# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2023--Daw-M-S-Chandross-M--Cu-Ag-Au-Ni-Pd-Pt # implementation = 2023--Daw-M-S--Cu-Ag-Au-Ni-Pd-Pt--LAMMPS--ipr1 # composition = AgCu3 # 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 2026-08-31 r A15--Cr3Si D0_3--BiF3 L1_2--AuCu3 0.50 nan nan nan 0.52 nan nan nan 0.54 nan nan nan 0.56 nan nan nan 0.58 nan nan nan 0.60 nan nan nan 0.62 nan nan nan 0.64 nan nan nan 0.66 nan nan nan 0.68 nan nan nan 0.70 nan nan nan 0.72 nan nan nan 0.74 nan nan nan 0.76 nan nan nan 0.78 3.007477629e+06 nan nan 0.80 2.688752240e+06 nan nan 0.82 2.400663634e+06 nan nan 0.84 2.139659945e+06 nan nan 0.86 1.902672583e+06 2.872522876e+06 nan 0.88 1.687047109e+06 2.591153822e+06 2.940495681e+06 0.90 1.490451757e+06 2.334448100e+06 2.660738059e+06 0.92 1.310839776e+06 2.099850072e+06 2.404992611e+06 0.94 1.146458466e+06 1.885081796e+06 2.170822770e+06 0.96 9.957417909e+05 1.688135849e+06 1.956054861e+06 0.98 8.572939639e+05 1.507140237e+06 1.758696795e+06 1.00 7.299487109e+05 1.340563404e+06 1.577019839e+06 1.02 6.126182697e+05 1.186988511e+06 1.409486079e+06 1.04 5.043554975e+05 1.045196096e+06 1.254777640e+06 1.06 4.043132332e+05 9.141152923e+05 1.111729285e+06 1.08 3.129599407e+05 7.927444361e+05 9.792943861e+05 1.10 2.405866107e+05 6.802343621e+05 8.565300225e+05 1.12 1.854268497e+05 5.758414860e+05 7.425702485e+05 1.14 1.432597502e+05 4.788641686e+05 6.366694045e+05 1.16 1.109236814e+05 3.886355413e+05 5.381293468e+05 1.18 8.606428378e+04 3.063304151e+05 4.463138588e+05 1.20 6.690963087e+04 2.407095548e+05 3.606784708e+05 1.22 5.211292421e+04 1.895515843e+05 2.850955002e+05 1.24 4.065564204e+04 1.495538302e+05 2.256538596e+05 1.26 3.176763652e+04 1.182157666e+05 1.789628153e+05 1.28 2.485905770e+04 9.361288022e+04 1.422060657e+05 1.30 1.947643681e+04 7.425859935e+04 1.132051374e+05 1.32 1.527550010e+04 5.900105307e+04 9.026504171e+04 1.34 1.199271073e+04 4.694434333e+04 7.208642359e+04 1.36 9.424429013e+03 3.740129632e+04 5.765568094e+04 1.38 7.411706284e+03 2.983554634e+04 4.618157887e+04 1.40 5.831860965e+03 2.382706111e+04 3.703808600e+04 1.42 4.590752114e+03 1.904932149e+04 2.973628197e+04 1.44 3.615109622e+03 1.524556843e+04 2.389804180e+04 1.46 2.847600418e+03 1.221255392e+04 1.922367368e+04 1.48 2.243396951e+03 9.789426552e+03 1.547633855e+04 1.50 1.767372340e+03 7.850964204e+03 1.246918253e+04 1.52 1.392098747e+03 6.299069867e+03 1.005329455e+04 1.54 1.096229243e+03 5.055820207e+03 8.110236254e+03 1.56 8.629567554e+02 4.059083098e+03 6.546341655e+03 1.58 6.790223132e+02 3.259510516e+03 5.286636928e+03 1.60 5.340098135e+02 2.617857167e+03 4.270807279e+03 1.62 4.197055038e+02 2.102763411e+03 3.451130113e+03 1.64 3.295877018e+02 1.689137918e+03 2.789426194e+03 1.66 2.585372466e+02 1.356870363e+03 2.254967431e+03 1.68 2.025369371e+02 1.089730557e+03 1.822923655e+03 1.70 1.584167824e+02 8.748367137e+02 1.473427166e+03 1.72 1.236725462e+02 7.019958212e+02 1.190678234e+03 1.74 