# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2025--Kushnerov-O-I-Ryabtsev-S-I-Bashev-V-F--Co-Cr-Fe-Ni-Mn-Al # implementation = 2025--Kushnerov-O-I--Co-Cr-Fe-Ni-Mn-Al--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 2025-07-01 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 nan nan 0.76 nan nan nan nan nan nan nan nan nan nan 0.78 nan nan nan nan nan nan nan nan 3.673756707e+02 nan 0.80 nan nan nan nan nan nan nan nan 3.319216767e+02 nan 0.82 nan nan nan nan nan nan nan nan 3.003367882e+02 nan 0.84 nan nan nan nan nan 2.334268291e+02 nan nan 2.719303624e+02 nan 0.86 nan nan nan nan nan 2.116335514e+02 nan nan 2.462703153e+02 nan 0.88 nan nan nan nan nan 1.921146404e+02 nan nan 2.233610734e+02 nan 0.90 nan nan nan nan nan 1.745879799e+02 nan nan 2.026193385e+02 nan 0.92 nan nan nan nan nan 1.586448978e+02 nan nan 1.838775310e+02 nan 0.94 nan nan nan nan nan 1.444054615e+02 nan nan 1.670553554e+02 nan 0.96 nan 2.252302065e+02 nan 3.654278668e+02 3.653986538e+02 1.314544750e+02 nan nan 1.517553315e+02 2.293777352e+02 0.98 nan 2.054069549e+02 nan 3.361447622e+02 3.361690568e+02 1.195688780e+02 2.120716275e+02 nan 1.377960487e+02 2.096718207e+02 1.00 nan 1.875000916e+02 nan 3.090806970e+02 3.090717735e+02 1.090174686e+02 1.937167748e+02 nan 1.251894018e+02 1.918972828e+02 1.02 nan 1.710991238e+02 nan 2.845253764e+02 2.845349965e+02 9.928464618e+01 1.771662028e+02 nan 1.138439148e+02 1.753135194e+02 1.04 nan 1.562904301e+02 nan 2.620337330e+02 2.620636958e+02 9.036908154e+01 1.619706509e+02 nan 1.034344269e+02 1.605193327e+02 1.06 nan 1.426604884e+02 nan 2.412689374e+02 2.412859705e+02 8.240137233e+01 1.481552153e+02 nan 9.396917281e+01 1.468040760e+02 1.08 nan 1.301928674e+02 1.958074542e+02 2.221618882e+02 2.221370516e+02 7.526966958e+01 1.355261676e+02 2.036485074e+02 8.538096789e+01 1.343376692e+02 1.10 2.049901110e+02 1.189162489e+02 1.802149050e+02 2.048382532e+02 2.048152156e+02 6.865684844e+01 1.238339663e+02 1.874599615e+02 7.761737356e+01 1.231075553e+02 1.12 1.887414903e+02 1.084231445e+02 1.656242769e+02 1.887273935e+02 1.886985408e+02 6.258847001e+01 1.133385496e+02 1.724212632e+02 7.048088635e+01 1.125485229e+02 1.14 1.741189652e+02 9.902170592e+01 1.521492184e+02 1.740672040e+02 1.741265490e+02 5.697562088e+01 1.035850064e+02 1.586749021e+02 6.397106765e+01 1.028489162e+02 1.16 1.603292304e+02 9.024407871e+01 1.399289301e+02 1.604491567e+02 1.605029388e+02 5.193793918e+01 9.464039606e+01 1.460138942e+02 5.797551255e+01 9.413352612e+01 1.18 1.477224927e+02 8.230220810e+01 1.286116779e+02 1.478162850e+02 1.478336013e+02 4.733974914e+01 8.649369836e+01 1.343956905e+02 5.256043244e+01 8.622327414e+01 1.20 1.361911329e+02 7.486624322e+01 1.185410439e+02 1.362708912e+02 1.362885037e+02 4.319159159e+01 7.897581786e+01 1.236842012e+02 4.762018486e+01 7.872055969e+01 1.22 1.257233990e+02 6.825718249e+01 1.089195041e+02 1.256707017e+02 1.256865098e+02 3.935725578e+01 7.211781263e+01 1.138361132e+02 4.308488426e+01 7.195281453e+01 1.24 