00 -1.940377623e+00 -1.869912540e+00 2.90 -2.067759796e+00 -1.893077976e+00 -1.831866744e+00 2.92 -2.026078791e+00 -1.845847244e+00 -1.794226593e+00 2.94 -1.984902713e+00 -1.798694318e+00 -1.757002905e+00 2.96 -1.944246978e+00 -1.751632507e+00 -1.720205160e+00 2.98 -1.904125141e+00 -1.704680304e+00 -1.683841654e+00 3.00 -1.864549048e+00 -1.657861994e+00 -1.647919645e+00 3.02 -1.825528954e+00 -1.611208075e+00 -1.612445484e+00 3.04 -1.787073640e+00 -1.564755464e+00 -1.577424731e+00 3.06 -1.749190518e+00 -1.518547456e+00 -1.542862270e+00 3.08 -1.711885726e+00 -1.472633423e+00 -1.508762403e+00 3.10 -1.675164219e+00 -1.427068265e+00 -1.475128939e+00 3.12 -1.639029848e+00 -1.381911621e+00 -1.441965267e+00 3.14 -1.603485442e+00 -1.337226867e+00 -1.409274425e+00 3.16 -1.568532873e+00 -1.293079945e+00 -1.377059150e+00 3.18 -1.534173132e+00 -1.249538077e+00 -1.345321924e+00 3.20 -1.500406384e+00 -1.206668418e+00 -1.314065008e+00 3.22 -1.467232035e+00 -1.164536705e+00 -1.283290469e+00 3.24 -1.434648781e+00 -1.123205971e+00 -1.253000198e+00 3.26 -1.402654669e+00 -1.082735360e+00 -1.223195915e+00 3.28 -1.371247138e+00 -1.043179098e+00 -1.193879181e+00 3.30 -1.340423075e+00 -1.004585645e+00 -1.165051387e+00 3.32 -1.310178851e+00 -9.669970522e-01 -1.136713752e+00 3.34 -1.280510368e+00 -9.304485259e-01 -1.108867309e+00 3.36 -1.251413098e+00 -8.949681974e-01 -1.081512893e+00 3.38 -1.222882117e+00 -8.605770871e-01 -1.054651123e+00 3.40 -1.194912145e+00 -8.272892393e-01 -1.028282380e+00 3.42 -1.167497573e+00 -7.951120049e-01 -1.002406796e+00 3.44 -1.140632500e+00 -7.640464415e-01 -9.770242268e-01 3.46 -1.114310759e+00 -7.340878049e-01 -9.521342383e-01 3.48 -1.088525943e+00 -7.052261023e-01 -9.277360873e-01 3.50 -1.063271436e+00 -6.774466824e-01 -9.038287062e-01 3.52 -1.038540433e+00 -6.507308405e-01 -8.804106895e-01 3.54 -1.014325962e+00 -6.250564188e-01 -8.574802820e-01 3.56 -9.906209099e-01 -6.003983880e-01 -8.350353699e-01 3.58 -9.674180378e-01 -5.767293964e-01 -8.130734754e-01 3.60 -9.447100017e-01 -5.540202814e-01 -7.915917525e-01 3.62 -9.224893696e-01 -5.322405345e-01 -7.705869873e-01 3.64 -9.007486372e-01 -5.113587202e-01 -7.500555998e-01 3.66 -8.794802436e-01 -4.913428453e-01 -7.299936492e-01 3.68 -8.586765849e-01 -4.721606816e-01 -7.103968414e-01 3.70 -8.383300276e-01 -4.537800416e-01 -6.912605386e-01 3.72 -8.184329207e-01 -4.361690129e-01 -6.725797721e-01 3.74 -7.989776070e-01 -4.192961516e-01 -6.543492556e-01 3.76 -7.799564337e-01 -4.031306410e-01 -6.365634017e-01 3.78 -7.613617621e-01 -3.876424177e-01 -6.192163387e-01 3.80 -7.431859766e-01 -3.728022694e-01 -6.023019291e-01 3.82 -7.254214934e-01 -3.585819083e-01 -5.858137893e-01 3.84 -7.080607677e-01 -3.449540227e-01 -5.697453097e-01 3.86 -6.910963011e-01 -3.318923115e-01 -5.540896752e-01 3.88 -6.745206481e-01 -3.193715019e-01 -5.388398864e-01 3.90 -6.583264223e-01 -3.073673558e-01 -5.239887807e-01 3.92 -6.425063011e-01 -2.958566651e-01 -5.095290532e-01 3.94 -6.270530314e-01 -2.848172381e-01 -4.954532775e-01 3.96 -6.119594338e-01 -2.742278802e-01 -4.817539257e-01 3.98 -5.972184064e-01 -2.640683686e-01 -4.684233888e-01 4.00 -5.828229287e-01 -2.543194233e-01 -4.554539952e-01 4.02 -5.687660642e-01 -2.449626749e-01 -4.428380294e-01 4.04 -5.550409636e-01 -2.359806312e-01 -4.305677497e-01 4.06 -5.416408669e-01 -2.273566415e-01 -4.186354046e-01 4.08 -5.285591053e-01 -2.190748608e-01 -4.070332486e-01 4.10 -5.157891024e-01 -2.111202142e-01 -3.957535572e-01 4.12 -5.033243762e-01 -2.034783608e-01 -3.847886408e-01 4.14 -4.911585389e-01 -1.961356587e-01 -3.741308572e-01 4.16 -4.792852982e-01 -1.890791308e-01 -3.637726237e-01 4.18 -4.676984571e-01 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