9.633012960e+01 5.630012324e+02 9.619173155e+02 1.76 7.483229156e+01 4.512414136e+02 7.768473898e+02 1.78 5.794229450e+01 3.613802298e+02 6.271292525e+02 1.80 4.468256416e+01 2.891317225e+02 5.060089484e+02 1.82 3.428309924e+01 2.310738044e+02 4.080294469e+02 1.84 2.613216896e+01 1.844452009e+02 3.287920917e+02 1.86 1.974741711e+01 1.470180503e+02 2.647324681e+02 1.88 1.474689075e+01 1.169951632e+02 2.129615939e+02 1.90 1.083378686e+01 9.292476931e+01 1.711041208e+02 1.92 7.774107416e+00 7.363777417e+01 1.372404296e+02 1.94 5.383029149e+00 5.819185902e+01 1.098662673e+02 1.96 3.514837545e+00 4.582155428e+01 8.775709382e+01 1.98 2.054880291e+00 3.592203548e+01 6.991612318e+01 2.00 9.131296882e-01 2.800187777e+01 5.553232399e+01 2.02 1.896083448e-02 2.166677526e+01 4.394560604e+01 2.04 -6.826495065e-01 1.660446430e+01 3.462021741e+01 2.06 -1.234554219e+00 1.256330195e+01 2.712029465e+01 2.08 -1.670079869e+00 9.340180734e+00 2.109361743e+01 2.10 -2.015066168e+00 6.771394549e+00 1.625487742e+01 2.12 -2.289430598e+00 4.725193098e+00 1.237283013e+01 2.14 -2.508492212e+00 3.095715937e+00 9.260191883e+00 2.16 -2.683998969e+00 1.798051181e+00 6.765180327e+00 2.18 -2.825008597e+00 7.641680454e-01 4.765862713e+00 2.20 -2.938418807e+00 -6.019327319e-02 3.163956220e+00 2.22 -3.029487378e+00 -7.182443483e-01 1.880248178e+00 2.24 -3.102218654e+00 -1.244344034e+00 8.508329635e-01 2.26 -3.159612447e+00 -1.665782448e+00 2.424530548e-02 2.28 -3.204030432e+00 -2.004161994e+00 -6.400648891e-01 2.30 -3.237298917e+00 -2.276564507e+00 -1.174604338e+00 2.32 -3.260835809e+00 -2.496463896e+00 -1.605433040e+00 2.34 -3.275754427e+00 -2.674458054e+00 -1.953370092e+00 2.36 -3.282943107e+00 -2.818859452e+00 -2.234985277e+00 2.38 -3.283125757e+00 -2.936170695e+00 -2.463460873e+00 2.40 -3.276907483e+00 -3.031466535e+00 -2.649256787e+00 2.42 -3.264808581e+00 -3.108699956e+00 -2.800651009e+00 2.44 -3.247289515e+00 -3.170946700e+00 -2.924178200e+00 2.46 -3.224768954e+00 -3.220595141e+00 -3.024984865e+00 2.48 -3.197602932e+00 -3.259501880e+00 -3.107116304e+00 2.50 -3.166103752e+00 -3.289112784e+00 -3.173730254e+00 2.52 -3.130553630e+00 -3.310504746e+00 -3.227212732e+00 2.54 -3.091280862e+00 -3.324579539e+00 -3.269480534e+00 2.56 -3.048615781e+00 -3.332074875e+00 -3.302040904e+00 2.58 -3.002880289e+00 -3.333596832e+00 -3.326115005e+00 2.60 -2.954388238e+00 -3.329653921e+00 -3.342675508e+00 2.62 -2.903445290e+00 -3.320544327e+00 -3.352504235e+00 2.64 -2.850348439e+00 -3.306492001e+00 -3.356237848e+00 2.66 -2.795385362e+00 -3.287840949e+00 -3.354403578e+00 2.68 -2.738717630e+00 -3.264906861e+00 -3.347446955e+00 2.70 -2.680441506e+00 -3.237984678e+00 -3.335753139e+00 2.72 -2.620805131e+00 -3.207354186e+00 -3.319663151e+00 2.74 -2.560046667e+00 -3.173283939e+00 -3.299486066e+00 2.76 -2.498392676e+00 -3.136033891e+00 -3.275508026e+00 2.78 -2.436027989e+00 -3.095857066e+00 -3.247998767e+00 2.80 -2.373107743e+00 -3.053000504e+00 -3.217216223e+00 2.82 -2.309820862e+00 -3.007705680e+00 -3.183409648e+00 2.84 -2.246332357e+00 -2.960196417e+00 -3.146805496e+00 2.86 -2.182795380e+00 -2.910690491e+00 -3.107624303e+00 2.88 -2.119364168e+00 -2.859411598e+00 -3.066088499e+00 2.90 -2.056181704e+00 -2.806576969e+00 -3.022207875e+00 2.92 -1.993379977e+00 -2.752396920e+00 -2.976106279e+00 2.94 -1.931080299e+00 -2.697074405e+00 -2.927992435e+00 2.96 -1.869393652e+00 -2.640783693e+00 -2.878069433e+00 2.98 -1.808421063e+00 -2.583656582e+00 -2.826534493e+00 3.00 -1.748254014e+00 -2.525867730e+00 -2.773578683e+00 3.02 -1.688974855e+00 -2.467586120e+00 -2.719386634e+00 3.04 -1.630657238e+00 -2.408972066e+00 -2.664136249e+00 3.06 -1.573366562e+00 -2.350150700e+00 -2.607998448e+00 3.08 -1.517160412e+00 -2.291117088e+00 -2.551136940e+00 3.10 -1.462089006e+00 -2.231980771e+00 -2.493708038e+00 3.12 -1.408195635e+00 -2.172865670e+00 -2.435860521e+00 3.14 -1.355508222e+00 -2.113887662e+00 -2.377735540e+00 3.16 -1.304017864e+00 -2.055154726e+00 -2.319466569e+00 3.18 -1.253745751e+00 -1.996767119e+00 -2.261179407e+00 3.20 -1.204712810e+00 -1.938817582e+00 -2.202992212e+00 3.22 -1.156935181e+00 -1.881391565e+00 -2.145015582e+00 3.24 -1.110424585e+00 -1.824567463e+00 -2.087352665e+00 3.26 -1.065188021e+00 -1.768416880e+00 -2.030097858e+00 3.28 -1.021205679e+00 -1.713004896e+00 -1.973285954e+00 3.30 -9.784667304e-01 -1.658390341e+00 -1.916971534e+00 3.32 -9.369694755e-01 -1.604626082e+00 -1.861229979e+00 3.34 -8.967094006e-01 -1.551759309e+00 -1.806130382e+00 3.36 -8.576794406e-01 -1.499831821e+00 -1.751735783e+00 3.38 -8.198702247e-01 -1.448880315e+00 -1.698103413e+00 3.40 -7.832703070e-01 -1.398936667e+00 -1.645284938e+00 3.42 -7.478663834e-01 -1.350028216e+00 -1.593326718e+00 3.44 -7.136434945e-01 -1.302178038e+00 -1.542270054e+00 3.46 -6.805852149e-01 -1.255402955e+00 -1.492151451e+00 3.48 -6.486738300e-01 -1.209685181e+00 -1.443002868e+00 3.50 -6.178905000e-01 -1.165026314e+00 -1.394851966e+00 3.52 -5.882154125e-01 -1.121435945e+00 -1.347722365e+00 3.54 -5.596279238e-01 -1.078920721e+00 -1.301590027e+00 3.56 -5.321066890e-01 -1.037484570e+00 -1.256414923e+00 3.58 -5.056297827e-01 -9.971289038e-01 -1.212211341e+00 3.60 -4.801748095e-01 -9.578528172e-01 -1.168990841e+00 3.62 -4.557190058e-01 -9.196532794e-01 -1.126762212e+00 3.64 -4.322393325e-01 -8.825253119e-01 -1.085531662e+00 3.66 -4.097125603e-01 -8.464621597e-01 -1.045303003e+00 3.68 -3.881153472e-01 -8.114554527e-01 -1.006077830e+00 3.70 -3.674243088e-01 -7.774953576e-01 -9.678556883e-01 3.72 -3.476160819e-01 -7.445707223e-01 -9.306342364e-01 3.74 -3.286673823e-01 -7.126692107e-01 -8.944093993e-01 3.76 -3.105550563e-01 -6.817774296e-01 -8.591755149e-01 3.78 -2.932561274e-01 -6.518810476e-01 -8.249254728e-01 3.80 -2.767478377e-01 -6.229649069e-01 -7.916508451e-01 3.82 -2.610076846e-01 -5.950131266e-01 -7.593420107e-01 3.84 -2.460134533e-01 -5.680092000e-01 -7.279882722e-01 3.86 -2.317432456e-01 -5.419360845e-01 -6.975779657e-01 3.88 -2.181755044e-01 -5.167762856e-01 -6.680985644e-01 3.90 -2.052890357e-01 -4.925119342e-01 -6.395367758e-01 3.92 -1.930630268e-01 -4.691248583e-01 -6.118786319e-01 3.94 -1.814770617e-01 -4.465966496e-01 -5.851095751e-01 3.96 -1.705111347e-01 -4.249087243e-01 -5.592145365e-01 3.98 -1.601456602e-01 -4.040423792e-01 -5.341780105e-01 4.00 -1.503614818e-01 -3.839788429e-01 -5.099804704e-01 4.02 -1.411398781e-01 -3.646993236e-01 -4.865907726e-01 4.04 -1.324625681e-01 -3.461850510e-01 -4.639914437e-01 4.06 -1.243117135e-01 -3.284173163e-01 -4.421665134e-01 4.08 -1.166384333e-01 -3.113775070e-01 -4.210998650e-01 4.10 -1.093344910e-01 -2.950471392e-01 -4.007752811e-01 4.12 -1.023819904e-01 -2.794078866e-01 -3.811764848e-01 4.14 -9.576962843e-02 -2.644416059e-01 -3.622871780e-01 4.16 -8.948639871e-02 -2.501303605e-01 -3.440910761e-01 4.18 -8.352158924e-02 -2.364564407e-01 -3.265719402e-01 4.20 -7.786466851e-02 -2.234023822e-01 -3.097136055e-01 4.22 -7.250521674e-02 -2.109509815e-01 -2.935000085e-01 4.24 -6.743368271e-02 -1.990853104e-01 -2.779152099e-01 4.26 -6.264070944e-02 -1.877887275e-01 -2.629434169e-01 4.28 -5.811710107e-02 -1.770448890e-01 -2.485690023e-01 4.30 -5.385385429e-02 -1.668377566e-01 -2.347765216e-01 4.32 -4.984218159e-02 -1.571459335e-01 -2.215507285e-01 4.34 -4.607352775e-02 -1.478909171e-01 -2.088765887e-01 4.36 -4.253958083e-02 -1.390424589e-01 -1.967392915e-01 4.38 -3.923227848e-02 -1.305887514e-01 -1.851242606e-01 4.40 -3.614381054e-02 -1.225182430e-01 -1.740171630e-01 4.42 -3.326661953e-02 -1.148196390e-01 -1.634039163e-01 4.44 -3.059339636e-02 -1.074819018e-01 -1.532706959e-01 4.46 -2.811473419e-02 -1.004942507e-01 -1.436039400e-01 4.48 -2.578452140e-02 -9.384616083e-02 -1.343903536e-01 4.50 -2.358376021e-02 -8.752736241e-02 -1.256169126e-01 4.52 -2.150813447e-02 -8.152783931e-02 -1.172708656e-01 4.54 -1.955346056e-02 -7.583782522e-02 -1.093397360e-01 4.56 -1.771567816e-02 -7.044780231e-02 -1.018113230e-01 4.58 -1.599048404e-02 -6.534849877e-02 -9.467370163e-02 4.60 -1.437405650e-02 -6.053088445e-02 -8.791522354e-02 4.62 -1.286293820e-02 -5.598616898e-02 -8.152451338e-02 4.64 -1.145372187e-02 -5.170566301e-02 -7.549046901e-02 4.66 -1.014306050e-02 -4.768092225e-02 -6.980226024e-02 4.68 -8.927675522e-03 -4.390375819e-02 -6.444932653e-02 4.70 -7.804363125e-03 -4.036650977e-02 -5.942118910e-02 4.72 -6.769999126e-03 -3.706177080e-02 -5.470770335e-02 4.74 -5.821542497e-03 -3.398224256e-02 -5.029934206e-02 4.76 -4.956037793e-03 -3.112075898e-02 -4.618674203e-02 4.78 -4.170616635e-03 -2.847030619e-02 -4.236072034e-02 4.80 -3.462498408e-03 -2.602403721e-02 -3.881229142e-02 4.82 -2.828990290e-03 -2.377528307e-02 -3.553268026e-02 4.84 -2.267486726e-03 -2.171755828e-02 -3.251333155e-02 4.86 -1.775468453e-03 -1.984456598e-02 -2.974591325e-02 4.88 -1.350501148e-03 -1.815020011e-02 -2.722232220e-02 4.90 -9.902337778e-04 -1.662403075e-02 -2.493468543e-02 4.92 -6.923967114e-04 -1.525068265e-02 -2.287535953e-02 4.94 -4.547996479e-04 -1.402478909e-02 -2.103692852e-02 4.96 -2.753294061e-04 -1.294150358e-02 -1.941220054e-02 4.98 -1.519477096e-04 -1.199613612e-02 -1.799420418e-02 5.00 -7.151353857e-05 -1.113929481e-02 -1.670894221e-02 5.02 -2.146892271e-05 -1.032380475e-02 -1.548570713e-02 5.04 -7.336221849e-07 -9.548460073e-03 -1.432269011e-02 5.06 0.000000000e+00 -8.812077177e-03 -1.321811577e-02 5.08 0.000000000e+00 -8.113495640e-03 -1.217024346e-02 5.10 0.000000000e+00 -7.451579410e-03 -1.117736912e-02 5.12 0.000000000e+00 -6.825217738e-03 -1.023782661e-02 5.14 0.000000000e+00 -6.233325871e-03 -9.349988806e-03 5.16 0.000000000e+00 -5.674845548e-03 -8.512268322e-03 5.18 0.000000000e+00 -5.148745312e-03 -7.723117967e-03 5.20 0.000000000e+00 -4.654020666e-03 -6.981030999e-03 5.22 0.000000000e+00 -4.189694107e-03 -6.284541160e-03 5.24 0.000000000e+00 -3.754815030e-03 -5.632222545e-03 5.26 0.000000000e+00 -3.348459549e-03 -5.022689324e-03 5.28 0.000000000e+00 -2.969730226e-03 -4.454595339e-03 5.30 0.000000000e+00 -2.617755732e-03 -3.926633598e-03 5.32 0.000000000e+00 -2.291690452e-03 -3.437535678e-03 5.34 0.000000000e+00 -1.990714039e-03 -2.986071059e-03 5.36 0.000000000e+00 -1.714030929e-03 -2.571046393e-03 5.38 0.000000000e+00 -1.460869823e-03 -2.191304735e-03 5.40 0.000000000e+00 -1.230483148e-03 -1.845724722e-03 5.42 0.000000000e+00 -1.022146494e-03 -1.533219741e-03 5.44 0.000000000e+00 -8.351580408e-04 -1.252737061e-03 5.46 0.000000000e+00 -6.688379723e-04 -1.003256959e-03 5.48 0.000000000e+00 -5.225278894e-04 -7.837918341e-04 5.50 0.000000000e+00 -3.955902166e-04 -5.933853250e-04 5.52 0.000000000e+00 -2.874076124e-04 -4.311114186e-04 5.54 0.000000000e+00 -1.973823810e-04 -2.960735715e-04 5.56 0.000000000e+00 -1.249358909e-04 -1.874038364e-04 5.58 0.000000000e+00 -6.950799952e-05 -1.042619993e-04 5.60 0.000000000e+00 -3.055648667e-05 -4.583473001e-05 5.62 0.000000000e+00 -7.556498200e-06 -1.133474730e-05 5.64 0.000000000e+00 1.948272213e-11 2.922408314e-11 5.66 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.68 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.70 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.72 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.74 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.76 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.78 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.80 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.82 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.84 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.86 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.88 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.90 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.92 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.94 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.96 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.98 0.000000000e+00 0.000000000e+00 0.000000000e+00 6.00 0.000000000e+00 0.000000000e+00 0.000000000e+00