# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2009--Kang-K-H-Sa-I-Lee-J-C-et-al--Cu-Ag # implementation = 2009--Kang-K-H--Cu-Ag--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 Cu Cu Cu 0.02 2.972530260e+03 6.615799956e+03 1.066119302e+03 0.04 2.802593725e+03 6.184114973e+03 1.004671343e+03 0.06 2.642097360e+03 5.779919770e+03 9.466267788e+02 0.08 2.490528365e+03 5.401499572e+03 8.918022676e+02 0.10 2.347401266e+03 5.047244614e+03 8.400241260e+02 0.12 2.212256491e+03 4.715643811e+03 7.911278290e+02 0.14 2.084659003e+03 4.405278816e+03 7.449575364e+02 0.16 1.964197022e+03 4.114818422e+03 7.013656434e+02 0.18 1.850480794e+03 3.843013300e+03 6.602123541e+02 0.20 1.743141438e+03 3.588691050e+03 6.213652762e+02 0.22 1.641829847e+03 3.350751541e+03 5.846990374e+02 0.24 1.546215645e+03 3.128162540e+03 5.500949198e+02 0.26 1.455986201e+03 2.919955591e+03 5.174405148e+02 0.28 1.370845693e+03 2.725222142e+03 4.866293939e+02 0.30 1.290514219e+03 2.543109911e+03 4.575607973e+02 0.32 1.214726954e+03 2.372819457e+03 4.301393385e+02 0.34 1.143233357e+03 2.213600966e+03 4.042747234e+02 0.36 1.075796411e+03 2.064751225e+03 3.798814843e+02 0.38 1.012191908e+03 1.925610778e+03 3.568787272e+02 0.40 9.522077691e+02 1.795561255e+03 3.351898926e+02 0.42 8.956433984e+02 1.674022857e+03 3.147425279e+02 0.44 8.423090761e+02 1.560451997e+03 2.954680719e+02 0.46 7.920253780e+02 1.454339079e+03 2.773016507e+02 0.48 7.446226277e+02 1.355206413e+03 2.601818831e+02 0.50 6.999403770e+02 1.262606255e+03 2.440506976e+02 0.52 6.578269138e+02 1.176118968e+03 2.288531570e+02 0.54 6.181387954e+02 1.095351288e+03 2.145372936e+02 0.56 5.807404066e+02 1.019934700e+03 2.010539522e+02 0.58 5.455035408e+02 9.495239129e+02 1.883566414e+02 0.60 5.123070035e+02 8.837954211e+02 1.764013925e+02 0.62 4.810362362e+02 8.224461601e+02 1.651466258e+02 0.64 4.515829602e+02 7.651922396e+02 1.545530237e+02 0.66 4.238448394e+02 7.117677549e+02 1.445834110e+02 0.68 3.977251608e+02 6.619236703e+02 1.352026404e+02 0.70 3.731325320e+02 6.154267712e+02 1.263774848e+02 0.72 3.499805939e+02 5.720586793e+02 1.180765349e+02 0.74 3.281877501e+02 5.316149287e+02 1.102701022e+02 0.76 3.076769090e+02 4.939040976e+02 1.029301271e+02 0.78 2.883752407e+02 4.587469940e+02 9.603009145e+01 0.80 2.702139463e+02 4.259758909e+02 8.954493649e+01 0.82 2.531280397e+02 3.954338081e+02 8.345098413e+01 0.84 2.370561406e+02 3.669738388e+02 7.772586306e+01 0.86 2.219402790e+02 3.404585171e+02 7.234843838e+01 0.88 2.077257099e+02 3.157592244e+02 6.729874512e+01 0.90 1.943607376e+02 2.927556328e+02 6.255792515e+01 0.92 1.817965499e+02 2.713351825e+02 5.810816744e+01 0.94 1.699870608e+02 2.513925911e+02 5.393265149e+01 0.96 1.588887617e+02 2.328293946e+02 5.001549373e+01 0.98 1.484605804e+02 2.155535149e+02 4.634169677e+01 1.00 1.386637483e+02 1.994788560e+02 4.289710131e+01 1.02 1.294616736e+02 1.845249236e+02 3.966834062e+01 1.04 1.208198224e+02 1.706164698e+02 3.664279743e+01 1.06 1.127056056e+02 1.576831587e+02 3.380856312e+01 1.08 1.050882720e+02 1.456592539e+02 3.115439905e+01 1.10 9.793880715e+01 1.344833244e+02 2.866969995e+01 1.12 9.122983773e+01 1.240979696e+02 2.634445933e+01 