# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2026--Starikov-S-Grigorev-P-Smirnova-D--Cu-Ag-Co # implementation = 2026--Starikov-S--Cu-Ag-Co--LAMMPS--ipr1 # composition = AgCo3 # 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 nan nan nan 0.80 nan nan nan 0.82 nan nan nan 0.84 5.260630200e+02 nan nan 0.86 4.731895378e+02 nan nan 0.88 4.257600126e+02 nan nan 0.90 3.832774487e+02 nan nan 0.92 3.452650280e+02 5.148812198e+02 nan 0.94 3.113054087e+02 4.671806352e+02 5.353888043e+02 0.96 2.810051776e+02 4.243383409e+02 4.867113549e+02 0.98 2.539218442e+02 3.859015915e+02 4.428288900e+02 1.00 2.296570870e+02 3.510135366e+02 4.032791377e+02 1.02 2.078719885e+02 3.192463234e+02 3.676002751e+02 1.04 1.883406101e+02 2.902129931e+02 3.353683763e+02 1.06 1.707327799e+02 2.638634281e+02 3.061977292e+02 1.08 1.548318365e+02 2.400645104e+02 2.797574280e+02 1.10 1.403945423e+02 2.186083405e+02 2.556201286e+02 1.12 1.273389974e+02 1.992963762e+02 2.338066963e+02 1.14 1.156346352e+02 1.818069283e+02 2.139724443e+02 1.16 1.051312806e+02 1.659959146e+02 1.958993866e+02 1.18 9.570390695e+01 1.516478890e+02 1.794629989e+02 1.20 8.720508255e+01 1.386550879e+02 1.643850670e+02 1.22 7.952432869e+01 1.268671068e+02 1.505388603e+02 1.24 7.253718206e+01 1.161147395e+02 1.377917341e+02 1.26 6.620185433e+01 1.063226289e+02 1.261111299e+02 1.28 6.046401462e+01 9.743186667e+01 1.155142707e+02 1.30 5.526844264e+01 8.933745966e+01 1.058878956e+02 1.32 5.058950496e+01 8.195095221e+01 9.713599640e+01 1.34 4.625768179e+01 7.525477162e+01 8.916324507e+01 1.36 4.227405576e+01 6.919675521e+01 8.189061596e+01 1.38 3.861711178e+01 6.371048052e+01 7.527491899e+01 1.40 3.524809397e+01 5.871384490e+01 6.924055368e+01 1.42 3.214164551e+01 5.409891413e+01 6.370786935e+01 1.44 2.930778617e+01 4.985222464e+01 5.863274684e+01 1.46 2.673219682e+01 4.594133708e+01 5.399964545e+01 1.48 2.438029725e+01 4.233598294e+01 4.976077171e+01 1.50 2.221952991e+01 3.900491876e+01 4.585815555e+01 1.52 2.025220430e+01 3.593471611e+01 4.226793782e+01 1.54 1.846669574e+01 3.311403605e+01 3.899461794e+01 1.56 1.684222955e+01 3.050973562e+01 3.601971587e+01 1.58 1.535192942e+01 2.809391954e+01 3.331950732e+01 1.60 1.397030379e+01 2.585109837e+01 3.085092868e+01 1.62 1.270100157e+01 2.378161929e+01 2.859752838e+01 1.64 1.151309211e+01 2.183036795e+01 2.645549776e+01 1.66 1.041055810e+01 1.997807688e+01 2.444497364e+01 1.68 9.389556813e+00 1.830256493e+01 2.255515272e+01 1.70 8.445563345e+00 1.674740236e+01 2.077686978e+01 1.72 7.438149575e+00 1.530784281e+01 1.909898807e+01 1.74 6.555783018e+00 1.397731187e+01 1.753011021e+01 1.76 5.707562100e+00 1.274556783e+01 1.607878846e+01 1.78 4.904268417e+00 1.159342066e+01 1.473360300e+01 1.80 4.157360512e+00 1.050261781e+01 