# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2026--Oliveira-D-S--Ni # implementation = 2026--Oliveira-D-S--Ni--LAMMPS--ipr1 # composition = Ni # 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 2026-06-16 r A1--Cu--fcc A15--beta-W A2--W--bcc A3'--alpha-La--d A3--Mg--hcp A4--C--dc A5--beta-Sn A6--In--bct A7--alpha-As Ah--alpha-Po--sc 0.50 nan nan nan nan nan nan nan nan nan nan 0.52 nan nan nan nan nan nan nan nan nan nan 0.54 nan nan nan nan nan nan nan nan nan nan 0.56 nan nan nan nan nan nan nan nan nan nan 0.58 nan nan nan nan nan nan nan nan nan nan 0.60 nan nan nan nan nan nan nan nan nan nan 0.62 nan nan nan nan nan nan nan nan nan nan 0.64 nan nan nan nan nan nan nan nan nan nan 0.66 nan nan nan nan nan nan nan nan nan nan 0.68 nan nan nan nan nan nan nan nan nan nan 0.70 nan nan nan nan nan nan nan nan nan nan 0.72 nan nan nan nan nan nan nan nan nan nan 0.74 nan nan nan nan nan nan nan nan 2.817468178e+02 nan 0.76 nan nan nan nan nan nan nan nan 2.564652949e+02 nan 0.78 nan nan nan nan nan nan nan nan 2.338320606e+02 nan 0.80 nan nan nan nan nan 1.815871311e+02 nan nan 2.135231079e+02 nan 0.82 nan nan nan nan nan 1.655792193e+02 nan nan 1.952213228e+02 nan 0.84 nan nan nan nan nan 1.510934744e+02 nan nan 1.786542014e+02 nan 0.86 nan nan nan nan nan 1.379600338e+02 nan nan 1.636327163e+02 nan 0.88 nan nan nan nan nan 1.260110308e+02 nan nan 1.500051430e+02 nan 0.90 nan 1.964812814e+02 nan 2.977574332e+02 2.978381839e+02 1.151070119e+02 nan nan 1.376135463e+02 1.973238734e+02 0.92 nan 1.809261154e+02 nan 2.755498734e+02 2.756357747e+02 1.051611954e+02 1.844216130e+02 nan 1.263005183e+02 1.820354550e+02 0.94 nan 1.667782128e+02 nan 2.552226003e+02 2.552917309e+02 9.609393223e+01 1.702778677e+02 nan 1.159307755e+02 1.680460695e+02 0.96 nan 1.539008198e+02 nan 2.365935761e+02 2.366286955e+02 8.783555897e+01 1.573796351e+02 nan 1.063878629e+02 1.552141261e+02 0.98 nan 1.421264596e+02 nan 2.194930425e+02 2.194890182e+02 8.031812519e+01 1.455519006e+02 nan 9.759368329e+01 1.434019539e+02 1.00 nan 1.313040935e+02 nan 2.037630660e+02 2.037295163e+02 7.347991448e+01 1.346493964e+02 nan 8.949692047e+01 1.324846125e+02 1.02 1.893451639e+02 1.213293139e+02 1.698637722e+02 1.892821931e+02 1.892316893e+02 6.726052859e+01 1.245415428e+02 1.758679753e+02 8.204340887e+01 1.223824876e+02 1.04 1.760078827e+02 1.121275155e+02 1.577833427e+02 1.759503591e+02 1.758922296e+02 6.160331626e+01 1.151543323e+02 1.633719701e+02 7.518451639e+01 1.130411681e+02 1.06 1.637191721e+02 1.036333385e+02 1.466858318e+02 1.636688599e+02 1.636104297e+02 5.645321325e+01 1.064482842e+02 1.518623532e+02 6.887185839e+01 1.044024751e+02 1.08 1.523876862e+02 9.579455021e+01 1.364663827e+02 1.523448179e+02 1.522926483e+02 5.175803013e+01 9.837396765e+01 1.412413019e+02 6.306595666e+01 9.640632037e+01 1.10 1.419232823e+02 8.856599613e+01 1.270318866e+02 1.418886551e+02 1.418496439e+02 4.747656493e+01 9.088387823e+01 1.314210837e+02 5.771408991e+01 8.900228177e+01 1.12 1.322331738e+02 8.189733702e+01 1.182916682e+02 1.322169941e+02 1.322018397e+02 4.356918273e+01 8.393076491e+01 1.223223918e+02 5.277089429e+01 8.214392699e+01 1.14 1.232439196e+02 