# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2013--Onat-B-Durukanoglu-S--Cu-Ni # implementation = 2013--Onat-B--Cu-Ni--LAMMPS--ipr2 # 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 Cu Cu Cu Ni Ni Ni 0.02 3.984371174e+02 6.096689537e+02 5.597652881e+02 0.04 3.766051022e+02 5.762857128e+02 5.298038506e+02 0.06 3.559259633e+02 5.446867997e+02 5.014340028e+02 0.08 3.363403930e+02 5.147793261e+02 4.745561168e+02 0.10 3.177928860e+02 4.864745206e+02 4.490871780e+02 0.12 3.002324455e+02 4.596914969e+02 4.249552559e+02 0.14 2.836132786e+02 4.343569155e+02 4.020923608e+02 0.16 2.678944273e+02 4.103979336e+02 3.804344382e+02 0.18 2.530357864e+02 3.877428996e+02 3.599206908e+02 0.20 2.389944207e+02 3.663234098e+02 3.404932198e+02 0.22 2.257291618e+02 3.460744906e+02 3.220968035e+02 0.24 2.131997342e+02 3.269342041e+02 3.046788176e+02 0.26 2.013675816e+02 3.088437058e+02 2.881892105e+02 0.28 1.901961453e+02 2.917472528e+02 2.725826651e+02 0.30 1.796509622e+02 2.755934019e+02 2.578191738e+02 0.32 1.697002318e+02 2.603379278e+02 2.438548970e+02 0.34 1.603234940e+02 2.459359607e+02 2.306486305e+02 0.36 1.514915328e+02 2.323407298e+02 2.181615691e+02 0.38 1.431740164e+02 2.195088745e+02 2.063569424e+02 0.40 1.353433447e+02 2.073996700e+02 1.951997491e+02 0.42 1.279736521e+02 1.959745474e+02 1.846565733e+02 0.44 1.210402751e+02 1.851967903e+02 1.746954611e+02 0.46 1.145194577e+02 1.750313398e+02 1.652858381e+02 0.48 1.083964255e+02 1.654446645e+02 1.563984512e+02 0.50 1.026667156e+02 1.564092822e+02 1.480053208e+02 0.52 9.729925582e+01 1.479102095e+02 1.400798766e+02 0.54 9.226587759e+01 1.399129836e+02 1.326095522e+02 0.56 8.754137105e+01 1.323845567e+02 1.255707342e+02 0.58 8.310254355e+01 1.252945063e+02 1.189365362e+02 0.60 7.892777661e+01 1.186145049e+02 1.126819591e+02 0.62 7.499682407e+01 1.123180044e+02 1.067835941e+02 0.64 7.129127175e+01 1.063800460e+02 1.012194132e+02 0.66 6.779636493e+01 1.007771447e+02 9.596862035e+01 0.68 6.449462783e+01 9.548721315e+01 9.101154474e+01 0.70 6.136959971e+01 9.048969660e+01 8.632956507e+01 0.72 5.840644493e+01 8.576610038e+01 8.190505434e+01 0.74 5.559179797e+01 8.129806815e+01 7.772133915e+01 0.76 5.291364503e+01 7.706888774e+01 7.376266853e+01 0.78 5.036122328e+01 7.306223359e+01 7.001418881e+01 0.80 4.792492831e+01 6.926298235e+01 6.646185622e+01 0.82 4.559622532e+01 6.565723305e+01 6.309246389e+01 0.84 4.336756231e+01 6.223222343e+01 5.989443292e+01 0.86 4.123228460e+01 5.897625305e+01 5.685630920e+01 0.88 3.918455097e+01 5.587861139e+01 5.396708619e+01 0.90 3.721925213e+01 5.292950990e+01 5.121663268e+01 0.92 3.533193202e+01 5.012001723e+01 4.859565650e+01 0.94 3.351871266e+01 4.744199742e+01 4.609567057e+01 0.96 3.177622311e+01 4.488805080e+01 4.370896024e+01 0.98 3.010153293e+01 4.245145746e+01 4.142854994e+01 1.00 2.849209060e+01 4.012612330e+01 3.924816900e+01 1.02 2.694566709e+01 3.790652849e+01 3.716221600e+01 1.04 