# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 1989--Adams-J-B-Foiles-S-M-Wolfer-W-G--Ni # implementation = 1989--Adams-J-B--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 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 7.497682240e+02 nan 0.66 nan nan nan nan nan nan nan nan 6.765499176e+02 nan 0.68 nan nan nan nan nan nan nan nan 6.127717990e+02 nan 0.70 nan nan nan nan nan 4.620478474e+02 nan nan 5.567589508e+02 nan 0.72 nan nan nan nan nan 4.158677181e+02 nan nan 5.071745001e+02 nan 0.74 nan nan nan nan nan 3.756851074e+02 nan nan 4.629803377e+02 nan 0.76 nan nan nan nan nan 3.405906902e+02 nan nan 4.233537363e+02 nan 0.78 nan nan nan 7.556671252e+02 7.556362204e+02 3.097929332e+02 nan nan 3.876150770e+02 5.350857043e+02 0.80 nan 5.045039236e+02 nan 7.021109330e+02 7.020843165e+02 2.826523702e+02 5.062845522e+02 nan 3.552302695e+02 4.939399787e+02 0.82 nan 4.688165599e+02 nan 6.542581221e+02 6.542371521e+02 2.586010039e+02 4.690223757e+02 nan 3.257628355e+02 4.565726982e+02 0.84 nan 4.356505933e+02 nan 6.110587465e+02 6.110451589e+02 2.371696420e+02 4.347544077e+02 nan 2.988550420e+02 4.224279467e+02 0.86 nan 4.046643126e+02 nan 5.716691787e+02 5.716643128e+02 2.179820811e+02 4.030740018e+02 nan 2.742107120e+02 3.910778618e+02 0.88 nan 3.756009802e+02 nan 5.354194230e+02 5.354164237e+02 2.007205994e+02 3.736620788e+02 5.059808402e+02 2.515958511e+02 3.621805627e+02 0.90 5.018091241e+02 3.482807712e+02 4.621915869e+02 5.018083376e+02 5.018066773e+02 1.851088535e+02 3.462808394e+02 4.737092455e+02 2.308075028e+02 3.354279542e+02 0.92 4.704418698e+02 3.225651896e+02 4.322413661e+02 4.704358446e+02 4.704380180e+02 1.709238548e+02 3.207260139e+02 4.434718202e+02 2.116686526e+02 3.106029324e+02 0.94 4.409843594e+02 2.983400783e+02 4.040220212e+02 4.409849928e+02 4.409898910e+02 1.579728189e+02 2.968389753e+02 4.150076964e+02 1.940349033e+02 2.875196740e+02 0.96 4.132210894e+02 2.755335115e+02 3.773751237e+02 4.132235817e+02 4.132325146e+02 1.461084483e+02 2.744954941e+02 3.881282459e+02 1.777745171e+02 2.660054881e+02 0.98 3.869550174e+02 2.540682811e+02 3.521472781e+02 3.869730843e+02 3.869861351e+02 1.351944578e+02 2.535770464e+02 3.626857585e+02 1.627737476e+02 2.459453024e+02 1.00 3.620756585e+02 2.338905194e+02 3.282507791e+02 3.620971372e+02 3.621119209e+02 1.251217036e+02 2.339938958e+02 3.385785607e+02 1.489336061e+02 2.272309976e+02 1.02 3.384629647e+02 2.149561188e+02 3.056070339e+02 3.384829937e+02 3.384996808e+02 1.158115837e+02 2.156707600e+02 3.157133784e+02 1.361650741e+02 2.097733117e+02 1.04 3.160451399e+02 1.972212128e+02 2.841541103e+02 3.160600020e+02 3.160764132e+02 1.071855711e+02 1.985483484e+02 2.940215146e+02 1.243901219e+02 1.934805075e+02 1.06 2.947553121e+02 1.806293435e+02 2.638517138e+02 2.947670349e+02 2.947812217e+02 9.918108016e+01 1.825584054e+02 2.734572068e+02 1.135356836e+02 1.782742902e+02 1.08 2.745475466e+02 1.651452458e+02 2.446576482e+02 2.745570145e+02 2.745699400e+02 9.174568997e+01 1.676401235e+02 2.539753301e+02 1.035330172e+02 