7.574365028e+01 1.101663144e+02 1.232598997e+02 1.232789661e+02 3.999526819e+01 7.747157922e+01 1.138806459e+02 4.820287556e+01 7.579286773e+01 1.16 1.148941433e+02 7.005961468e+01 1.025796555e+02 1.149468317e+02 1.150000830e+02 3.671640268e+01 7.146757925e+01 1.060446506e+02 4.398884191e+01 6.991326552e+01 1.18 1.071337964e+02 6.479751329e+01 9.547430645e+01 1.072134518e+02 1.072900613e+02 3.370397463e+01 6.588291644e+01 9.876617669e+01 4.010934645e+01 6.446944868e+01 1.20 9.991741116e+01 5.991162432e+01 8.881901226e+01 1.000065194e+02 1.000912270e+02 3.093947600e+01 6.068670269e+01 9.199576436e+01 3.654345324e+01 5.942905763e+01 1.22 9.319800161e+01 5.536790863e+01 8.258989587e+01 9.327935366e+01 9.335740363e+01 2.840764350e+01 5.585723743e+01 8.568284852e+01 3.326841978e+01 5.475919806e+01 1.24 8.692967178e+01 5.113417752e+01 7.676697603e+01 8.699099688e+01 8.705165738e+01 2.609320183e+01 5.137634753e+01 7.978029854e+01 3.025843557e+01 5.042519943e+01 1.26 8.106661408e+01 4.718692355e+01 7.132652764e+01 8.110265852e+01 8.114112133e+01 2.397843836e+01 4.722217679e+01 7.424842183e+01 2.749176606e+01 4.639829986e+01 1.28 7.556127982e+01 4.350098953e+01 6.624037876e+01 7.557453181e+01 7.559236594e+01 2.204287531e+01 4.337202175e+01 6.905084921e+01 2.494791988e+01 4.265314670e+01 1.30 7.038035623e+01 4.005705037e+01 6.147925899e+01 7.037714798e+01 7.037920776e+01 2.026497192e+01 3.980177317e+01 6.416354597e+01 2.260721998e+01 3.916907091e+01 1.32 6.550333044e+01 3.683501608e+01 5.701413818e+01 6.549065311e+01 6.548235081e+01 1.862328565e+01 3.648407521e+01 5.956502124e+01 2.045223372e+01 3.592925704e+01 1.34 6.091052621e+01 3.381324712e+01 5.281802729e+01 6.089463977e+01 6.088086902e+01 1.709782701e+01 3.339502565e+01 5.523671654e+01 1.846661677e+01 3.291677854e+01 1.36 5.658414993e+01 3.097350747e+01 4.886377795e+01 5.656869495e+01 5.655282808e+01 1.566953814e+01 3.051374231e+01 5.116446454e+01 1.663391640e+01 3.011449480e+01 1.38 5.251028456e+01 2.829910149e+01 4.513420508e+01 5.249592068e+01 5.247938630e+01 1.432844526e+01 2.782569614e+01 4.733607105e+01 1.494043279e+01 2.750966566e+01 1.40 4.867685540e+01 2.577791596e+01 4.161967045e+01 4.866352584e+01 4.864722774e+01 1.307054540e+01 2.531872142e+01 4.373970925e+01 1.337603147e+01 2.509194210e+01 1.42 4.507165187e+01 2.340125908e+01 3.831216890e+01 4.506016686e+01 4.504548147e+01 1.189244766e+01 2.298400803e+01 4.036205674e+01 1.193158799e+01 2.285065378e+01 1.44 4.168146580e+01 2.116214973e+01 3.520367658e+01 4.167360250e+01 4.166248380e+01 1.079111567e+01 2.081274609e+01 3.718847867e+01 1.059798762e+01 2.077523050e+01 1.46 3.849254099e+01 1.905345477e+01 3.228437564e+01 3.849046303e+01 3.848478918e+01 9.763066572e+00 1.879667694e+01 3.420466231e+01 9.366242288e+00 1.885440925e+01 1.48 3.549201129e+01 1.706751245e+01 2.954456895e+01 3.549674849e+01 3.549747671e+01 8.804835434e+00 1.692799460e+01 3.139780779e+01 8.228326866e+00 1.707565981e+01 1.50 3.266754831e+01 1.519671208e+01 2.697475095e+01 3.267845098e+01 3.268571379e+01 7.912722853e+00 1.519706025e+01 2.875762566e+01 7.177619334e+00 1.542620443e+01 1.52 3.000777715e+01 1.343483513e+01 2.456416442e+01 