# 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 = Ag3Ni # 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 5.200161564e+06 nan nan 0.80 4.671307078e+06 nan nan 0.82 4.193346278e+06 nan nan 0.84 3.760387608e+06 nan nan 0.86 3.367343417e+06 4.976032097e+06 nan 0.88 3.009748276e+06 4.509131632e+06 5.088504472e+06 0.90 2.683734263e+06 4.083305927e+06 4.624271186e+06 0.92 2.385923512e+06 3.694211598e+06 4.200022854e+06 0.94 2.113409308e+06 3.337990873e+06 3.811626417e+06 0.96 1.863590021e+06 3.011320528e+06 3.455347573e+06 0.98 1.634214511e+06 2.711192979e+06 3.127985589e+06 1.00 1.423250355e+06 2.434971125e+06 2.826668264e+06 1.02 1.228916840e+06 2.180351727e+06 2.548900152e+06 1.04 1.049629784e+06 1.945339753e+06 2.292443664e+06 1.06 8.840174138e+05 1.728125910e+06 2.055374356e+06 1.08 7.308288167e+05 1.527119365e+06 1.835953566e+06 1.10 5.889492277e+05 1.340822708e+06 1.632583168e+06 1.12 4.603182808e+05 1.167939891e+06 1.443819535e+06 1.14 3.562989512e+05 1.007322655e+06 1.268395498e+06 1.16 2.764548783e+05 8.579034759e+05 1.105151672e+06 1.18 2.149897887e+05 7.187526420e+05 9.530993162e+05 1.20 1.675393540e+05 5.890278081e+05 8.113154518e+05 1.22 1.308252006e+05 4.703677003e+05 6.789774418e+05 1.24 1.023470365e+05 3.717394722e+05 5.554804897e+05 1.26 8.020410717e+04 2.944040999e+05 4.438235713e+05 1.28 6.295089586e+04 2.336276567e+05 3.532619673e+05 1.30 4.947990774e+04 1.857371963e+05 2.817256816e+05 1.32 3.894338774e+04 1.479163452e+05 2.250785881e+05 1.34 3.068964067e+04 1.179825471e+05 1.801279475e+05 1.36 2.421375747e+04 9.424899531e+04 1.443837033e+05 1.38 1.912426356e+04 7.539571840e+04 1.159036827e+05 1.40 1.511848961e+04 6.038984563e+04 9.316760206e+04 1.42 1.196209452e+04 4.842819904e+04 7.498855273e+04 1.44 9.472119885e+03 3.887825863e+04 6.043058224e+04 1.46 7.505024640e+03 3.124349001e+04 4.875635971e+04 1.48 5.949186390e+03 2.513261001e+04 3.937898002e+04 1.50 4.717742233e+03 2.023472608e+04 3.183586355e+04 1.52 3.742494041e+03 1.630386412e+04 2.576154248e+04 1.54 2.969724186e+03 1.314609752e+04 2.086482348e+04 1.56 2.356830457e+03 1.060691726e+04 1.691319132e+04 1.58 1.870411584e+03 8.563007153e+03 1.372021881e+04 1.60 1.484243290e+03 6.916577491e+03 1.113643218e+04 1.62 1.177610038e+03 5.589441929e+03 9.044049758e+03 1.64 9.341069897e+02 4.518795492e+03 7.348153619e+03 1.66 7.407147516e+02 3.654180560e+03 5.972314347e+03 1.68 5.871131294e+02 2.955244376e+03 4.855538022e+03 1.70 4.650976816e+02 2.390024563e+03 3.948634257e+03 1.72 3.681908771e+02 1.932848861e+03 3.211730170e+03 1.74 2.912504401e+02 1.562964457e+03 2.612627812e+03 1.76 2.301869723e+02 1.263620060e+03 2.125425864e+03 1.78 1.817462442e+02 1.021359630e+03 1.729134547e+03 1.80 1.433373760e+02 8.253064293e+02 1.406679459e+03 1.82 1.128930940e+02 6.666610630e+02 1.144192156e+03 