1.640921118e+02 1.10 2.553842655e+02 1.507180665e+02 2.265150456e+02 2.553912850e+02 2.554041230e+02 8.482390132e+01 1.537351848e+02 2.355403035e+02 9.432230350e+01 1.508764377e+02 1.12 2.372151052e+02 1.373042742e+02 2.094019966e+02 2.372293315e+02 2.372435222e+02 7.837938841e+01 1.407935455e+02 2.181129750e+02 8.584701850e+01 1.385687016e+02 1.14 2.200263850e+02 1.248647749e+02 1.932871956e+02 2.200440297e+02 2.200583438e+02 7.237913091e+01 1.287675043e+02 2.016719214e+02 7.805888812e+01 1.271184685e+02 1.16 2.037883205e+02 1.133477425e+02 1.781420073e+02 2.038041766e+02 2.038183947e+02 6.680008783e+01 1.176036940e+02 1.861840818e+02 7.090859124e+01 1.164760342e+02 1.18 1.884658953e+02 1.027007444e+02 1.639204058e+02 1.884834190e+02 1.884986540e+02 6.160886508e+01 1.072565857e+02 1.716206858e+02 6.434872948e+01 1.065899723e+02 1.20 1.740391992e+02 9.288533966e+01 1.506020102e+02 1.740567556e+02 1.740729124e+02 5.678501273e+01 9.767612418e+01 1.579505125e+02 5.833834579e+01 9.742505324e+01 1.22 1.604775390e+02 8.385239428e+01 1.381514038e+02 1.604941691e+02 1.605096847e+02 5.230452158e+01 8.881981231e+01 1.451451272e+02 5.283243364e+01 8.893925812e+01 1.24 1.477531718e+02 7.554847523e+01 1.265342853e+02 1.477650917e+02 1.477781246e+02 4.814829006e+01 8.064777243e+01 1.331687468e+02 4.779741379e+01 8.109309769e+01 1.26 1.358233782e+02 6.793548371e+01 1.157113491e+02 1.358362061e+02 1.358480205e+02 4.429621934e+01 7.312080453e+01 1.219851225e+02 4.319937297e+01 7.384714688e+01 1.28 1.246697547e+02 6.097049149e+01 1.056402153e+02 1.246793908e+02 1.246891416e+02 4.072767865e+01 6.619847988e+01 1.115636798e+02 3.900530822e+01 6.716382916e+01 1.30 1.142591214e+02 5.460970567e+01 9.629024245e+01 1.142652810e+02 1.142732535e+02 3.742616884e+01 5.983861161e+01 1.018675066e+02 3.518260394e+01 6.099727245e+01 1.32 1.045580304e+02 4.880671520e+01 8.762472555e+01 1.045586658e+02 1.045650988e+02 3.437457722e+01 5.400519056e+01 9.286115293e+01 3.170450204e+01 5.532386842e+01 1.34 9.552514290e+01 4.352012108e+01 7.960438094e+01 9.552575836e+01 9.553150010e+01 3.155500884e+01 4.866275737e+01 8.450750752e+01 2.854547482e+01 5.010997499e+01 1.36 8.712709890e+01 3.871810608e+01 7.219726954e+01 8.713293004e+01 8.713878410e+01 2.895711392e+01 4.377624692e+01 7.677381385e+01 2.567727077e+01 4.532437821e+01 1.38 7.934111300e+01 3.436479584e+01 6.536734201e+01 7.934925101e+01 7.935511951e+01 2.656640501e+01 3.931512239e+01 6.962820558e+01 2.307842186e+01 4.094092618e+01 1.40 7.212977183e+01 3.042409702e+01 5.907452322e+01 7.214084069e+01 7.214764683e+01 2.436914227e+01 3.524588901e+01 6.303611274e+01 2.072802818e+01 3.693002363e+01 1.42 6.546361286e+01 2.686372773e+01 5.328089400e+01 6.547469272e+01 6.548154720e+01 2.234826881e+01 3.153909069e+01 5.696466051e+01 1.860390229e+01 3.326605956e+01 1.44 5.931221893e+01 2.365039083e+01 4.796246698e+01 5.932127738e+01 5.932777613e+01 2.049486467e+01 2.817204130e+01 5.138023286e+01 1.668805619e+01 2.992434581e+01 1.46 5.364095051e+01 2.075684237e+01 4.309040209e+01 5.364920143e+01 