2.546030464e+01 3.578767844e+01 3.516572142e+01 1.06 2.403427100e+01 3.376505740e+01 3.325430908e+01 1.08 2.266601905e+01 3.183450155e+01 3.142415428e+01 1.10 2.135415165e+01 2.999177604e+01 2.967188420e+01 1.12 2.009739177e+01 2.823328106e+01 2.799387678e+01 1.14 1.889455771e+01 2.655588447e+01 2.638697032e+01 1.16 1.774454319e+01 2.495664883e+01 2.484882845e+01 1.18 1.664630221e+01 2.343287283e+01 2.337724592e+01 1.20 1.559883832e+01 2.198206295e+01 2.197023795e+01 1.22 1.460120224e+01 2.060190845e+01 2.062601308e+01 1.24 1.365143255e+01 1.929026205e+01 1.934293457e+01 1.26 1.274746231e+01 1.804470792e+01 1.811948552e+01 1.28 1.188802278e+01 1.686246768e+01 1.695423808e+01 1.30 1.107183900e+01 1.574143305e+01 1.584582705e+01 1.32 1.029762949e+01 1.467956935e+01 1.479292793e+01 1.34 9.564108167e+00 1.367489101e+01 1.379423920e+01 1.36 8.869987488e+00 1.272545409e+01 1.284846855e+01 1.38 8.213982401e+00 1.182935113e+01 1.195432241e+01 1.40 7.594814929e+00 1.098470817e+01 1.111049831e+01 1.42 7.011219169e+00 1.018968347e+01 1.031567929e+01 1.44 6.461946515e+00 9.442467656e+00 9.568529764e+00 1.46 5.945770943e+00 8.741284696e+00 8.867692168e+00 1.48 5.461494242e+00 8.084393394e+00 8.211784090e+00 1.50 5.007951093e+00 7.470089130e+00 7.599396041e+00 1.52 4.584013950e+00 6.896701441e+00 7.028971580e+00 1.54 4.188597698e+00 6.362288655e+00 6.495450047e+00 1.56 3.820664123e+00 5.863579057e+00 5.995555620e+00 1.58 3.479226325e+00 5.398752683e+00 5.528071165e+00 1.60 3.163157574e+00 4.964616137e+00 5.091480636e+00 1.62 2.868655996e+00 4.558987180e+00 4.684289679e+00 1.64 2.593734115e+00 4.180334411e+00 4.305029166e+00 1.66 2.337349582e+00 3.827184963e+00 3.952258140e+00 1.68 2.098502000e+00 3.498124001e+00 3.624566786e+00 1.70 1.876231881e+00 3.191794319e+00 3.320579382e+00 1.72 1.669620027e+00 2.906895770e+00 3.038957161e+00 1.74 1.477786770e+00 2.642184567e+00 2.778401046e+00 1.76 1.299891133e+00 2.396472441e+00 2.537654178e+00 1.78 1.135129896e+00 2.168625679e+00 2.315504200e+00 1.80 9.827366065e-01 1.957564067e+00 2.110785232e+00 1.82 8.419805472e-01 1.762259711e+00 1.922379494e+00 1.84 7.121656588e-01 1.581735766e+00 1.749218549e+00 1.86 5.926294468e-01 1.415065079e+00 1.590284133e+00 1.88 4.827418744e-01 1.261368733e+00 1.444608577e+00 1.90 3.819042485e-01 1.119814530e+00 1.311274807e+00 1.92 2.895481063e-01 9.896153946e-01 1.189415965e+00 1.94 2.051341090e-01 8.700277238e-01 1.078214648e+00 1.96 1.281509477e-01 7.603497015e-01 9.769018245e-01 1.98 5.811426105e-02 6.599195736e-01 8.847554674e-01 2.00 -5.434428340e-03 5.681139117e-01 8.010989384e-01 2.02 -6.292875889e-02 4.843458695e-01 7.252991846e-01 2.04 -1.147785548e-01 4.080634520e-01 6.567647895e-01 2.06 -1.613708255e-01 3.387478029e-01 5.949439226e-01 2.08 -2.030707461e-01 2.759115226e-01 5.393222319e-01 2.10 -2.402226115e-01 2.190970283e-01 4.894207152e-01 2.12 -2.731507667e-01 1.678749604e-01 4.447936018e-01 2.14 -3.021605114e-01 