1.84 8.876763800e+01 5.383022673e+02 9.305077461e+02 1.86 6.965040757e+01 4.344651678e+02 7.565113807e+02 1.88 5.451010307e+01 3.504817296e+02 6.148344897e+02 1.90 4.252549671e+01 2.825417329e+02 4.994505010e+02 1.92 3.304360929e+01 2.275764706e+02 4.054697482e+02 1.94 2.554633179e+01 1.831262429e+02 3.289481202e+02 1.96 1.962108675e+01 1.471911992e+02 2.666654995e+02 1.98 1.493965998e+01 1.181552173e+02 2.159928083e+02 2.00 1.124117336e+01 9.470590534e+01 1.747824906e+02 2.02 8.317880390e+00 7.576996768e+01 1.412786127e+02 2.04 6.006062847e+00 6.048596969e+01 1.140525307e+02 2.06 4.176330166e+00 4.815768020e+01 9.193924140e+01 2.08 2.725953272e+00 3.821967063e+01 7.398775784e+01 2.10 1.574109409e+00 3.021302865e+01 5.942204682e+01 2.12 6.574023245e-01 2.376546159e+01 4.760908655e+01 2.14 -7.415744147e-02 1.857532440e+01 3.803180557e+01 2.16 -6.598016384e-01 1.439846335e+01 3.026357815e+01 2.18 -1.130323642e+00 1.103734197e+01 2.396457985e+01 2.20 -1.509892531e+00 8.331832432e+00 1.885859279e+01 2.22 -1.817433825e+00 6.152565449e+00 1.472138299e+01 2.24 -2.067733153e+00 4.396348288e+00 1.137017118e+01 2.26 -2.272316856e+00 2.979646617e+00 8.655999904e+00 2.28 -2.440153210e+00 1.835359766e+00 6.457611898e+00 2.30 -2.578209578e+00 9.098963869e-01 4.676418348e+00 2.32 -2.691893981e+00 1.601140044e-01 3.232247443e+00 2.34 -2.785404116e+00 -4.486565251e-01 2.060123611e+00 2.36 -2.862002364e+00 -9.442229300e-01 1.107641253e+00 2.38 -2.924231728e+00 -1.348846324e+00 3.324009841e-01 2.40 -2.974084746e+00 -1.680312447e+00 -2.998466924e-01 2.42 -3.013116088e+00 -1.952803372e+00 -8.167207494e-01 2.44 -3.042530139e+00 -2.177604062e+00 -1.240446822e+00 2.46 -3.063328403e+00 -2.363664143e+00 -1.588868067e+00 2.48 -3.076317405e+00 -2.518067122e+00 -1.876309310e+00 2.50 -3.082161450e+00 -2.646431286e+00 -2.114244569e+00 2.52 -3.081468323e+00 -2.753207788e+00 -2.311848348e+00 2.54 -3.074743137e+00 -2.841918721e+00 -2.476398333e+00 2.56 -3.062419844e+00 -2.915319354e+00 -2.613641944e+00 2.58 -3.044933883e+00 -2.975612187e+00 -2.728208977e+00 2.60 -3.022690003e+00 -3.024560737e+00 -2.823795825e+00 2.62 -2.996068977e+00 -3.063577825e+00 -2.903352996e+00 2.64 -2.965432587e+00 -3.093803363e+00 -2.969237488e+00 2.66 -2.931126968e+00 -3.116165965e+00 -3.023335838e+00 2.68 -2.893484734e+00 -3.131431520e+00 -3.067163176e+00 2.70 -2.852821207e+00 -3.140241258e+00 -3.101942704e+00 2.72 -2.809412877e+00 -3.143141395e+00 -3.128669215e+00 2.74 -2.763550938e+00 -3.140606060e+00 -3.148159659e+00 2.76 -2.715520857e+00 -3.133054863e+00 -3.161093192e+00 2.78 -2.665596585e+00 -3.120866226e+00 -3.168042731e+00 2.80 -2.614040331e+00 -3.104387385e+00 -3.169499666e+00 2.82 -2.561085765e+00 -3.083941773e+00 -3.165863805e+00 2.84 -2.506919637e+00 -3.059801638e+00 -3.157443167e+00 2.86 -2.451732557e+00 -3.032223629e+00 -3.144538624e+00 2.88 -2.395736301e+00 -3.001484481e+00 -3.127465874e+00 2.90 -2.339130431e+00 -2.967850487e+00 -3.106518992e+00 2.92 -2.282102332e+00 -2.931578637e+00 -3.081975113e+00 2.94 -2.224827333e+00 -2.892917281e+00 -3.054097850e+00 2.96 -2.167468870e+00 -2.852049312e+00 -3.023139724e+00 2.98 -2.110178715e+00 -2.809049766e+00 -2.989343847e+00 3.00 -2.053097250e+00 -2.764099520e+00 -2.952945027e+00 3.02 -1.996346914e+00 -2.717403127e+00 -2.914170449e+00 3.04 -1.939910087e+00 -2.669161795e+00 -2.873240046e+00 3.06 -1.883842679e+00 -2.619568432e+00 -2.830366653e+00 3.08 -1.828244352e+00 -2.568807587e+00 -2.785756008e+00 3.10 -1.773205835e+00 -2.517055396e+00 -2.739606663e+00 3.12 -1.718809328e+00 -2.464479532e+00 -2.692109844e+00 3.14 -1.665119194e+00 -2.411239197e+00 -2.643449283e+00 3.16 -1.612158034e+00 -2.357485133e+00 -2.593801061e+00 3.18 -1.559979867e+00 -2.303359662e+00 -2.543333458e+00 3.20 -1.508637353e+00 -2.248996769e+00 -2.492206841e+00 3.22 -1.458176856e+00 -2.194522210e+00 -2.440573578e+00 3.24 -1.408638826e+00 -2.140053654e+00 -2.388577998e+00 3.26 -1.360058176e+00 -2.085700849e+00 -2.336352279e+00 3.28 -1.312464649e+00 -2.031565816e+00 -2.283871251e+00 3.30 -1.265883167e+00 -1.977743067e+00 -2.231175847e+00 3.32 -1.220334173e+00 -1.924319838e+00 -2.178376926e+00 3.34 -1.175833959e+00 -1.871376339e+00 -2.125578329e+00 3.36 -1.132394975e+00 -1.818986019e+00 -2.072877047e+00 3.38 -1.090026127e+00 -1.767215837e+00 -2.020363397e+00 3.40 -1.048733065e+00 -1.716126546e+00 -1.968121229e+00 3.42 -1.008518451e+00 -1.665772973e+00 -1.916228131e+00 3.44 -9.693822103e-01 -1.616204308e+00 -1.864752334e+00 3.46 -9.313217803e-01 -1.567458171e+00 -1.813741695e+00 3.48 -8.943323330e-01 -1.519481874e+00 -1.763253812e+00 3.50 -8.584069910e-01 -1.472280508e+00 -1.713343673e+00 3.52 -8.235370292e-01 -1.425885563e+00 -1.664061214e+00 3.54 -7.897120627e-01 -1.380324504e+00 -1.615451557e+00 3.56 -7.569202239e-01 -1.335621012e+00 -1.567555248e+00 3.58 -7.251483269e-01 -1.291795220e+00 -1.520408487e+00 3.60 -6.943820213e-01 -1.248863944e+00 -1.474043364e+00 3.62 -6.646059347e-01 -1.206840901e+00 -1.428488086e+00 3.64 -6.358038054e-01 -1.165736923e+00 -1.383767198e+00 3.66 -6.079586051e-01 -1.125560159e+00 -1.339901803e+00 3.68 -5.810526524e-01 -1.086316272e+00 -1.296909770e+00 3.70 -5.550677177e-01 -1.048008628e+00 -1.254805941e+00 3.72 -5.299851195e-01 -1.010638465e+00 -1.213602330e+00 3.74 -5.057858131e-01 -9.742050739e-01 -1.173308312e+00 3.76 -4.824504718e-01 -9.387059496e-01 -1.133930806e+00 3.78 -4.599595617e-01 -9.041369483e-01 -1.095474453e+00 3.80 -4.382934090e-01 -8.704924302e-01 -1.057941781e+00 3.82 -4.174322621e-01 -8.377653951e-01 -1.021333370e+00 3.84 -3.973563480e-01 -8.059476109e-01 -9.856480014e-01 3.86 -3.780459226e-01 -7.750297343e-01 -9.508828048e-01 3.88 -3.594813169e-01 -7.450014237e-01 -9.170333967e-01 3.90 -3.416429782e-01 -7.158514456e-01 -8.840940105e-01 3.92 -3.245115071e-01 -6.875677738e-01 -8.520576206e-01 3.94 -3.080676905e-01 -6.601376826e-01 -8.209160590e-01 3.96 -2.922925309e-01 -6.335478336e-01 -7.906601257e-01 3.98 -2.771672722e-01 -6.077843558e-01 -7.612796918e-01 4.00 -2.626734229e-01 -5.828329213e-01 -7.327533836e-01 4.02 -2.487927754e-01 -5.586788150e-01 -7.050267519e-01 4.04 -2.355074234e-01 -5.353069987e-01 -6.780842636e-01 4.06 -2.227997767e-01 -5.127021715e-01 -6.519146470e-01 4.08 -2.106525738e-01 -4.908488245e-01 -6.265061268e-01 4.10 -1.990488918e-01 -4.697312920e-01 -6.018464894e-01 4.12 -1.879721554e-01 -4.493337979e-01 -5.779231434e-01 4.14 -1.774061431e-01 -4.296404990e-01 -5.547231760e-01 4.16 -1.673349930e-01 -4.106355241e-01 -5.322334051e-01 4.18 -1.577432062e-01 -3.923030097e-01 -5.104404280e-01 4.20 -1.486156491e-01 -3.746271333e-01 -4.893306660e-01 4.22 -1.399375548e-01 -3.575827207e-01 -4.688904066e-01 4.24 -1.316945237e-01 -3.411447600e-01 -4.491058408e-01 4.26 -1.238725218e-01 -3.252984449e-01 -4.299630993e-01 4.28 -1.164578801e-01 -3.100290937e-01 -4.114482840e-01 4.30 -1.094372913e-01 -2.953221673e-01 -3.935474985e-01 4.32 -1.027978074e-01 -2.811632869e-01 -3.762468746e-01 4.34 -9.652663570e-02 -2.675382489e-01 -3.595325971e-01 4.36 -9.058890982e-02 -2.544330395e-01 -3.433909267e-01 4.38 -8.495850391e-02 -2.418338463e-01 -3.278082202e-01 4.40 -7.962549330e-02 -2.297270691e-01 -3.127709487e-01 4.42 -7.458022647e-02 -2.180993291e-01 -2.982657148e-01 4.44 -6.981332105e-02 -2.069374767e-01 -2.842792669e-01 4.46 -6.531565962e-02 -1.962285980e-01 -2.707985129e-01 4.48 -6.107838528e-02 -1.859600211e-01 -2.578105319e-01 4.50 -5.709289700e-02 -1.761193194e-01 -2.453025847e-01 4.52 -5.335084483e-02 -1.666943165e-01 -2.332621228e-01 4.54 -4.984412556e-02 -1.576730880e-01 -2.216767966e-01 4.56 -4.656487730e-02 -1.490439637e-01 -2.105344621e-01 4.58 -4.350547336e-02 -1.407955290e-01 -1.998231866e-01 4.60 -4.065851671e-02 -1.329166251e-01 -1.895312542e-01 4.62 -3.799823755e-02 -1.253963492e-01 -1.796471689e-01 4.64 -3.547319139e-02 -1.182240540e-01 -1.701596586e-01 4.66 -3.307697217e-02 -1.113893461e-01 -1.610576771e-01 4.68 -3.080542993e-02 -1.048820850e-01 -1.523304061e-01 4.70 -2.865427648e-02 -9.869238077e-02 -1.439672564e-01 4.72 -2.661964589e-02 -9.281059207e-02 -1.359578683e-01 4.74 -2.469792892e-02 -8.722732322e-02 -1.282921119e-01 4.76 -2.288556746e-02 -8.193342143e-02 -1.209600864e-01 4.78 -2.117903511e-02 -7.691997364e-02 -1.139521197e-01 4.80 -1.957472485e-02 -7.217830384e-02 -1.072587668e-01 4.82 -1.806932472e-02 -6.769996802e-02 -1.008708084e-01 4.84 -1.665963830e-02 -6.347675047e-02 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