# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au # implementation = 2004--Zhou-X-W--Cu-Ag-Au--LAMMPS--ipr1 # NOTE: These values only provide a look at the purely pair interaction # of the potential and therefore exclude multi-body interactions. # Calculations from the NIST Interatomic Potential Repository Project: # http://www.ctcms.nist.gov/potentials/ # Table generated 2022-05-24 r Ag Ag Ag Au Ag Cu Au Au Au Cu Cu Cu 0.02 1.265151388e+04 1.474578889e+04 9.084166215e+03 1.441663599e+04 9.995958093e+03 6.397361890e+03 0.04 6.326491757e+03 7.375721298e+03 4.541013596e+03 7.218637943e+03 4.996882012e+03 3.196591321e+03 0.06 4.218151048e+03 4.919032099e+03 3.026629390e+03 4.819305261e+03 3.330523319e+03 2.129667798e+03 0.08 3.163980694e+03 3.690687500e+03 2.269437287e+03 3.619638920e+03 2.497343972e+03 1.596206037e+03 0.10 2.531478482e+03 2.953680740e+03 1.815122025e+03 2.899839115e+03 1.997436364e+03 1.276128980e+03 0.12 2.109810340e+03 2.462342900e+03 1.512245184e+03 2.419972578e+03 1.664164625e+03 1.062744275e+03 0.14 1.808618810e+03 2.111387300e+03 1.295904583e+03 2.077210767e+03 1.426113384e+03 9.103266293e+02 0.16 1.582725163e+03 1.848170600e+03 1.133649132e+03 1.820139408e+03 1.247574952e+03 7.960133947e+02 0.18 1.407030104e+03 1.643446501e+03 1.007450449e+03 1.620195018e+03 1.108711728e+03 7.071031011e+02 0.20 1.266474057e+03 1.479667221e+03 9.064915015e+02 1.460239506e+03 9.976211481e+02 6.359748662e+02 0.22 1.151473654e+03 1.345665992e+03 8.238887267e+02 1.329366814e+03 9.067288557e+02 5.777790377e+02 0.24 1.055639986e+03 1.233998301e+03 7.550530809e+02 1.220306237e+03 8.309852787e+02 5.292825139e+02 0.26 9.745499586e+02 1.139510255e+03 6.968075345e+02 1.128024211e+03 7.668945598e+02 4.882469938e+02 0.28 9.050442209e+02 1.058520501e+03 6.468827805e+02 1.048925331e+03 7.119596578e+02 4.530736909e+02 0.30 8.448059150e+02 9.883293808e+02 6.036146603e+02 9.803729691e+02 6.643494094e+02 4.225901616e+02 0.32 7.920973973e+02 9.269121509e+02 5.657550552e+02 9.203896520e+02 6.226904421e+02 3.959170736e+02 0.34 7.455898816e+02 8.727204774e+02 5.323495212e+02 8.674631958e+02 5.859325297e+02 3.723819958e+02 0.36 7.042498678e+02 8.245501009e+02 5.026557132e+02 8.204174569e+02 5.532588298e+02 3.514619268e+02 0.38 6.672614343e+02 7.814502904e+02 4.760875693e+02 7.783239011e+02 5.240244668e+02 3.327439702e+02 0.40 6.339718441e+02 7.426604610e+02 4.521762397e+02 7.404397009e+02 4.977135401e+02 3.158978093e+02 0.42 6.038526912e+02 7.075649010e+02 4.305421796e+02 7.061635197e+02 4.739084159e+02 3.006560447e+02 0.44 5.764716430e+02 6.756598465e+02 4.108748523e+02 6.750033550e+02 4.522673939e+02 2.867998951e+02 0.46 5.514715555e+02 6.465291445e+02 3.929177273e+02 6.465527698e+02 4.325081999e+02 2.741486280e+02 0.48 5.285548087e+02 6.198260010e+02 3.764570294e+02 6.204730667e+02 4.143956054e+02 2.625516332e+02 0.50 5.071163466e+02 5.948128993e+02 3.610557156e+02 5.959903436e+02 3.974279073e+02 2.516986731e+02 0.52 4.755219225e+02 