1.218426432e-01 4.050262730e-01 2.16 -3.275389803e-01 8.062260183e-02 3.697332427e-01 2.18 -3.495559960e-01 4.386114498e-02 3.385562147e-01 2.20 -3.684648978e-01 1.122700589e-02 3.111622292e-01 2.22 -3.845033434e-01 -1.758994627e-02 2.872419076e-01 2.24 -3.978940858e-01 -4.287993811e-02 2.665078005e-01 2.26 -4.088457206e-01 -6.491444998e-02 2.486928399e-01 2.28 -4.175534123e-01 -8.394732280e-02 2.335488961e-01 2.30 -4.241995873e-01 -1.002157929e-01 2.208454367e-01 2.32 -4.289546083e-01 -1.139414814e-01 2.103682844e-01 2.34 -4.319774152e-01 -1.253313123e-01 2.019184679e-01 2.36 -4.334161423e-01 -1.345783943e-01 1.953111617e-01 2.38 -4.334087147e-01 -1.418628360e-01 1.903747075e-01 2.40 -4.320834121e-01 -1.473525281e-01 1.869497129e-01 2.42 -4.295594107e-01 -1.512038660e-01 1.848882196e-01 2.44 -4.259472999e-01 -1.535624432e-01 1.840529368e-01 2.46 -4.213495736e-01 -1.545636940e-01 1.843165334e-01 2.48 -4.158610996e-01 -1.543335055e-01 1.855609840e-01 2.50 -4.095695635e-01 -1.529887887e-01 1.876769642e-01 2.52 -4.025558919e-01 -1.506380207e-01 1.905632901e-01 2.54 -3.948946037e-01 -1.473817515e-01 1.941263989e-01 2.56 -3.866547344e-01 -1.433130834e-01 1.982798658e-01 2.58 -3.778971458e-01 -1.385181207e-01 2.029439553e-01 2.60 -3.686818477e-01 -1.330763945e-01 2.080452027e-01 2.62 -3.591176760e-01 -1.270612597e-01 2.135160240e-01 2.64 -3.493062302e-01 -1.205402708e-01 2.192943518e-01 2.66 -3.393034131e-01 -1.135755350e-01 2.253232950e-01 2.68 -3.291479766e-01 -1.062240429e-01 2.315508200e-01 2.70 -3.188801650e-01 -9.853797781e-02 2.379294531e-01 2.72 -3.085360708e-01 -9.056496130e-02 2.444160012e-01 2.74 -2.981487961e-01 -8.234846148e-02 2.509712905e-01 2.76 -2.877485932e-01 -7.393033194e-02 2.575599214e-01 2.78 -2.773630601e-01 -6.533923045e-02 2.641500393e-01 2.80 -2.670173230e-01 -5.663846960e-02 2.707131191e-01 2.82 -2.567342052e-01 -4.788435513e-02 2.772237640e-01 2.84 -2.465343883e-01 -3.910990104e-02 2.836595174e-01 2.86 -2.364365661e-01 -3.034692812e-02 2.900006864e-01 2.88 -2.264575826e-01 -2.160593277e-02 2.962301762e-01 2.90 -2.166125644e-01 -1.290917328e-02 3.023333368e-01 2.92 -2.069150423e-01 -4.310439386e-03 3.082978201e-01 2.94 -1.973770664e-01 4.152722336e-03 3.141134438e-01 2.96 -1.880093201e-01 1.246541489e-02 3.197720686e-01 2.98 -1.788212161e-01 2.061297363e-02 3.252674805e-01 3.00 -1.698209870e-01 2.858230350e-02 3.305952728e-01 3.02 -1.610157794e-01 3.636184665e-02 3.357531957e-01 3.04 -1.524117383e-01 4.394143670e-02 3.407353098e-01 3.06 -1.440140720e-01 5.131221303e-02 3.455544933e-01 3.08 -1.358271314e-01 5.846652099e-02 3.501509429e-01 3.10 -1.278544841e-01 6.539781502e-02 3.544473403e-01 3.12 -1.200989549e-01 7.210059740e-02 3.584225846e-01 3.14 -1.125627037e-01 7.857031932e-02 3.620642422e-01 3.16 -1.052472756e-01 8.480331461e-02 3.654006242e-01 3.18 -9.815362925e-02 9.079675227e-02 3.684343605e-01 3.20 -9.128222290e-02 9.654853354e-02 