5.365577549e+01 1.879865903e+01 2.511855378e+01 4.625249570e+01 1.496497851e+01 2.687765344e+01 1.48 4.842188389e+01 1.815907446e+01 3.863271108e+01 4.842984509e+01 4.843664865e+01 1.716611718e+01 2.235408474e+01 4.155289538e+01 1.341765863e+01 2.410585146e+01 1.50 4.362793777e+01 1.583236015e+01 3.456068719e+01 4.363449785e+01 4.364144052e+01 1.569720187e+01 1.985500175e+01 3.725291546e+01 1.202960321e+01 2.158990499e+01 1.52 3.923051398e+01 1.375324480e+01 3.084801328e+01 3.923452894e+01 3.924153973e+01 1.429988306e+01 1.759888063e+01 3.332284121e+01 1.070561397e+01 1.930940368e+01 1.54 3.519906725e+01 1.189999576e+01 2.746843342e+01 3.520312902e+01 3.521014796e+01 1.297528055e+01 1.556726364e+01 2.973563407e+01 9.544135608e+00 1.724203466e+01 1.56 3.151320173e+01 1.025198683e+01 2.439716504e+01 3.151526452e+01 3.152024268e+01 1.172349913e+01 1.374052443e+01 2.646896987e+01 8.452249547e+00 1.537559684e+01 1.58 2.814852763e+01 8.788031788e+00 2.161087307e+01 2.814844725e+01 2.815123952e+01 1.054382884e+01 1.210065355e+01 2.349887879e+01 7.428556081e+00 1.369378872e+01 1.60 2.508194817e+01 7.493689921e+00 1.908763545e+01 2.508004911e+01 2.508098060e+01 9.434917904e+00 1.063424120e+01 2.080312022e+01 6.471052883e+00 1.218143874e+01 1.62 2.228452025e+01 6.352899242e+00 1.680056812e+01 2.228463900e+01 2.228517291e+01 8.392308699e+00 9.324747171e+00 1.835824355e+01 5.576740121e+00 1.081850780e+01 1.64 1.974393506e+01 5.347533468e+00 1.473778078e+01 1.974573860e+01 1.974592050e+01 7.416914055e+00 8.159429417e+00 1.614841394e+01 4.743683200e+00 9.598783422e+00 1.66 1.744068126e+01 4.378003226e+00 1.288116374e+01 1.744389711e+01 1.744376598e+01 6.506151639e+00 7.045486960e+00 1.415500852e+01 3.969419058e+00 8.429958579e+00 1.68 1.535646315e+01 3.546265292e+00 1.121384778e+01 1.535883714e+01 1.535842641e+01 5.657275157e+00 6.093006630e+00 1.236063968e+01 3.250631322e+00 7.419718120e+00 1.70 1.347397905e+01 2.775781962e+00 9.719434876e+00 1.347541849e+01 1.347484563e+01 4.866903394e+00 5.201830641e+00 1.074898247e+01 2.585439943e+00 6.472695021e+00 1.72 1.177648422e+01 2.061794315e+00 8.380379274e+00 1.177758578e+01 1.177733636e+01 4.129959151e+00 4.370956118e+00 9.304458823e+00 1.971030321e+00 5.585095120e+00 1.74 1.025013791e+01 1.403035099e+00 7.187513128e+00 1.025093656e+01 1.025094991e+01 3.447678273e+00 3.598033619e+00 8.013773133e+00 1.404624621e+00 4.756453519e+00 1.76 8.881012014e+00 7.955487983e-01 6.128225062e+00 8.881538753e+00 8.881763600e+00 2.818230993e+00 2.880164891e+00 6.861749407e+00 8.835034061e-01 3.984113845e+00 1.78 7.656152996e+00 2.359856963e-01 5.190855308e+00 7.656011275e+00 7.656404479e+00 2.236312461e+00 2.213882800e+00 5.838063657e+00 4.059601804e-01 3.265413404e+00 1.80 6.563529596e+00 -2.796538488e-01 4.279087832e+00 6.562148328e+00 6.562673769e+00 1.699196781e+00 1.597149590e+00 4.929801004e+00 -3.047341382e-02 2.597707685e+00 1.82 5.589406692e+00 -7.517525307e-01 3.505952464e+00 5.587920304e+00 5.588869706e+00 1.204245535e+00 1.027250585e+00 4.034842948e+00 -4.310254954e-01 