# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2016--Beland-L-K-Lu-C-Osetskiy-Y-N-et-al--Ni-Co # implementation = 2016--Beland-L-K--Ni-Co--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 nan nan 0.76 nan nan nan nan nan nan nan nan nan nan 0.78 nan nan nan nan nan nan nan nan nan nan 0.80 nan nan nan nan nan nan nan nan 4.808441953e+02 nan 0.82 nan nan nan nan nan nan nan nan 4.260226935e+02 nan 0.84 nan nan nan nan nan nan nan nan 3.793654595e+02 nan 0.86 nan nan nan nan nan 3.508455998e+02 nan nan 3.396928399e+02 nan 0.88 nan nan nan nan nan 3.198785810e+02 nan nan 3.060392467e+02 nan 0.90 nan nan nan nan nan 2.939598351e+02 nan nan 2.775884761e+02 nan 0.92 nan nan nan nan nan 2.724076881e+02 nan nan 2.536171111e+02 nan 0.94 nan nan nan nan nan 2.546051079e+02 nan nan 2.335140782e+02 nan 0.96 nan nan nan nan nan 2.399925207e+02 nan nan 2.167498089e+02 nan 0.98 nan nan nan 3.999810586e+02 3.998517049e+02 2.280566824e+02 nan nan 2.028476090e+02 2.641639167e+02 1.00 nan 2.147416666e+02 nan 3.606315036e+02 3.605854249e+02 2.183229749e+02 2.354270809e+02 nan 1.913759039e+02 2.426131318e+02 1.02 nan 1.987403282e+02 nan 3.264851557e+02 3.265335132e+02 2.103628705e+02 2.171168273e+02 nan 1.819538398e+02 2.241787496e+02 1.04 nan 1.852183893e+02 nan 2.968189449e+02 2.969466015e+02 2.038570442e+02 2.014457416e+02 nan 1.742920334e+02 2.084501665e+02 1.06 nan 1.738096060e+02 nan 2.710688726e+02 2.712354140e+02 1.985441087e+02 1.881039104e+02 nan 1.681552692e+02 1.951020705e+02 1.08 nan 1.641817288e+02 nan 2.487510661e+02 2.489186753e+02 1.933607388e+02 1.768240022e+02 nan 1.633442905e+02 1.838486355e+02 1.10 nan 1.560747766e+02 nan 2.294346333e+02 2.295793444e+02 1.829952749e+02 1.673668448e+02 2.114264072e+02 1.596828198e+02 1.744398154e+02 1.12 2.126098063e+02 1.492931585e+02 1.909178915e+02 2.127257728e+02 2.128353341e+02 1.690597503e+02 1.595217196e+02 1.968882141e+02 1.570105077e+02 1.666529123e+02 1.14 1.981814039e+02 1.436777691e+02 1.789596086e+02 1.982658592e+02 1.983373568e+02 1.537595002e+02 1.531030980e+02 1.843269034e+02 1.523685374e+02 1.602839326e+02 1.16 1.856733069e+02 1.390998633e+02 1.687386600e+02 1.857273989e+02 1.857672637e+02 1.386010381e+02 1.479456084e+02 1.734733456e+02 1.428414265e+02 1.551439634e+02 1.18 1.748190019e+02 1.354464618e+02 1.600532631e+02 1.748487529e+02 1.748686560e+02 1.245570660e+02 1.438998543e+02 1.641386396e+02 1.307701951e+02 1.510739374e+02 1.20 1.654500973e+02 1.326207121e+02 1.527122408e+02 1.654599981e+02 1.654679958e+02 1.118688857e+02 1.408296159e+02 1.561695503e+02 1.178599131e+02 1.479544986e+02 1.22 1.574178275e+02 1.305373931e+02 1.465370976e+02 1.574124482e+02 1.574127013e+02 1.003730608e+02 1.386112426e+02 1.494245750e+02 1.052832398e+02 1.456779339e+02 1.24 1.505867208e+02 1.290226762e+02 1.413668703e+02 1.505695803e+02 1.505629869e+02 8.991597153e+01 1.371345579e+02 1.437749964e+02 9.376876552e+01 1.440449216e+02 1.26 1.448335804e+02 1.242049276e+02 1.370865721e+02 