1.158096263e+02 6.199118708e+01 9.997115472e+01 1.158238790e+02 1.158181930e+02 3.576462130e+01 6.570862064e+01 1.047455010e+02 3.895546347e+01 6.588288096e+01 1.26 1.067439547e+02 5.645089137e+01 9.192111469e+01 1.066932923e+02 1.066849283e+02 3.251813223e+01 5.986139734e+01 9.638290676e+01 3.514436051e+01 6.011859089e+01 1.28 9.832146741e+01 5.116966786e+01 8.438192946e+01 9.820098491e+01 9.817794834e+01 2.956923536e+01 5.463101281e+01 8.853061035e+01 3.170110821e+01 5.479011419e+01 1.30 9.044608054e+01 4.648358867e+01 7.746538050e+01 9.045399189e+01 9.046970834e+01 2.693163290e+01 4.974572287e+01 8.129236691e+01 2.856940262e+01 4.994172256e+01 1.32 8.331064832e+01 4.205328380e+01 7.096235829e+01 8.329496398e+01 8.328841611e+01 2.439526041e+01 4.529750121e+01 7.460870642e+01 2.566655923e+01 4.540668767e+01 1.34 7.654256019e+01 3.794880447e+01 6.520178098e+01 7.663060420e+01 7.662529845e+01 2.211593334e+01 4.105848300e+01 6.851913156e+01 2.303290804e+01 4.124090783e+01 1.36 7.036427603e+01 3.429159752e+01 5.963604504e+01 7.044492875e+01 7.048232508e+01 1.998656362e+01 3.722206661e+01 6.280461688e+01 2.062990625e+01 3.749118875e+01 1.38 6.473752684e+01 3.090719815e+01 5.451853926e+01 6.476702288e+01 6.480040048e+01 1.805665013e+01 3.365354600e+01 5.755432461e+01 1.839323636e+01 3.413201931e+01 1.40 5.935771777e+01 2.771804970e+01 4.977327321e+01 5.942665790e+01 5.945646844e+01 1.626897563e+01 3.041651471e+01 5.269663630e+01 1.641136469e+01 3.087046470e+01 1.42 5.446165020e+01 2.487409207e+01 4.539109237e+01 5.446207892e+01 5.446846205e+01 1.463156883e+01 2.745677307e+01 4.816470788e+01 1.453936004e+01 2.795399974e+01 1.44 4.984654927e+01 2.230698533e+01 4.157504707e+01 4.988568796e+01 4.989157220e+01 1.324738745e+01 2.474936473e+01 4.404627134e+01 1.292453152e+01 2.518963473e+01 1.46 4.581374975e+01 1.984463759e+01 3.798106483e+01 4.574076919e+01 4.573782980e+01 1.203162473e+01 2.217626048e+01 4.023175782e+01 1.134551608e+01 2.272855803e+01 1.48 4.183287227e+01 1.756718060e+01 3.448377985e+01 4.180939942e+01 4.180700962e+01 1.074174208e+01 1.983920805e+01 3.665090038e+01 9.915347642e+00 2.038465372e+01 1.50 3.824750210e+01 1.548017119e+01 3.125375125e+01 3.827326883e+01 3.827135892e+01 9.560683315e+00 1.770122379e+01 3.332485953e+01 8.591543216e+00 1.835015985e+01 1.52 3.482545648e+01 1.369356027e+01 2.835392628e+01 3.484875089e+01 3.484725879e+01 8.479283109e+00 1.575558505e+01 3.028834643e+01 7.434622455e+00 1.635817687e+01 1.54 3.181986006e+01 1.196981420e+01 2.575178393e+01 3.178007627e+01 3.175866304e+01 7.570334659e+00 1.397124615e+01 2.745433629e+01 6.331322389e+00 1.469078462e+01 1.56 2.886998391e+01 1.035076080e+01 2.318170523e+01 2.887774465e+01 2.885879064e+01 6.655386947e+00 1.239043133e+01 2.483357248e+01 5.327386860e+00 1.299338419e+01 1.58 2.618182427e+01 8.890877690e+00 2.083710936e+01 2.616794682e+01 2.615118218e+01 5.846286955e+00 1.085361842e+01 2.237012390e+01 4.487639510e+00 1.145652551e+01 1.60 2.365032653e+01 7.534768318e+00 