5.569290423e+02 3.382852496e+02 5.572123099e+02 3.716946840e+02 2.355834784e+02 0.54 4.455459464e+02 5.210166608e+02 3.166896118e+02 5.204617567e+02 3.473155008e+02 2.203055294e+02 0.56 4.174222811e+02 4.873709018e+02 2.964376559e+02 4.860685336e+02 3.244897857e+02 2.059848694e+02 0.58 3.910370948e+02 4.558494286e+02 2.774465629e+02 4.538828368e+02 3.031196849e+02 1.925623151e+02 0.60 3.662837760e+02 4.263193833e+02 2.596383671e+02 4.237642778e+02 2.831132071e+02 1.799818663e+02 0.62 3.430621121e+02 3.986559932e+02 2.429400922e+02 3.955817627e+02 2.643843810e+02 1.681912527e+02 0.64 3.212778834e+02 3.727420312e+02 2.272829340e+02 3.692118299e+02 2.468522912e+02 1.571411861e+02 0.66 3.008430969e+02 3.484680614e+02 2.126029430e+02 3.445392947e+02 2.304416144e+02 1.467859419e+02 0.68 2.816746024e+02 3.257311452e+02 1.988393163e+02 3.214562812e+02 2.150812148e+02 1.370818934e+02 0.70 2.636945482e+02 3.044347660e+02 1.859355438e+02 2.998616101e+02 2.007048599e+02 1.279887591e+02 0.72 2.468298453e+02 2.844886136e+02 1.738383917e+02 2.796606907e+02 1.872502463e+02 1.194683996e+02 0.74 2.310121854e+02 2.658081571e+02 1.624979920e+02 2.607647777e+02 1.746590722e+02 1.114851172e+02 0.76 2.161768220e+02 2.483135940e+02 1.518674736e+02 2.430906287e+02 1.628766954e+02 1.040055334e+02 0.78 2.022638323e+02 2.319309442e+02 1.419029705e+02 2.265606137e+02 1.518518526e+02 9.699811219e+01 0.80 1.892160643e+02 2.165901097e+02 1.325631475e+02 2.111019379e+02 1.415367082e+02 9.043354899e+01 0.82 1.769803914e+02 2.022256414e+02 1.238093467e+02 1.966461001e+02 1.318861399e+02 8.428416348e+01 0.84 1.655069392e+02 1.887763334e+02 1.156052958e+02 1.831293352e+02 1.228580927e+02 7.852404703e+01 0.86 1.547486762e+02 1.761845750e+02 1.079168880e+02 1.704916921e+02 1.144130957e+02 7.312893430e+01 0.88 1.446615611e+02 1.643964935e+02 1.007121343e+02 1.586771398e+02 1.065140861e+02 6.807597352e+01 0.90 1.352043031e+02 1.533615549e+02 9.396105922e+01 1.476331951e+02 9.912649375e+01 6.334383841e+01 0.92 1.263381337e+02 1.430324193e+02 8.763555839e+01 1.373106116e+02 9.221782329e+01 5.891250636e+01 0.94 1.180265825e+02 1.333647094e+02 8.170917156e+01 1.276634592e+02 8.575763616e+01 5.476296843e+01 0.96 1.102355388e+02 1.243167662e+02 7.615718613e+01 1.186483739e+02 7.971742010e+01 5.087626696e+01 0.98 1.029327796e+02 1.158495166e+02 7.095626623e+01 1.102250434e+02 7.407035364e+01 4.723654329e+01 1.00 9.608838075e+01 1.079264687e+02 6.608467554e+01 1.023556353e+02 6.879123736e+01 4.382954733e+01 1.02 8.967381161e+01 1.005132021e+02 6.152187700e+01 9.500472865e+01 6.385685419e+01 4.064172858e+01 1.04 8.366274306e+01 9.357770460e+01 5.724868198e+01 8.813904666e+01 5.924535838e+01 3.766017502e+01 1.06 7.803018021e+01 8.708980612e+01 5.324707568e+01 8.172758461e+01 5.493640208e+01 3.487276910e+01 1.08 7.275277382e+01 8.102126359e+01 4.949947615e+01 7.574115269e+01 5.091077766e+01 3.226796328e+01 1.10 6.780854652e+01 7.534553911e+01 4.599021818e+01 7.015254822e+01 