1.448086063e+02 1.447961986e+02 8.039263791e+01 1.339305914e+02 1.391037114e+02 8.341244882e+01 1.391499189e+02 1.28 1.400457853e+02 1.157136064e+02 1.336057579e+02 1.400188503e+02 1.400034544e+02 7.172505773e+01 1.265308292e+02 1.353050378e+02 7.408814118e+01 1.305919640e+02 1.30 1.361223018e+02 1.052847703e+02 1.308445880e+02 1.360999906e+02 1.360855478e+02 6.384329763e+01 1.167368083e+02 1.322844007e+02 6.568369415e+01 1.200923297e+02 1.32 1.329729219e+02 9.418517671e+01 1.287339677e+02 1.329606894e+02 1.329508972e+02 5.668439883e+01 1.059079933e+02 1.299575264e+02 5.809876927e+01 1.089020556e+02 1.34 1.305159166e+02 8.332236504e+01 1.272135776e+02 1.305168917e+02 1.305141226e+02 5.019141961e+01 9.502240501e+01 1.282480650e+02 5.124317525e+01 9.791161032e+01 1.36 1.286757006e+02 7.331651325e+01 1.254397272e+02 1.286908572e+02 1.286960812e+02 4.431243358e+01 8.476380848e+01 1.270882452e+02 4.503995571e+01 8.772280187e+01 1.38 1.273839106e+02 6.434669538e+01 1.199985927e+02 1.274112929e+02 1.274239175e+02 3.899940756e+01 7.545056626e+01 1.241145015e+02 3.943362511e+01 7.849497447e+01 1.40 1.256573801e+02 5.632253790e+01 1.118713648e+02 1.256870236e+02 1.257022054e+02 3.420731626e+01 6.702095990e+01 1.175639711e+02 3.437686650e+01 7.011889432e+01 1.42 1.203526117e+02 4.915594462e+01 1.023107433e+02 1.203776370e+02 1.203918334e+02 2.989363547e+01 5.939317887e+01 1.088667866e+02 2.982651222e+01 6.248789775e+01 1.44 1.124931225e+02 4.276698256e+01 9.225350834e+01 1.125124765e+02 1.125251776e+02 2.601779000e+01 5.249424234e+01 9.911236333e+01 2.574284367e+01 5.551715158e+01 1.46 1.032319393e+02 3.708302624e+01 8.239022932e+01 1.032458687e+02 1.032569488e+02 2.254140136e+01 4.625863875e+01 8.911986289e+01 2.208869960e+01 4.915107061e+01 1.48 9.344129567e+01 3.203811951e+01 7.321537011e+01 9.344988276e+01 9.345897593e+01 1.942869718e+01 4.062718021e+01 7.949159117e+01 1.882877260e+01 4.334228888e+01 1.50 8.377088971e+01 2.757196775e+01 6.492270988e+01 8.377358209e+01 8.377984119e+01 1.664667161e+01 3.554603186e+01 7.063167197e+01 1.592935655e+01 3.804878164e+01 1.52 7.469272282e+01 2.362886863e+01 5.744805570e+01 7.468890752e+01 7.469114856e+01 1.416529626e+01 3.096574765e+01 6.260265879e+01 1.335812123e+01 3.323302634e+01 1.54 6.642578483e+01 2.015681897e+01 5.071876545e+01 6.641580257e+01 6.641313212e+01 1.195740785e+01 2.684087352e+01 5.533437078e+01 1.108398624e+01 2.886132075e+01 1.56 5.892297366e+01 1.710676024e+01 4.466806852e+01 5.890788233e+01 5.889996657e+01 9.997985010e+00 2.312978832e+01 4.876303998e+01 9.077435443e+00 2.490299855e+01 1.58 5.212131486e+01 1.443230373e+01 3.923478607e+01 5.210264810e+01 5.208975315e+01 8.263828603e+00 1.979421948e+01 4.283084714e+01 7.310991339e+00 2.132959970e+01 1.60 4.596358918e+01 1.208967449e+01 3.436267218e+01 4.594321568e+01 4.592623551e+01 6.733334567e+00 1.679870019e+01 3.748527772e+01 5.759481701e+00 1.811448954e+01 1.62 4.039791522e+01 1.003749058e+01 2.999991883e+01 4.037774354e+01 