3.002304840e+01 3.003627071e+01 7.081360433e+00 1.359189181e+01 2.627661328e+01 6.210283773e+00 1.389304473e+01 1.54 2.750363979e+01 1.177856676e+01 2.230316878e+01 2.752111682e+01 2.753887634e+01 6.304883580e+00 1.210214279e+01 2.394720039e+01 5.321768378e+00 1.246381861e+01 1.56 2.514606985e+01 1.022683587e+01 2.018356790e+01 2.516370710e+01 2.518393588e+01 5.577982341e+00 1.071817437e+01 2.176113228e+01 4.506202411e+00 1.112610216e+01 1.58 2.292728913e+01 8.779511941e+00 1.819762701e+01 2.294291732e+01 2.296307841e+01 4.895804950e+00 9.431507780e+00 1.971067383e+01 3.756847774e+00 9.871318547e+00 1.60 2.084134083e+01 7.435449152e+00 1.633879584e+01 2.085363779e+01 2.087144166e+01 4.254595490e+00 8.234225410e+00 1.778970243e+01 3.066910436e+00 8.695781269e+00 1.62 1.888186822e+01 6.192692932e+00 1.460167860e+01 1.889053032e+01 1.890431368e+01 3.651901813e+00 7.119563383e+00 1.599191235e+01 2.430245889e+00 7.596597503e+00 1.64 1.704353004e+01 5.047612615e+00 1.298132300e+01 1.704840079e+01 1.705719431e+01 3.085939040e+00 6.083627190e+00 1.431085459e+01 1.843307431e+00 6.571492082e+00 1.66 1.532038159e+01 3.997559991e+00 1.147257416e+01 1.532151311e+01 1.532497293e+01 2.555241514e+00 5.123288789e+00 1.273966940e+01 1.303399219e+00 5.617779531e+00 1.68 1.370608706e+01 3.039424704e+00 1.006998803e+01 1.370409938e+01 1.370242473e+01 2.058351780e+00 4.235067102e+00 1.127100861e+01 8.079897509e-01 4.732474323e+00 1.70 1.219501892e+01 2.170190532e+00 8.768244700e+00 1.219054151e+01 1.218433157e+01 1.593462491e+00 3.415049295e+00 9.898547761e+00 3.547792915e-01 3.912948177e+00 1.72 1.078169336e+01 1.386336575e+00 7.562578648e+00 1.077527284e+01 1.076554351e+01 1.158994851e+00 2.658989179e+00 8.616754332e+00 -5.818193701e-02 3.156660831e+00 1.74 9.459722210e+00 6.845343249e-01 6.448375679e+00 9.452432801e+00 9.440786501e+00 7.536069080e-01 1.962810669e+00 7.421002285e+00 -4.326047449e-01 2.460193524e+00 1.76 8.223652909e+00 5.969756144e-02 5.420758820e+00 8.216959229e+00 8.205343636e+00 3.758526226e-01 1.322774759e+00 6.307798090e+00 -7.709863718e-01 1.819806007e+00 1.78 7.070555893e+00 -4.939383315e-01 4.474864264e+00 7.065512321e+00 7.055637965e+00 2.423892240e-02 7.351761438e-01 5.274540009e+00 -1.076480930e+00 1.232686188e+00 1.80 5.997678036e+00 -9.830668757e-01 3.605924085e+00 5.994735964e+00 5.987822399e+00 -3.124401097e-01 1.970414999e-01 4.318266206e+00 -1.352574893e+00 6.960625451e-01 1.82 5.002079356e+00 -1.414433859e+00 2.808864220e+00 5.001142505e+00 4.997813287e+00 -6.383380097e-01 -2.936754298e-01 3.435565493e+00 -1.602324670e+00 2.070310230e-01 1.84 4.080149712e+00 -1.793693815e+00 2.077950046e+00 4.081101041e+00 4.081518414e+00 -9.501174271e-01 -7.385574928e-01 2.622696617e+00 -1.828293010e+00 -2.378670016e-01 1.86 3.228607752e+00 -2.126265101e+00 1.407705891e+00 3.231224063e+00 3.235125378e+00 -1.245436479e+00 -1.139322019e+00 1.876356870e+00 -2.035889245e+00 -6.416187919e-01 1.88 2.444582896e+00 -2.417279805e+00 7.935551125e-01 2.448684817e+00 2.455509000e+00 -1.521790571e+00 -1.497853873e+00 1.193516186e+00 -2.235951643e+00 -1.006452517e+00 1.90 1.725113111e+00 -2.671310903e+00 2.310427816e-01 