1.978390418e+00 1.84 4.642699940e+00 -1.182730867e+00 2.786175458e+00 4.643326353e+00 4.645365383e+00 7.489178546e-01 5.015610292e-01 3.274010346e+00 -7.963503539e-01 1.404909670e+00 1.86 3.853742184e+00 -1.575229832e+00 2.116741819e+00 3.856109309e+00 3.858993708e+00 3.307770976e-01 1.755116332e-02 2.566398684e+00 -1.128887854e+00 8.747804551e-01 1.88 3.118376016e+00 -1.931742170e+00 1.491657093e+00 3.121221910e+00 3.123845604e+00 -5.250516749e-02 -4.276105269e-01 1.909063055e+00 -1.431078093e+00 3.855943373e-01 1.90 2.433701817e+00 -2.254619850e+00 9.124741349e-01 2.436922795e+00 2.439312943e+00 -4.031475176e-01 -8.360919221e-01 1.299200742e+00 -1.704364361e+00 -6.497355270e-02 1.92 1.796956554e+00 -2.545399267e+00 3.743472180e-01 1.799868924e+00 1.802050073e+00 -7.241313917e-01 -1.210578844e+00 7.341454177e-01 -1.950696190e+00 -4.791596609e-01 1.94 1.205509262e+00 -2.804739859e+00 -1.237322495e-01 1.207832908e+00 1.209827192e+00 -1.016929131e+00 -1.551570211e+00 2.102154826e-01 -2.171917284e+00 -8.584521191e-01 1.96 6.568305909e-01 -3.037172916e+00 -5.827795267e-01 6.586579372e-01 6.604852836e-01 -1.282918587e+00 -1.859766965e+00 -2.736565851e-01 -2.369765681e+00 -1.203565914e+00 1.98 1.474688670e-01 -3.244481924e+00 -1.005111161e+00 1.491472101e-01 1.508255531e-01 -1.523154004e+00 -2.139592016e+00 -7.197929872e-01 -2.546440663e+00 -1.521614118e+00 2.00 -3.235602898e-01 -3.428353932e+00 -1.392919419e+00 -3.220148405e-01 -3.204693911e-01 -1.739815612e+00 -2.392824885e+00 -1.130396297e+00 -2.702810048e+00 -1.811224463e+00 2.02 -7.584421376e-01 -3.590383415e+00 -1.748278849e+00 -7.571645931e-01 -7.558870486e-01 -1.934919142e+00 -2.621157180e+00 -1.507555187e+00 -2.839984472e+00 -2.074183035e+00 2.04 -1.159250920e+00 -3.732077224e+00 -2.073152453e+00 -1.158829259e+00 -1.158407599e+00 -2.109959719e+00 -2.826194674e+00 -1.853498134e+00 -2.959796544e+00 -2.312184838e+00 2.06 -1.527955160e+00 -3.855285450e+00 -2.369397562e+00 -1.528256368e+00 -1.528557576e+00 -2.266343340e+00 -3.009459760e+00 -2.170536772e+00 -3.063745422e+00 -2.526836447e+00 2.08 -1.866422706e+00 -3.961063579e+00 -2.638827509e+00 -1.867333866e+00 -1.868245027e+00 -2.405441863e+00 -3.172394151e+00 -2.459621243e+00 -3.153208951e+00 -2.719658958e+00 2.10 -2.176425557e+00 -4.050781277e+00 -2.881860877e+00 -2.177850929e+00 -2.179276301e+00 -2.529014095e+00 -3.316843639e+00 -2.722459572e+00 -3.228861461e+00 -2.892091142e+00 2.12 -2.459644453e+00 -4.126165487e+00 -3.100533550e+00 -2.461502965e+00 -2.463361477e+00 -2.637586153e+00 -3.443896996e+00 -2.958634609e+00 -3.291771266e+00 -3.045492725e+00 2.14 -2.717679231e+00 -4.187345382e+00 -3.297328465e+00 -2.719900838e+00 -2.722122446e+00 -2.732258106e+00 -3.554391680e+00 -3.171669886e+00 -3.343022422e+00 -3.181153081e+00 2.16 -2.952023185e+00 -4.234760667e+00 -3.473609400e+00 -2.954114531e+00 -2.956205876e+00 -2.814059956e+00 -3.649491536e+00 -3.364494204e+00 -3.383475540e+00 -3.301900567e+00 2.18 -3.164126699e+00 -4.270187331e+00 -3.630669333e+00 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