# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2018--Farkas-D-Caro-A--Fe-Ni-Cr-Co-Cu # implementation = 2018--Farkas-D--Fe-Ni-Cr-Co-Cu--LAMMPS--ipr2 # 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 2022-05-24 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 -5.302379894e+02 nan 0.76 nan nan nan nan nan nan nan nan -4.889920394e+02 nan 0.78 nan nan nan nan nan nan nan nan -4.518569077e+02 nan 0.80 nan nan nan nan nan -3.608970884e+02 nan nan -4.182638772e+02 nan 0.82 nan nan nan nan nan -3.338745241e+02 nan nan -3.877894287e+02 nan 0.84 nan nan nan nan nan -3.087024837e+02 nan nan -3.598672690e+02 nan 0.86 nan nan nan nan nan -2.851376953e+02 nan nan -3.341409897e+02 nan 0.88 nan nan nan nan nan -2.629223139e+02 nan nan -3.103762713e+02 nan 0.90 nan -3.916401790e+02 nan -5.628888836e+02 -5.632339578e+02 -2.417966499e+02 nan nan -2.884418040e+02 -3.935166090e+02 0.92 nan -3.651889296e+02 nan -5.256223757e+02 -5.258151564e+02 -2.218013176e+02 -3.719973979e+02 nan -2.682473295e+02 -3.678965515e+02 0.94 nan -3.410302409e+02 nan -4.913411461e+02 -4.913436819e+02 -2.031144863e+02 -3.485722270e+02 nan -2.496539411e+02 -3.440151256e+02 0.96 nan -3.190495023e+02 nan -4.597821109e+02 -4.596025430e+02 -1.856474073e+02 -3.268185976e+02 nan -2.324889480e+02 -3.217501201e+02 0.98 nan -2.989729317e+02 nan -4.307568746e+02 -4.304095789e+02 -1.693038514e+02 -3.064224497e+02 nan -2.165535268e+02 -3.010785955e+02 1.00 nan -2.804834943e+02 nan -4.040758405e+02 -4.036256639e+02 -1.540265304e+02 -2.872894989e+02 nan -2.017260225e+02 -2.819010819e+02 1.02 -3.799142631e+02 -2.634207365e+02 -3.475599294e+02 -3.796298405e+02 -3.791723440e+02 -1.397761836e+02 -2.693882752e+02 -3.572985472e+02 -1.878414404e+02 -2.641990123e+02 1.04 -3.574327801e+02 -2.476935914e+02 -3.270626862e+02 -3.572663015e+02 -3.569088330e+02 -1.265917655e+02 -2.527070400e+02 -3.362774858e+02 -1.747101678e+02 -2.477873363e+02 1.06 -3.368194762e+02 -2.331263475e+02 -3.081415180e+02 -3.367202670e+02 -3.365242560e+02 -1.145471192e+02 -2.371831219e+02 -3.168362485e+02 -1.621984771e+02 -2.325761839e+02 1.08 -3.177535655e+02 -2.195280256e+02 -2.907226181e+02 -3.177202131e+02 -3.177025611e+02 -1.037146424e+02 -2.227636040e+02 -2.987290286e+02 -1.502524447e+02 -2.185222511e+02 1.10 -2.999436379e+02 -2.068018327e+02 -2.745908599e+02 -3.000136186e+02 -3.001697293e+02 -9.409717658e+01 -2.093879852e+02 -2.817704769e+02 -1.388245588e+02 -2.054291612e+02 1.12 -2.832132787e+02 -1.948759788e+02 -2.595022582e+02 -2.834248188e+02 -2.837333909e+02 -8.563337942e+01 -1.969553932e+02 -2.658534713e+02 -1.278733236e+02 -1.930834756e+02 1.14 -2.674869485e+02 -1.836980259e+02 -2.452886202e+02 -2.678330981e+02 -2.682429855e+02 -7.821724598e+01 -1.853136279e+02 -2.509601473e+02 -1.173624349e+02 -1.813219776e+02 1.16 -2.527478740e+02 -1.731897895e+02 -2.318415460e+02 -2.531792136e+02 -2.536184843e+02 -7.167084617e+01 -1.743239908e+02 -2.371207548e+02 -1.073112016e+02 -1.700073380e+02 1.18 -2.390025391e+02 -1.633160461e+02 -2.191122428e+02 -2.394500191e+02 -2.398483633e+02 -6.584758508e+01 -1.638967779e+02 -2.243452900e+02 -9.778571097e+01 -1.590478060e+02 1.20 -2.263006927e+02 -1.540012588e+02 -2.070997815e+02 -2.266617399e+02 -2.269523018e+02 -6.063773189e+01 -1.539536531e+02 -2.125653189e+02 -8.883745017e+01 -1.484127671e+02 1.22 -2.146314094e+02 -1.451119218e+02 -1.958517191e+02 -2.147967331e+02 -2.149240789e+02 -5.596716698e+01 -1.444241036e+02 -2.016205754e+02 -8.046595777e+01 -1.380745329e+02 1.24 -2.038141916e+02 -1.365163342e+02 -1.854378918e+02 -2.037453521e+02 -2.036882236e+02 -5.178178360e+01 -1.352371001e+02 -1.913457929e+02 -7.266467722e+01 -1.280281038e+02 1.26 -1.936776215e+02 -1.281045389e+02 -1.758307653e+02 -1.933900797e+02 -1.931573963e+02 -4.803152460e+01 -1.263253606e+02 -1.816214123e+02 -6.542207860e+01 -1.183112948e+02 1.28 -1.840530124e+02 -1.198174772e+02 -1.669172653e+02 -1.836187469e+02 -1.832488923e+02 -4.464399562e+01 -1.176252582e+02 -1.723551180e+02 -5.871987744e+01 -1.089537296e+02 1.30 -1.748355372e+02 -1.116528812e+02 -1.585153497e+02 -1.743453036e+02 -1.738919466e+02 -4.150074558e+01 -1.090800766e+02 -1.634869507e+02 -5.254699099e+01 -1.000189772e+02 1.32 -1.659988170e+02 -1.036364692e+02 -1.505061931e+02 -1.655194840e+02 -1.650357301e+02 -3.851785545e+01 -1.006716735e+02 -1.549804766e+02 -4.690022563e+01 -9.157237091e+01 1.34 -1.575160938e+02 -9.578589771e+01 -1.428026527e+02 -1.570919779e+02 -1.566350752e+02 -3.563484400e+01 -9.241490522e+01 -1.468043865e+02 -4.175998953e+01 -8.361721144e+01 1.36 -1.493494457e+02 -8.812052904e+01 -1.353074693e+02 -1.490144031e+02 -1.486392294e+02 -3.279006648e+01 -8.434602258e+01 -1.389212805e+02 -3.709396591e+01 -7.614431323e+01 1.38 -1.414714711e+02 -8.066539336e+01 -1.279477713e+02 -1.412493886e+02 -1.409958248e+02 -2.993955314e+01 -7.653089283e+01 -1.312767921e+02 -3.286735302e+01 -6.915475625e+01 1.40 -1.338625156e+02 -7.344640217e+01 -1.206910161e+02 -1.337651850e+02 -1.336545207e+02 -2.706824687e+01 -6.904166126e+01 -1.238226160e+02 -2.903013209e+01 -6.266303575e+01 1.42 -1.265056181e+02 -6.645948575e+01 -1.135096554e+02 -1.265281685e+02 -1.265602738e+02 -2.415931533e+01 -6.192312064e+01 -1.165263629e+02 -2.553143088e+01 -5.669722361e+01 1.44 -1.193584403e+02 -5.969787310e+01 -1.063774864e+02 -1.194888594e+02 -1.196476840e+02 -2.119693491e+01 -5.521568959e+01 -1.093540469e+02 -2.232153409e+01 -5.127382008e+01 1.46 -1.123245634e+02 -5.316050951e+01 -9.926290618e+01 -1.125635693e+02 -1.128319670e+02 -1.816726976e+01 -4.895987542e+01 -1.022720351e+02 -1.934679957e+01 -4.634823827e+01 1.48 -1.053588972e+02 -4.685896084e+01 -9.213545542e+01 -1.057049144e+02 -1.060616891e+02 -1.505797415e+01 -4.317053790e+01 -9.528010625e+01 -1.655497042e+01 -4.186621607e+01 1.50 -9.847709759e+01 -4.080609720e+01 -8.498288689e+01 -9.890574338e+01 -9.932160081e+01 -1.197055657e+01 -3.783574913e+01 -8.839384083e+01 -1.390077289e+01 -3.776987701e+01 1.52 -9.170142284e+01 -3.500878010e+01 -7.782157329e+01 -9.216903896e+01 -9.261109300e+01 -9.406101449e+00 -3.294051993e+01 -8.162747850e+01 -1.141516139e+01 -3.400549655e+01 1.54 -8.503826677e+01 -2.947754851e+01 -7.068853788e+01 -8.549937623e+01 -8.593638011e+01 -7.362409877e+00 -2.846572892e+01 -7.498873544e+01 -9.405658280e+00 -3.051795765e+01 1.56 -7.848649524e+01 -2.422840129e+01 -6.364349618e+01 -7.890440931e+01 -7.930760822e+01 -5.775983864e+00 -2.438628761e+01 -6.848288213e+01 -7.818398154e+00 -2.725388769e+01 1.58 -7.205171978e+01 -1.928514741e+01 -5.676556878e+01 -7.240040309e+01 -7.274359362e+01 -4.582928640e+00 -2.067762660e+01 -6.211495688e+01 -6.563135618e+00 -2.416649523e+01 1.60 -6.575178477e+01 -1.466903603e+01 -5.012946392e+01 -6.601210169e+01 -6.627243055e+01 -3.713943395e+00 -1.731110054e+01 -5.589945073e+01 -5.573076179e+00 -2.123210770e+01 1.62 -5.959536258e+01 -1.038857468e+01 -4.378137054e+01 -5.975342692e+01 -5.991541505e+01 -3.090684809e+00 -1.425340520e+01 -4.984832174e+01 -4.797286944e+00 -1.843263736e+01 1.64 -5.358706468e+01 -6.899688801e+00 -3.775267345e+01 -5.363631245e+01 -5.369408621e+01 -2.629642775e+00 -1.147946815e+01 -4.397474332e+01 -4.194877741e+00 -1.574703533e+01 1.66 -4.773852973e+01 -4.454325385e+00 -3.208101560e+01 -4.768735101e+01 -4.764856772e+01 -2.254544811e+00 -9.238555788e+00 -3.829743436e+01 -3.732193202e+00 -1.315587958e+01 1.68 -4.206374000e+01 -2.863531188e+00 -2.678810834e+01 -4.193116762e+01 -4.181253906e+01 -1.900124870e+00 -7.533252920e+00 -3.284204986e+01 -3.381495966e+00 -1.084491317e+01 1.70 -3.657922889e+01 -1.896400203e+00 -2.186671502e+01 -3.638597008e+01 -3.620531237e+01 -1.541267314e+00 -6.227671420e+00 -2.763815782e+01 -3.118570504e+00 -8.936665352e+00 1.72 -3.130179152e+01 -1.372854378e+00 -1.730666340e+01 -3.107019503e+01 -3.084729344e+01 -1.272806446e+00 -5.226565297e+00 -2.271351555e+01 -2.919713064e+00 -7.357817208e+00 1.74 -2.625234783e+01 -1.155706834e+00 -1.309801077e+01 -2.600464582e+01 -2.576053057e+01 -1.136424140e+00 -4.461422981e+00 -1.808824477e+01 -2.761202238e+00 -6.058946804e+00 1.76 -2.146699880e+01 -1.145668907e+00 -9.247367708e+00 -2.122169837e+01 -2.097432935e+01 -1.085426615e+00 -3.882425268e+00 -1.378734801e+01 -2.620928550e+00 -5.011166030e+00 1.78 -1.697753484e+01 -1.268404450e+00 -6.248790979e+00 -1.674627561e+01 -1.650806576e+01 -1.075291090e+00 -3.450486318e+00 -9.827761462e+00 -2.477641844e+00 -4.187753962e+00 1.80 -1.280572882e+01 -1.466261556e+00 -4.167073706e+00 -1.259284739e+01 -1.237041675e+01 -1.074073584e+00 -3.134667521e+00 -6.585366510e+00 -2.332917591e+00 -3.558280662e+00 1.82 -8.984694409e+00 -1.697991983e+00 -2.770807123e+00 -8.799882866e+00 -8.606112276e+00 -1.077598258e+00 -2.911927363e+00 -4.333353651e+00 -2.229283099e+00 -3.092941177e+00 1.84 -6.026760070e+00 -1.937384221e+00 -1.880300022e+00 -5.890511411e+00 -5.748949788e+00 -1.087055136e+00 -2.763909881e+00 -2.820291640e+00 -2.196101992e+00 -2.761498578e+00 1.86 -3.980503965e+00 -2.168193788e+00 -1.356414655e+00 -3.873366868e+00 -3.766601438e+00 -1.102796733e+00 -2.675786703e+00 -1.843360635e+00 -2.219314003e+00 -2.532056168e+00 1.88 -2.603035152e+00 -2.385054532e+00 -1.094250959e+00 -2.514921028e+00 -2.432216051e+00 -1.126411560e+00 -2.635297253e+00 -1.251081394e+00 -2.278418145e+00 -2.375392638e+00 1.90 -1.711552945e+00 -2.589336966e+00 -1.015628405e+00 -1.638717782e+00 -1.573638238e+00 -1.160032220e+00 -2.629760845e+00 -9.331620977e-01 -2.354809683e+00 -2.268068983e+00 1.92 -1.171397667e+00 -2.783660850e+00 -1.062855405e+00 -1.112287725e+00 -1.060623955e+00 -1.205477420e+00 -2.645135051e+00 -8.095901068e-01 -2.431922728e+00 -2.192397173e+00 1.94 -8.842524258e-01 -2.967775755e+00 -1.195831651e+00 -8.372022149e-01 -7.959926820e-01 -1.263648852e+00 -2.667779816e+00 -8.225606885e-01 -2.501006972e+00 -2.133981184e+00 1.96 -7.780397973e-01 -3.138905508e+00 -1.384701721e+00 -7.412322307e-01 -7.083707953e-01 -1.332904604e+00 -2.685451164e+00 -9.302753602e-01 -2.562507631e+00 -2.079650427e+00 1.98 -7.980768172e-01 -3.294870259e+00 -1.605121546e+00 -7.705183005e-01 -7.448392629e-01 -1.410165464e+00 -2.690839392e+00 -1.102439569e+00 -2.618304607e+00 -2.036521959e+00 2.00 -9.048403464e-01 -3.436646303e+00 -1.839562168e+00 -8.865624457e-01 -8.676674144e-01 -1.492782800e+00 -2.698143596e+00 -1.317312489e+00 -2.670885851e+00 -2.032411498e+00 2.02 -1.071091116e+00 -3.566645715e+00 -2.075781065e+00 -1.062557014e+00 -1.050380580e+00 -1.578668644e+00 -2.728113972e+00 -1.558525131e+00 -2.722797361e+00 -2.086051841e+00 2.04 -1.278684533e+00 -3.686172058e+00 -2.306249125e+00 -1.279313717e+00 -1.273617362e+00 -1.666692803e+00 -2.794119151e+00 -1.813346362e+00 -2.775730175e+00 -2.187020327e+00 2.06 -1.514745376e+00 -3.795265807e+00 -2.527129910e+00 -1.522202056e+00 -1.522446995e+00 -1.756535981e+00 -2.889282880e+00 -2.070675381e+00 -2.829628764e+00 -2.319603874e+00 2.08 -1.767479256e+00 -3.893218950e+00 -2.736541478e+00 -1.778947047e+00 -1.784620524e+00 -1.847538060e+00 -3.002944434e+00 -2.320740315e+00 -2.882784496e+00 -2.469481733e+00 2.10 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