3.711667411e-01 3.22 -8.463301890e-02 1.020572739e-01 3.735993833e-01 3.24 -7.820555056e-02 1.073222241e-01 3.757346282e-01 3.26 -7.199895503e-02 1.123432166e-01 3.775753499e-01 3.28 -6.601197928e-02 1.171206488e-01 3.791249271e-01 3.30 -6.024306993e-02 1.216553797e-01 3.803871918e-01 3.32 -5.469032671e-02 1.259487664e-01 3.813663847e-01 3.34 -4.935161967e-02 1.300025325e-01 3.820671209e-01 3.36 -4.422451709e-02 1.338188361e-01 3.824943572e-01 3.38 -3.930641247e-02 1.374001264e-01 3.826533500e-01 3.40 -3.459443950e-02 1.407492215e-01 3.825496062e-01 3.42 -3.008560575e-02 1.438691643e-01 3.821888734e-01 3.44 -2.577668860e-02 1.467633281e-01 3.815771248e-01 3.46 -2.166439118e-02 1.494352319e-01 3.807204939e-01 3.48 -1.774520155e-02 1.518886924e-01 3.796252543e-01 3.50 -1.401558479e-02 1.541276183e-01 3.782978470e-01 3.52 -1.047180560e-02 1.561561903e-01 3.767448067e-01 3.54 -7.110134477e-03 1.579786186e-01 3.749727218e-01 3.56 -3.926688137e-03 1.595993499e-01 3.729883216e-01 3.58 -9.175583940e-04 1.610228761e-01 3.707983300e-01 3.60 1.921204642e-03 1.622537763e-01 3.684095038e-01 3.62 4.593679464e-03 1.632968219e-01 3.658287063e-01 3.64 7.103841590e-03 1.641566595e-01 3.630626658e-01 3.66 9.455843911e-03 1.648382133e-01 3.601182652e-01 3.68 1.165376204e-02 1.653462865e-01 3.570022362e-01 3.70 1.370169350e-02 1.656857490e-01 3.537213650e-01 3.72 1.560387226e-02 1.658616451e-01 3.502823886e-01 3.74 1.736432509e-02 1.658787732e-01 3.466919441e-01 3.76 1.898720404e-02 1.657421411e-01 3.429567285e-01 3.78 2.047671047e-02 1.654567841e-01 3.390832188e-01 3.80 2.183681640e-02 1.650274851e-01 3.350780098e-01 3.82 2.307166594e-02 1.644592526e-01 3.309474406e-01 3.84 2.418541747e-02 1.637571289e-01 3.266979063e-01 3.86 2.518195363e-02 1.629257946e-01 3.223356914e-01 3.88 2.606533460e-02 1.619701554e-01 3.178668284e-01 3.90 2.683969382e-02 1.608953032e-01 3.132977048e-01 3.92 2.750880254e-02 1.597056683e-01 3.086338651e-01 3.94 2.807654941e-02 1.584060793e-01 3.038817061e-01 3.96 2.854699379e-02 1.570014572e-01 2.990466043e-01 3.98 2.892391783e-02 1.554963389e-01 2.941343194e-01 4.00 2.921093106e-02 1.538951579e-01 2.891508788e-01 4.02 2.941186381e-02 1.522024957e-01 2.841009840e-01 4.04 2.953064443e-02 1.504233051e-01 2.789906384e-01 4.06 2.957071739e-02 1.485616408e-01 2.738251594e-01 4.08 2.953553725e-02 1.466215421e-01 2.686088897e-01 4.10 2.942876955e-02 1.446076909e-01 2.633477824e-01 4.12 2.925418955e-02 1.425248701e-01 2.580469047e-01 4.14 2.901504959e-02 1.403765894e-01 2.527098429e-01 4.16 2.871448918e-02 1.381666547e-01 2.473421736e-01 4.18 2.835591458e-02 1.358995232e-01 2.419497445e-01 4.20 2.794285442e-02 1.335794333e-01 2.365349294e-01 4.22 2.747877108e-02 1.312106519e-01 2.311022791e-01 4.24 2.696632929e-02 1.287959711e-01 2.256578932e-01 4.26 2.640850185e-02 1.263391788e-01 2.202064648e-01 4.28 2.580845224e-02 1.238440080e-01 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