1.14 8.493554106e+01 1.144495617e+02 2.416923663e+01 1.16 7.903155941e+01 1.054880034e+02 2.213512621e+01 1.18 7.349491906e+01 9.716650116e+01 2.023372794e+01 1.20 6.830395365e+01 8.944135341e+01 1.845711945e+01 1.22 6.343823175e+01 8.227175083e+01 1.679782971e+01 1.24 5.887848834e+01 7.561959009e+01 1.524881423e+01 1.26 5.460655998e+01 6.944929902e+01 1.380343142e+01 1.28 5.060532353e+01 6.372767287e+01 1.245542034e+01 1.30 4.685863823e+01 5.842372088e+01 1.119887958e+01 1.32 4.335129085e+01 5.350852262e+01 1.002824727e+01 1.34 4.006894395e+01 4.895509338e+01 8.938282279e+00 1.36 3.699808683e+01 4.473825818e+01 7.924046278e+00 1.38 3.412598930e+01 4.083453365e+01 6.980886889e+00 1.40 3.144065783e+01 3.722201761e+01 6.104421697e+00 1.42 2.893079422e+01 3.388028553e+01 5.290523138e+00 1.44 2.658575648e+01 3.079029371e+01 4.535304218e+00 1.46 2.439552183e+01 2.793428858e+01 3.835105002e+00 1.48 2.235065182e+01 2.529572181e+01 3.186479839e+00 1.50 2.044225924e+01 2.285917093e+01 2.586185294e+00 1.52 1.866197698e+01 2.061026498e+01 2.031168733e+00 1.54 1.700192850e+01 1.853561494e+01 1.518557539e+00 1.56 1.545469996e+01 1.662274869e+01 1.045648924e+00 1.58 1.401331393e+01 1.486005014e+01 6.099002956e-01 1.60 1.267120451e+01 1.323670227e+01 2.089201673e-01 1.62 1.142219379e+01 1.174263390e+01 -1.595404352e-01 1.64 1.026046971e+01 1.036846986e+01 -4.975960866e-01 1.66 9.180565066e+00 9.105484479e+00 -8.072346231e-01 1.68 8.177337691e+00 7.945557967e+00 -1.090324378e+00 1.70 7.245951786e+00 6.881135777e+00 -1.348621012e+00 1.72 6.381860240e+00 5.905190525e+00 -1.583773966e+00 1.74 5.580787958e+00 5.011186437e+00 -1.797332553e+00 1.76 4.838716121e+00 4.193046112e+00 -1.990751716e+00 1.78 4.151867320e+00 3.445119463e+00 -2.165397461e+00 1.80 3.516691533e+00 2.762154704e+00 -2.322551998e+00 1.82 2.929852884e+00 2.139271235e+00 -2.463418602e+00 1.84 2.388217153e+00 1.571934322e+00 -2.589126199e+00 1.86 1.888839991e+00 1.055931441e+00 -2.700733716e+00 1.88 1.428955804e+00 5.873501926e-01 -2.799234188e+00 1.90 1.005967265e+00 1.625576734e-01 -2.885558643e+00 1.92 6.174354338e-01 -2.218187771e-01 -2.960579784e+00 1.94 2.610704316e-01 -5.689095508e-01 -3.025115463e+00 1.96 -6.527734248e-02 -8.816195435e-01 -3.079931974e+00 1.98 -3.636254908e-01 -1.162643805e+00 -3.125747156e+00 2.00 -6.358674183e-01 -1.414482138e+00 -3.163233334e+00 2.02 -8.837796811e-01 -1.639452713e+00 -3.193020083e+00 2.04 -1.109028908e+00 -1.839704758e+00 -3.215696845e+00 2.06 -1.313178316e+00 -2.017230395e+00 -3.231815382e+00 2.08 -1.497693850e+00 -2.173875661e+00 -3.241892089e+00 2.10 -1.663949954e+00 -2.311350782e+00 -3.246410168e+00 2.12 -1.813235010e+00 -2.431239733e+00 -3.245821659e+00 2.14 -1.946756452e+00 -2.535009148e+00 -3.240549352e+00 2.16 -2.065645582e+00 -2.624016610e+00 -3.230988569e+00 2.18 -2.170962093e+00 -2.699518363e+00 -3.217508833e+00 2.20 -2.263698332e+00 -2.762676494e+00 -3.200455428e+00 2.22 -2.344783310e+00 -2.814565606e+00 -3.180150852e+00 2.24 -2.415086468e+00 -2.856179038e+00 -3.156896181e+00 2.26 -2.475421227e+00 -2.888434635e+00 -3.130972333e+00 2.28 -2.526548325e+00 -2.912180127e+00 -3.102641258e+00 2.30 -2.569178957e+00 -2.928198122e+00 -3.072147051e+00 2.32 -2.603977730e+00 -2.937210761e+00 -3.039716986e+00 2.34 -2.631565450e+00 -2.939884038e+00 -3.005562503e+00 2.36 -2.652521740e+00 -2.936831824e+00 -2.969880120e+00 2.38 -2.667387509e+00 -2.928619613e+00 -2.932852305e+00 2.40 -2.676667279e+00 -2.915768000e+00 -2.894648295e+00 2.42 -2.680831381e+00 -2.898755928e+00 -2.855424874e+00 2.44 -2.680318021e+00 -2.878023708e+00 -2.815327112e+00 2.46 -2.675535236e+00 -2.853975825e+00 -2.774489064e+00 2.48 -2.666862732e+00 -2.826983564e+00 -2.733034443e+00 2.50 -2.654653631e+00 -2.797387441e+00 -2.691077258e+00 2.52 -2.639236115e+00 -2.765499484e+00 -2.648722425e+00 2.54 -2.620914976e+00 -2.731605344e+00 -2.606066348e+00 2.56 -2.599973095e+00 -2.695966273e+00 -2.563197478e+00 2.58 -2.576672825e+00 -2.658820965e+00 -2.520196842e+00 2.60 -2.551257313e+00 -2.620387265e+00 -2.477138553e+00 2.62 -2.523951741e+00 -2.580863771e+00 -2.434090290e+00 2.64 -2.494964505e+00 -2.540431323e+00 -2.391113758e+00 2.66 -2.464488326e+00 -2.499254385e+00 -2.348265121e+00 2.68 -2.432701305e+00 -2.457482341e+00 -2.305595413e+00 2.70 -2.399767916e+00 -2.415250694e+00 -2.263150925e+00 2.72 -2.365839940e+00 -2.372682184e+00 -2.220973570e+00 2.74 -2.331057355e+00 -2.329887828e+00 -2.179101221e+00 2.76 -2.295549158e+00 -2.286967884e+00 -2.137568031e+00 2.78 -2.259434159e+00 -2.244012746e+00 -2.096404727e+00 2.80 -2.222821701e+00 -2.201103776e+00 -2.055638885e+00 2.82 -2.185812355e+00 -2.158314071e+00 -2.015295184e+00 2.84 -2.148498558e+00 -2.115709173e+00 -1.975395634e+00 2.86 -2.110965210e+00 -2.073347727e+00 -1.935959798e+00 2.88 -2.073290227e+00 -2.031282081e+00 -1.897004982e+00 2.90 -2.035545063e+00 -1.989558848e+00 -1.858546414e+00 2.92 -1.997795177e+00 -1.948219412e+00 -1.820597413e+00 2.94 -1.960100481e+00 -1.907300395e+00 -1.783169529e+00 2.96 -1.922515740e+00 -1.866834090e+00 -1.746272688e+00 2.98 -1.885090947e+00 -1.826848847e+00 -1.709915307e+00 3.00 -1.847871664e+00 -1.787369431e+00 -1.674104413e+00 3.02 -1.810899337e+00 -1.748417343e+00 -1.638845741e+00 3.04 -1.774211585e+00 -1.710011118e+00 -1.604143831e+00 3.06 -1.737842462e+00 -1.672166587e+00 -1.570002114e+00 3.08 -1.701822701e+00 -1.634897119e+00 -1.536422990e+00 3.10 -1.666179941e+00 -1.598213844e+00 -1.503407905e+00 3.12 -1.630938931e+00 -1.562125842e+00 -1.470957416e+00 3.14 -1.596121721e+00 -1.526640332e+00 -1.439071257e+00 3.16 -1.561747845e+00 -1.491762827e+00 -1.407748400e+00 3.18 -1.527834486e+00 -1.457497286e+00 -1.376987113e+00 3.20 -1.494396632e+00 -1.423846247e+00 -1.346785008e+00 3.22 -1.461447225e+00 -1.390810951e+00 -1.317139101e+00 3.24 -1.428997304e+00 -1.358391456e+00 -1.288045852e+00 3.26 -1.397056135e+00 -1.326586743e+00 -1.259501216e+00 3.28 -1.365631339e+00 -1.295394808e+00 -1.231500687e+00 3.30 -1.334729014e+00 -1.264812758e+00 -1.204039338e+00 3.32 -1.304353849e+00 -1.234836891e+00 -1.177111863e+00 3.34 -1.274509234e+00 -1.205462778e+00 -1.150712612e+00 3.36 -1.245197367e+00 -1.176685334e+00 -1.124835632e+00 3.38 -1.216419348e+00 -1.148498887e+00 -1.099474695e+00 3.40 -1.188175278e+00 -1.120897246e+00 -1.074623335e+00 3.42 -1.160464347e+00 -1.093873759e+00 -1.050274876e+00 3.44 -1.133284914e+00 -1.067421369e+00 -1.026422459e+00 3.46 -1.106634588e+00 -1.041532671e+00 -1.003059072e+00 3.48 -1.080510299e+00 -1.016199956e+00 -9.801775716e-01 3.50 -1.054908368e+00 -9.914152590e-01 -9.577707074e-01 3.52 -1.029824567e+00 -9.671704017e-01 -9.358311423e-01 3.54 -1.005254181e+00 -9.434570286e-01 -9.143514721e-01 3.56 -9.811920580e-01 -9.202666428e-01 -8.933242436e-01 3.58 -9.576326585e-01 -8.975906381e-01 -8.727419707e-01 3.60 -9.345701036e-01 -8.754203268e-01 -8.525971495e-01 3.62 -9.119982141e-01 -8.537469659e-01 -8.328822717e-01 3.64 -8.899105499e-01 -8.325617799e-01 -8.135898370e-01 3.66 -8.683004444e-01 -8.118559814e-01 -7.947123644e-01 3.68 -8.471610365e-01 -7.916207893e-01 -7.762424018e-01 3.70 -8.264853003e-01 -7.718474449e-01 -7.581725358e-01 3.72 -8.062660718e-01 -7.525272264e-01 -7.404953990e-01 3.74 -7.864960733e-01 -7.336514611e-01 -7.232036779e-01 3.76 -7.671679360e-01 -7.152115367e-01 -7.062901193e-01 3.78 -7.482742208e-01 -6.971989108e-01 -6.897475359e-01 3.80 -7.298074367e-01 -6.796051195e-01 -6.735688117e-01 3.82 -7.117600586e-01 -6.624217849e-01 -6.577469063e-01 3.84 -6.941245422e-01 -6.456406211e-01 -6.422748591e-01 3.86 -6.768933390e-01 -6.292534399e-01 -6.271457928e-01 3.88 -6.600589090e-01 -6.132521556e-01 -6.123529164e-01 3.90 -6.436137327e-01 -5.976287890e-01 -5.978895280e-01 3.92 -6.275503215e-01 -5.823754708e-01 -5.837490168e-01 3.94 -6.118612278e-01 -5.674844443e-01 -5.699248650e-01 3.96 -5.965390535e-01 -5.529480681e-01 -5.564106500e-01 3.98 -5.815764580e-01 -5.387588173e-01 -5.432000448e-01 4.00 -5.669661654e-01 -5.249092859e-01 -5.302868199e-01 4.02 -5.527009706e-01 -5.113921869e-01 -5.176648434e-01 4.04 -5.387737450e-01 -4.982003539e-01 -5.053280820e-01 4.06 -5.251774416e-01 -4.853267411e-01 -4.932706015e-01 4.08 -5.119050993e-01 -4.727644236e-01 -4.814865663e-01 4.10 -4.989498468e-01 -4.605065973e-01 -4.699702403e-01 4.12 -4.863049060e-01 -4.485465788e-01 -4.587159861e-01 4.14 -4.739635949e-01 -4.368778048e-01 -4.477182650e-01 4.16 -4.619193297e-01 -4.254938319e-01 -4.369716367e-01 4.18 -4.501656276e-01 -4.143883350e-01 -4.264707584e-01 4.20 -4.386961077e-01 -4.035551074e-01 -4.162103846e-01 4.22 -4.275044931e-01 -3.929880592e-01 -4.061853663e-01 4.24 -4.165846113e-01 -3.826812160e-01 -3.963906500e-01 4.26 -4.059303957e-01 -3.726287187e-01 -3.868212770e-01 4.28 -3.955358855e-01 -3.628248209e-01 -3.774723824e-01 4.30 -3.853952264e-01 -3.532638887e-01 -3.683391940e-01 4.32 -3.755026707e-01 -3.439403988e-01 -3.594170316e-01 4.34 -3.658525769e-01 -3.348489370e-01 -3.507013056e-01 4.36 -3.564394099e-01 -3.259841969e-01 -3.421875158e-01 4.38 -3.472577400e-01 -3.173409784e-01 -3.338712505e-01 4.40 -3.383022431e-01 -3.089141861e-01 -3.257481850e-01 4.42 -3.287411872e-01 -2.999655550e-01 -3.170141465e-01 4.44 -3.082141601e-01 -2.813062287e-01 -2.976301499e-01 4.46 -2.509515972e-01 -2.299347828e-01 -2.425879731e-01 4.48 -1.298870820e-01 -1.205236571e-01 -1.256108553e-01 4.50 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.52 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.54 0.000000000e+00 0.000000000e+00 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