4.715051120e+01 2.983482800e+01 1.12 6.317695174e+01 7.003759437e+01 4.270506917e+01 6.493614852e+01 4.363869085e+01 2.756302652e+01 1.14 5.883861446e+01 6.507435735e+01 3.963056149e+01 6.006807405e+01 4.035954582e+01 2.544273606e+01 1.16 5.477537745e+01 6.043420120e+01 3.675393155e+01 5.552593765e+01 3.729820532e+01 2.346453455e+01 1.18 5.097024339e+01 5.609686951e+01 3.406293220e+01 5.128876076e+01 3.444078965e+01 2.161958418e+01 1.20 4.740722216e+01 5.204333188e+01 3.154644220e+01 4.733689541e+01 3.177427003e+01 1.989953838e+01 1.22 4.407133068e+01 4.825572564e+01 2.919411626e+01 4.365197279e+01 2.928643808e+01 1.829655263e+01 1.24 4.094846374e+01 4.471726092e+01 2.699614033e+01 4.021671155e+01 2.696581781e+01 1.680324008e+01 1.26 3.802538498e+01 4.141217979e+01 2.494321259e+01 3.701500135e+01 2.480168346e+01 1.541267402e+01 1.28 3.528972482e+01 3.832575243e+01 2.302650002e+01 3.403173514e+01 2.278396622e+01 1.411831877e+01 1.30 3.272919545e+01 3.544411710e+01 2.123763171e+01 3.125278253e+01 2.090322123e+01 1.291403696e+01 1.32 3.033304843e+01 3.275428109e+01 1.956874291e+01 2.866485526e+01 1.915048091e+01 1.179407582e+01 1.34 2.809161467e+01 3.024409602e+01 1.801240669e+01 2.625557938e+01 1.751674364e+01 1.075301757e+01 1.36 2.599574673e+01 2.790213387e+01 1.656161269e+01 2.401306439e+01 1.599475982e+01 9.785763218e+00 1.38 2.403675594e+01 2.571768715e+01 1.520974751e+01 2.192617412e+01 1.457791869e+01 8.887545025e+00 1.40 2.220643403e+01 2.368068705e+01 1.395057780e+01 1.998522320e+01 1.325992190e+01 8.053878873e+00 1.42 2.049704328e+01 2.178170985e+01 1.277825001e+01 1.818109707e+01 1.203478586e+01 7.280543853e+00 1.44 1.890128267e+01 2.001192576e+01 1.168726816e+01 1.650519171e+01 1.089686243e+01 6.563604798e+00 1.46 1.741218503e+01 1.836301899e+01 1.067243328e+01 1.494937500e+01 9.840764930e+00 5.899344614e+00 1.48 1.602325404e+01 1.682724143e+01 9.728890297e+00 1.350599753e+01 8.861412364e+00 5.284286828e+00 1.50 1.472827000e+01 1.539730060e+01 8.852063872e+00 1.216782742e+01 7.953983095e+00 4.715172410e+00 1.52 1.352135650e+01 1.406634299e+01 8.037653003e+00 1.092805054e+01 7.113845769e+00 4.188945780e+00 1.54 1.239703114e+01 1.282777529e+01 7.281620320e+00 9.780291389e+00 6.336608502e+00 3.702734291e+00 1.56 1.135008657e+01 1.167545658e+01 6.580181868e+00 8.718577834e+00 5.618151767e+00 3.253861508e+00 1.58 1.037563716e+01 1.060409391e+01 5.929769902e+00 7.737290271e+00 4.954591154e+00 2.839806623e+00 1.60 9.469100079e+00 9.608702548e+00 5.327050876e+00 6.831141909e+00 4.342279814e+00 2.458208522e+00 1.62 8.626144204e+00 8.684534557e+00 4.768884170e+00 5.995138754e+00 3.777785800e+00 2.106862185e+00 1.64 7.842723643e+00 7.827139728e+00 4.252334828e+00 5.224613503e+00 3.257900078e+00 1.783698536e+00 1.66 7.115014420e+00 7.032293543e+00 3.774641930e+00 4.515165295e+00 2.779596201e+00 1.486777796e+00 1.68 6.439417613e+00 6.296005593e+00 3.333215632e+00 3.862664165e+00 2.340051644e+00 1.214294139e+00 1.70 5.812575481e+00 