1.864392741e+01 2.367961829e+01 2.370629243e+01 5.077423004e+00 9.499032500e+00 2.007960011e+01 3.692557917e+00 1.002479667e+01 1.62 2.130754161e+01 6.436725273e+00 1.661982588e+01 2.137499839e+01 2.139918280e+01 4.374279931e+00 8.173897034e+00 1.801946150e+01 2.928434514e+00 8.711603042e+00 1.64 1.930145274e+01 5.291495129e+00 1.475219067e+01 1.926118388e+01 1.926288859e+01 3.731477386e+00 6.974692502e+00 1.611249529e+01 2.256271492e+00 7.507652795e+00 1.66 1.727957631e+01 4.247073034e+00 1.310969385e+01 1.730365709e+01 1.732540977e+01 3.144096985e+00 5.863288291e+00 1.432513001e+01 1.626493828e+00 6.404413191e+00 1.68 1.540970360e+01 3.295477691e+00 1.159308791e+01 1.545154837e+01 1.547128928e+01 2.647617577e+00 4.847110620e+00 1.264721759e+01 1.076349239e+00 5.394043256e+00 1.70 1.368083015e+01 2.429371338e+00 1.011377180e+01 1.371870704e+01 1.373662462e+01 2.154063542e+00 3.987697528e+00 1.115236780e+01 6.104801158e-01 4.629149875e+00 1.72 1.208279392e+01 1.726494570e+00 8.751072431e+00 1.215715662e+01 1.217342146e+01 1.703920693e+00 3.133620654e+00 9.774642546e+00 1.494432336e-01 3.768044345e+00 1.74 1.060620412e+01 1.065817996e+00 7.577126398e+00 1.067349553e+01 1.068826206e+01 1.374390657e+00 2.383312683e+00 8.448503682e+00 -2.756747435e-01 2.981340342e+00 1.76 9.487042420e+00 4.250729910e-01 6.415025935e+00 9.405213547e+00 9.398232741e+00 9.932689261e-01 1.671256930e+00 7.361040176e+00 -6.150349373e-01 2.344825340e+00 1.78 8.205153061e+00 -1.751923204e-01 5.346479745e+00 8.130827821e+00 8.124514087e+00 6.466340159e-01 1.063691669e+00 6.223641819e+00 -9.513532518e-01 1.682479027e+00 1.80 7.022666067e+00 -7.174875787e-01 4.364659609e+00 6.997308788e+00 6.991600359e+00 3.317198807e-01 4.714383065e-01 5.219248270e+00 -1.242539859e+00 1.079260546e+00 1.82 6.018721257e+00 -1.177671162e+00 3.571032445e+00 5.952620460e+00 5.925903979e+00 4.598648369e-02 -3.863987129e-02 4.267883873e+00 -1.511779046e+00 5.593312115e-01 1.84 5.006566000e+00 -1.620047477e+00 2.734517246e+00 4.946481086e+00 4.922194525e+00 -2.128998534e-01 -4.312127333e-01 3.379451613e+00 -1.740203705e+00 5.840352482e-02 1.86 4.074760434e+00 -1.974035908e+00 2.129501672e+00 4.080707672e+00 4.078818560e+00 -3.663364372e-01 -8.818781668e-01 2.620052592e+00 -1.921633744e+00 -3.958724726e-01 1.88 3.217597246e+00 -2.268350285e+00 1.413610787e+00 3.244019424e+00 3.242355048e+00 -5.849349317e-01 -1.288493007e+00 1.896289168e+00 -2.112276353e+00 -8.071166003e-01 1.90 2.516369989e+00 -2.572419853e+00 7.591620613e-01 2.508140997e+00 2.495853110e+00 -7.819894479e-01 -1.654516031e+00 1.233537685e+00 -2.289589661e+00 -1.092082873e+00 1.92 1.785541470e+00 -2.863844357e+00 1.616644177e-01 1.778102485e+00 1.766923121e+00 -9.592258107e-01 -1.983141441e+00 5.984259668e-01 -2.444709287e+00 -1.434481371e+00 1.94 1.115220344e+00 -3.121880979e+00 -3.417261183e-01 1.115382728e+00 1.105212129e+00 -1.076912310e+00 -2.277319941e+00 1.824586680e-02 -2.558545941e+00 -1.742492709e+00 1.96 5.011130644e-01 -3.349244456e+00 -8.410154271e-01 5.446950251e-01 5.354422349e-01 -1.222654997e+00 -2.510993365e+00 -5.109795645e-01 -2.655894046e+00 -2.018807876e+00 1.98 -6.076970102e-02 -3.548441949e+00 -1.294669958e+00 -2.075624611e-02 -2.917413773e-02 -1.352683726e+00 -2.724967615e+00 -9.655102017e-01 -2.738196498e+00 -2.265914277e+00 2.00 -4.902014529e-01 -3.721789279e+00 -1.706041809e+00 -4.954339185e-01 -5.030924711e-01 -1.468265601e+00 -2.935349876e+00 -1.349964021e+00 -2.805298079e+00 -2.402177165e+00 2.02 -9.653955692e-01 -3.871425810e+00 -2.078243099e+00 -9.701919182e-01 -9.771599772e-01 -1.570568621e+00 -3.120683915e+00 -1.754134535e+00 -2.881342312e+00 -2.604488962e+00 2.04 -1.398162986e+00 -3.999328098e+00 -2.414163938e+00 -1.361608366e+00 -1.326996411e+00 -1.660669756e+00 -3.226188613e+00 -2.091467325e+00 -2.944060776e+00 -2.783421034e+00 2.06 -1.791533134e+00 -4.046451835e+00 -2.716488936e+00 -1.757924989e+00 -1.726053361e+00 -1.739562306e+00 -3.357983627e+00 -2.424257348e+00 -2.994649298e+00 -2.940839188e+00 2.08 -2.148324841e+00 -4.120165928e+00 -2.987712388e+00 -2.117427711e+00 -2.088081640e+00 -1.808162638e+00 -3.485008899e+00 -2.724020315e+00 -3.034207562e+00 -3.078469542e+00 2.10 -2.385688363e+00 -4.184454665e+00 -3.152933430e+00 -2.399062175e+00 -2.389067735e+00 -1.830852806e+00 -3.582417815e+00 -2.920754485e+00 -3.063746820e+00 -3.127419035e+00 2.12 -2.642490326e+00 -4.237978955e+00 -3.339300272e+00 -2.676379941e+00 -2.671505427e+00 -1.864472510e+00 -3.644338099e+00 -3.162260184e+00 -3.063497363e+00 -3.200639661e+00 2.14 -2.913951791e+00 -4.289143552e+00 -3.538818652e+00 -2.945264662e+00 -2.940803935e+00 -1.911181263e+00 -3.724220170e+00 -3.382482040e+00 -3.077324279e+00 -3.295834230e+00 2.16 -3.157562830e+00 -4.327082267e+00 -3.714924082e+00 -3.186494949e+00 -3.182414391e+00 -1.950285054e+00 -3.761661301e+00 -3.577989731e+00 -3.083578200e+00 -3.376340951e+00 2.18 -3.375352839e+00 -4.352976378e+00 -3.869398422e+00 -3.402085427e+00 -3.398354129e+00 -1.982423282e+00 -3.802443667e+00 -3.750637333e+00 -3.061765767e+00 -3.443378363e+00 2.20 -3.569212038e+00 -4.367917049e+00 -4.003898454e+00 -3.553415031e+00 -3.550004576e+00 -2.008186477e+00 -3.817330394e+00 -3.902149791e+00 -3.056614590e+00 -3.498074185e+00 2.22 -3.740901250e+00 -4.372912056e+00 -4.119964776e+00 -3.726276324e+00 -3.723160586e+00 -2.028120088e+00 -3.823540372e+00 -4.034132067e+00 -3.045793421e+00 -3.541472072e+00 2.24 -3.871391267e+00 -4.327552632e+00 -4.136351312e+00 -3.868187616e+00 -3.875677418e+00 -1.960049241e+00 -3.849829184e+00 -4.134297815e+00 -3.029879513e+00 -3.533198485e+00 2.26 -4.005075860e+00 -4.318428470e+00 -4.225851467e+00 -4.002116246e+00 -4.009091710e+00 -1.975900479e+00 -3.866541733e+00 -4.232613630e+00 -3.009403149e+00 -3.559877723e+00 2.28 -4.121071458e+00 -4.301716866e+00 -4.300472864e+00 -4.118338326e+00 -4.124835277e+00 -1.986872393e+00 -3.874537990e+00 -4.315500918e+00 -2.984851314e+00 -3.577721075e+00 2.30 -4.220713498e+00 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