4.035812994e+01 5.386469056e+00 1.411143399e+01 3.267844048e+01 4.399506280e+00 1.523263370e+01 1.64 3.537696039e+01 8.236564865e+00 2.609881566e+01 3.535868332e+01 3.533829709e+01 4.204919716e+00 1.170800310e+01 2.836631000e+01 3.209041360e+00 1.266012991e+01 1.66 3.085719166e+01 6.654137066e+00 2.261530043e+01 3.084222467e+01 3.082310387e+01 3.172015034e+00 9.566701303e+00 2.450813351e+01 2.170621651e+00 1.037381424e+01 1.68 2.679850994e+01 5.265662222e+00 1.950848076e+01 2.678785402e+01 2.677190150e+01 2.272439874e+00 7.666871360e+00 2.106609270e+01 1.269737913e+00 8.351344452e+00 1.70 2.316387070e+01 4.048256057e+00 1.674014129e+01 2.315799845e+01 2.314672505e+01 1.492038073e+00 5.988722478e+00 1.800493577e+01 4.927816975e-01 6.571305316e+00 1.72 1.991873417e+01 2.980324911e+00 1.427423161e+01 1.991770146e+01 1.991214808e+01 8.176674399e-01 4.513479680e+00 1.529161972e+01 -1.729836043e-01 5.013171062e+00 1.74 1.703050706e+01 2.041912544e+00 1.207645753e+01 1.703420047e+01 1.703495001e+01 2.370837989e-01 3.223510843e+00 1.289494440e+01 -7.394986506e-01 3.657310109e+00 1.76 1.446832856e+01 1.214993041e+00 1.011813763e+01 1.447665850e+01 1.448386824e+01 -2.609493646e-01 2.102435803e+00 1.078542957e+01 -1.218064194e+00 2.485315638e+00 1.78 1.220318096e+01 4.831888088e-01 8.377442101e+00 1.221605593e+01 1.222946161e+01 -6.863611020e-01 1.135118933e+00 8.935290517e+00 -1.619324843e+00 1.480068606e+00 1.80 1.020774609e+01 -1.686139683e-01 6.834096458e+00 1.022495312e+01 1.024389160e+01 -1.047721803e+00 3.070134746e-01 7.318272548e+00 -1.953257949e+00 6.252233809e-01 1.82 8.456218814e+00 -7.501071793e-01 5.468874397e+00 8.477281972e+00 8.500743737e+00 -1.352743602e+00 -3.960956320e-01 5.909478804e+00 -2.229124293e+00 -9.494109169e-02 1.84 6.924128980e+00 -1.266582063e+00 4.263474770e+00 6.948292836e+00 6.975005873e+00 -1.608723721e+00 -9.881159472e-01 4.685207635e+00 -2.455353500e+00 -6.956054790e-01 1.86 5.588205885e+00 -1.723055814e+00 3.200551409e+00 5.614480709e+00 5.643009543e+00 -1.822617509e+00 -1.482548198e+00 3.622822343e+00 -2.639474110e+00 -1.191410350e+00 1.88 4.426313893e+00 -2.124402122e+00 2.264011698e+00 4.453509817e+00 4.482338065e+00 -2.000832767e+00 -1.892434126e+00 2.700672592e+00 -2.788049661e+00 -1.596313664e+00 1.90 3.417364193e+00 -2.475435773e+00 1.439189739e+00 3.444130687e+00 3.471742338e+00 -2.149206699e+00 -2.230197648e+00 1.898017283e+00 -2.906779872e+00 -1.923525438e+00 1.92 2.541221140e+00 -2.781041926e+00 7.129260509e-01 2.566099578e+00 2.591064569e+00 -2.273048857e+00 -2.506279395e+00 1.195100844e+00 -3.000886301e+00 -2.185544379e+00 1.94 1.778616379e+00 -3.046203112e+00 7.320789002e-02 1.800132628e+00 1.821195233e+00 -2.377176460e+00 -2.729911756e+00 5.732242391e-01 -3.075288445e+00 -2.394227663e+00 1.96 1.111070150e+00 -3.275871754e+00 -4.913299383e-01 1.127924540e+00 1.144093302e+00 -2.465941537e+00 -2.910008257e+00 1.591989099e-02 -3.134641364e+00 -2.560802535e+00 1.98 5.208192618e-01 -3.474804876e+00 -9.916335067e-01 5.321083143e-01 5.427348727e-01 -2.543258637e+00 -3.055168723e+00 -4.864647084e-01 -3.183295508e+00 -2.695868616e+00 2.00 -9.249017717e-03 -3.647506115e+00 -1.438438863e+00 -3.963319067e-03 8.271967701e-04 -2.612756440e+00 -3.173670741e+00 -9.415661734e-01 -3.225274790e+00 -2.809398196e+00 2.02 -4.934676680e-01 -3.797899495e+00 -1.841016083e+00 -4.942115088e-01 -4.952442018e-01 -2.677281793e+00 -3.272726851e+00 -1.355974397e+00 -3.263770776e+00 -2.909639307e+00 2.04 -9.369771881e-01 -3.928463489e+00 -2.202898963e+00 -9.434359772e-01 -9.500182845e-01 -2.736850335e+00 -3.356295160e+00 -1.733107078e+00 -3.299518226e+00 -2.999876975e+00 2.06 -1.342509235e+00 -4.041011401e+00 -2.526313779e+00 -1.354091400e+00 -1.365708404e+00 -2.790966323e+00 -3.427251679e+00 -2.075482279e+00 -3.332467192e+00 -3.081791350e+00 2.08 -1.712617226e+00 -4.136919899e+00 -2.813678904e+00 -1.728533032e+00 -1.744453675e+00 -2.839391263e+00 -3.488012268e+00 -2.385472233e+00 -3.362347223e+00 -3.156557245e+00 2.10 -2.049688594e+00 -4.217257348e+00 -3.067512595e+00 -2.069001663e+00 -2.088314795e+00 -2.882061575e+00 -3.540474461e+00 -2.665312033e+00 -3.388695910e+00 -3.225026720e+00 2.12 -2.355956118e+00 -4.282945088e+00 -3.290352670e+00 -2.377617549e+00 -2.399278979e+00 -2.919023631e+00 -3.586183520e+00 -2.917111692e+00 -3.411005495e+00 -3.287963679e+00 2.14 -2.633508382e+00 -4.334799244e+00 -3.484731306e+00 -2.656398943e+00 -2.679289504e+00 -2.950408188e+00 -3.626402496e+00 -3.142871052e+00 -3.428858672e+00 -3.346090451e+00 2.16 -2.884299492e+00 -4.373563200e+00 -3.653146957e+00 -2.907294607e+00 -2.930289723e+00 -2.976403722e+00 -3.662129728e+00 -3.344490781e+00 -3.441952200e+00 -3.399960482e+00 2.18 -3.110158068e+00 -4.399941615e+00 -3.798031674e+00 -3.132208736e+00 -3.154259405e+00 -2.997230601e+00 -3.694119281e+00 -3.523782358e+00 -3.450101001e+00 -3.449924667e+00 2.20 -3.312795613e+00 -4.414635980e+00 -3.921714774e+00 -3.333007242e+00 -3.353218871e+00 -3.013119027e+00 -3.722904849e+00 -3.682477123e+00 -3.453226934e+00 -3.496156902e+00 2.22 -3.493814210e+00 -4.418380352e+00 -4.026383780e+00 -3.511484438e+00 -3.529154667e+00 -3.024292746e+00 -3.748826991e+00 -3.822218163e+00 -3.451370516e+00 -3.538682119e+00 2.24 -3.654713705e+00 -4.411952637e+00 -4.114043473e+00 -3.669344553e+00 -3.683975402e+00 -3.030959727e+00 -3.772063412e+00 -3.944501856e+00 -3.444692805e+00 -3.577405471e+00 2.26 -3.796898402e+00 -4.396164675e+00 -4.186471755e+00 -3.808195619e+00 -3.819492835e+00 -3.033305783e+00 -3.792661676e+00 -4.050639578e+00 -3.433435784e+00 -3.612142228e+00 2.28 -3.921683241e+00 -4.371866272e+00 -4.245216592e+00 -3.929542396e+00 -3.937401550e+00 -3.031461846e+00 -3.810554369e+00 -4.141738957e+00 -3.417895998e+00 -3.642647944e+00 2.30 -4.030299565e+00 -4.339887160e+00 -4.291691281e+00 -4.034778398e+00 -4.039257231e+00 -3.025509301e+00 -3.825534519e+00 -4.218757862e+00 -3.398408899e+00 -3.668648863e+00 2.32 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