5.614531640e+00 2.925635155e+00 3.263225056e+00 1.936600916e+00 9.645460134e-01 1.72 5.231319879e+00 4.984313214e+00 2.549624955e+00 2.713208951e+00 1.566759731e+00 7.359507752e-01 1.74 4.692679718e+00 4.401990287e+00 2.203056872e+00 2.209198261e+00 1.228190093e+00 5.270204884e-01 1.76 4.193856561e+00 3.864395488e+00 1.883930051e+00 1.747995925e+00 9.187098987e-01 3.363679340e-01 1.78 3.732241171e+00 3.368553056e+00 1.590378529e+00 1.326592360e+00 6.362674069e-01 1.626946675e-01 1.80 3.305366898e+00 2.911665556e+00 1.320648579e+00 9.421815174e-01 3.789491399e-01 4.789034523e-03 1.82 2.910934725e+00 2.491114604e+00 1.073103816e+00 5.921256306e-01 1.449599094e-01 -1.384842066e-01 1.84 2.546774379e+00 2.104433342e+00 8.462057732e-01 2.739680743e-01 -6.737440496e-02 -2.681828152e-01 1.86 2.210867052e+00 1.749317701e+00 6.385201614e-01 -1.460326034e-02 -2.596267957e-01 -3.852992283e-01 1.88 1.901306043e+00 1.423595116e+00 4.487013782e-01 -2.757402857e-01 -4.332609511e-01 -4.907552537e-01 1.90 1.616309677e+00 1.125236997e+00 2.754912768e-01 -5.114564851e-01 -5.896483631e-01 -5.854163649e-01 1.92 1.354208498e+00 8.523394361e-01 1.177150004e-01 -7.236407182e-01 -7.300688315e-01 -6.700853598e-01 1.94 1.113439349e+00 6.031195571e-01 -2.572780704e-02 -9.140454466e-01 -8.557167998e-01 -7.455142088e-01 1.96 8.925356929e-01 3.759073922e-01 -1.558653114e-01 -1.084317100e+00 -9.677094745e-01 -8.124065582e-01 1.98 6.901278826e-01 1.691409607e-01 -2.736578846e-01 -1.235986357e+00 -1.067087052e+00 -8.714132673e-01 2.00 5.049307683e-01 -1.864203269e-02 -3.800027228e-01 -1.370482482e+00 -1.154820578e+00 -9.231451333e-01 2.02 3.357387395e-01 -1.888129545e-01 -4.757406143e-01 -1.489139614e+00 -1.231815217e+00 -9.681707537e-01 2.04 1.814296406e-01 -3.426494201e-01 -5.616536142e-01 -1.593198452e+00 -1.298916218e+00 -1.007018989e+00 2.06 4.095325748e-02 -4.813458994e-01 -6.384726717e-01 -1.683818082e+00 -1.356909186e+00 -1.040183654e+00 2.08 -8.668030877e-02 -6.060218662e-01 -7.068810788e-01 -1.762074883e+00 -1.406525596e+00 -1.068123440e+00 2.10 -2.023875906e-01 -7.177211314e-01 -7.675151756e-01 -1.828975459e+00 -1.448448098e+00 -1.091265888e+00 2.12 -3.070303807e-01 -8.174177201e-01 -8.209697726e-01 -1.885450708e+00 -1.483312190e+00 -1.110009138e+00 2.14 -4.014130726e-01 -9.060225041e-01 -8.677984737e-01 -1.932369225e+00 -1.511705756e+00 -1.124722863e+00 2.16 -4.862853739e-01 -9.843830050e-01 -9.085178661e-01 -1.970539857e+00 -1.534178832e+00 -1.135750455e+00 2.18 -5.623522818e-01 -1.053293185e+00 -9.436094818e-01 -2.000712404e+00 -1.551240662e+00 -1.143411872e+00 2.20 -6.302651472e-01 -1.113488650e+00 -9.735220357e-01 -2.023581470e+00 -1.563366081e+00 -1.148005174e+00 2.22 -6.906405021e-01 -1.165660415e+00 -9.986735896e-01 -2.039796064e+00 -1.570993543e+00 -1.149804709e+00 2.24 -7.440457680e-01 -1.210447454e+00 -1.019452325e+00 -2.049954089e+00 -1.574532177e+00 -1.149067555e+00 2.26 -7.910163000e-01 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