1.730682095e+00 1.739781949e+00 -1.777167695e+00 -1.816407898e+00 5.714810992e-01 -2.427358353e+00 -1.334580995e+00 1.92 1.067119931e+00 -2.892609148e+00 -2.841424825e-01 1.074108723e+00 1.084773948e+00 -2.010126571e+00 -2.097085355e+00 7.580511976e-03 -2.608267369e+00 -1.628393137e+00 1.94 4.676150648e-01 -3.085418760e+00 -7.552171672e-01 4.759094249e-01 4.873939803e-01 -2.220173864e+00 -2.342509812e+00 -5.010630710e-01 -2.777243324e+00 -1.890429237e+00 1.96 -7.593259757e-02 -3.253765066e+00 -1.184456680e+00 -6.670698088e-02 -5.521557574e-02 -2.406845407e+00 -2.555551784e+00 -9.573183933e-01 -2.932729372e+00 -2.122929269e+00 1.98 -5.660911282e-01 -3.403804194e+00 -1.573988021e+00 -5.565043249e-01 -5.457866405e-01 -2.570275565e+00 -2.739342335e+00 -1.364100994e+00 -3.073156913e+00 -2.328129518e+00 2.00 -1.005943126e+00 -3.546135520e+00 -1.925979603e+00 -9.966509632e-01 -9.873627275e-01 -2.710769320e+00 -2.897313133e+00 -1.724697485e+00 -3.197384461e+00 -2.508476318e+00 2.02 -1.398731797e+00 -3.678495289e+00 -2.242461955e+00 -1.390438347e+00 -1.383073522e+00 -2.828432243e+00 -3.032824748e+00 -2.042629761e+00 -3.304611930e+00 -2.666469541e+00 2.04 -1.747700589e+00 -3.799126794e+00 -2.525363851e+00 -1.741036548e+00 -1.735928133e+00 -2.923169138e+00 -3.150975597e+00 -2.321640205e+00 -3.394370481e+00 -2.804615354e+00 2.06 -2.056219248e+00 -3.907535868e+00 -2.776571425e+00 -2.051747683e+00 -2.049067471e+00 -2.994917298e+00 -3.262326827e+00 -2.565861271e+00 -3.466752387e+00 -2.932736338e+00 2.08 -2.328110693e+00 -4.003193343e+00 -2.997658390e+00 -2.326176297e+00 -2.325931634e+00 -3.045525698e+00 -3.368219606e+00 -2.779650451e+00 -3.522241025e+00 -3.057332718e+00 2.10 -2.567209800e+00 -4.086224864e+00 -3.190279066e+00 -2.567929785e+00 -2.570000937e+00 -3.077846254e+00 -3.468409894e+00 -2.967315178e+00 -3.561508521e+00 -3.176979060e+00 2.12 -2.777371542e+00 -4.157101531e+00 -3.356525814e+00 -2.780701276e+00 -2.784906618e+00 -3.095115968e+00 -3.562096034e+00 -3.133170990e+00 -3.585401105e+00 -3.290260556e+00 2.14 -2.962532455e+00 -4.215848451e+00 -3.499068796e+00 -2.968280373e+00 -2.974387397e+00 -3.100558785e+00 -3.648270198e+00 -3.281578966e+00 -3.594749995e+00 -3.395865587e+00 2.16 -3.126400109e+00 -4.262441298e+00 -3.627473652e+00 -3.134217251e+00 -3.141951873e+00 -3.097309394e+00 -3.725769755e+00 -3.415770798e+00 -3.590473678e+00 -3.492179584e+00 2.18 -3.272607305e+00 -4.296583590e+00 -3.744225461e+00 -3.282014880e+00 -3.291062287e+00 -3.088073573e+00 -3.794034173e+00 -3.537458874e+00 -3.573867507e+00 -3.577839629e+00 2.20 -3.404739286e+00 -4.318663679e+00 -3.848745514e+00 -3.415141134e+00 -3.425097951e+00 -3.075056474e+00 -3.852903443e+00 -3.656946049e+00 -3.547453393e+00 -3.652132336e+00 2.22 -3.525355775e+00 -4.329448154e+00 -3.941823713e+00 -3.536659875e+00 -3.547547539e+00 -3.059886185e+00 -3.902425888e+00 -3.775961141e+00 -3.513601660e+00 -3.714894215e+00 2.24 -3.642719065e+00 -4.329759324e+00 -4.024279857e+00 -3.655542072e+00 -3.667982673e+00 -3.043063476e+00 -3.942176877e+00 -3.890554385e+00 -3.473810681e+00 -3.765952754e+00 2.26 -3.760764240e+00 -4.320508062e+00 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