1.348239200e+01 1.82 3.474978865e+00 9.472109559e+00 1.231692488e+01 1.84 2.852354613e+00 8.514118910e+00 1.123218676e+01 1.86 2.273935083e+00 7.632356223e+00 1.022425063e+01 1.88 1.756353759e+00 6.825385130e+00 9.291337338e+00 1.90 1.296301965e+00 6.095430408e+00 8.447062754e+00 1.92 8.865062117e-01 5.337064232e+00 7.537503877e+00 1.94 4.978943010e-01 4.678818322e+00 6.758733308e+00 1.96 5.615712498e-02 4.051065177e+00 6.006698501e+00 1.98 -3.506343959e-01 3.457128135e+00 5.286036090e+00 2.00 -7.311482998e-01 2.899123712e+00 4.600820445e+00 2.02 -1.090029623e+00 2.377545627e+00 3.953597177e+00 2.04 -1.425708963e+00 1.881663421e+00 3.341933808e+00 2.06 -1.736348185e+00 1.415638526e+00 2.762783373e+00 2.08 -2.018624046e+00 9.534295163e-01 2.217988614e+00 2.10 -2.271289142e+00 5.066297482e-01 1.708131801e+00 2.12 -2.490001053e+00 8.545547517e-02 1.242581766e+00 2.14 -2.675056011e+00 -3.571560427e-01 8.266576742e-01 2.16 -2.828705786e+00 -7.626120562e-01 4.584106981e-01 2.18 -2.954691586e+00 -1.130488787e+00 2.535162652e-02 2.20 -3.057195699e+00 -1.460634968e+00 -3.609197073e-01 2.22 -3.138341517e+00 -1.753340438e+00 -7.040099103e-01 2.24 -3.201866127e+00 -2.009373737e+00 -1.008026441e+00 2.26 -3.253249108e+00 -2.229052881e+00 -1.278346664e+00 2.28 -3.297554946e+00 -2.415435247e+00 -1.521823417e+00 2.30 -3.338353894e+00 -2.574243321e+00 -1.746561739e+00 2.32 -3.376178195e+00 -2.709437886e+00 -1.961110067e+00 2.34 -3.407722617e+00 -2.824080224e+00 -2.175671696e+00 2.36 -3.434046464e+00 -2.921768403e+00 -2.386270519e+00 2.38 -3.454398326e+00 -3.007060277e+00 -2.581363362e+00 2.40 -3.467671753e+00 -3.084996097e+00 -2.760456688e+00 2.42 -3.472579697e+00 -3.155387884e+00 -2.923198987e+00 2.44 -3.467632291e+00 -3.215859450e+00 -3.068505490e+00 2.46 -3.451586273e+00 -3.268472615e+00 -3.195619269e+00 2.48 -3.423644817e+00 -3.312853690e+00 -3.303886557e+00 2.50 -3.384741813e+00 -3.346185548e+00 -3.392894466e+00 2.52 -3.336379972e+00 -3.369730580e+00 -3.462687566e+00 2.54 -3.280165226e+00 -3.384671029e+00 -3.513433584e+00 2.56 -3.217609504e+00 -3.392102911e+00 -3.546333476e+00 2.58 -3.150005597e+00 -3.393226694e+00 -3.563410855e+00 2.60 -3.078548479e+00 -3.389122390e+00 -3.566746871e+00 2.62 -3.004654969e+00 -3.380610498e+00 -3.558127661e+00 2.64 -2.929872498e+00 -3.368300859e+00 -3.539298395e+00 2.66 -2.856013587e+00 -3.352591599e+00 -3.512107157e+00 2.68 -2.784793971e+00 -3.333924973e+00 -3.478591043e+00 2.70 -2.719328258e+00 -3.312898459e+00 -3.440873248e+00 2.72 -2.657358748e+00 -3.289778953e+00 -3.401027902e+00 2.74 -2.594040816e+00 -3.264702225e+00 -3.360463916e+00 2.76 -2.528979526e+00 -3.237750839e+00 -3.322324246e+00 2.78 -2.461881706e+00 -3.209000304e+00 -3.286891582e+00 2.80 -2.393179694e+00 -3.178644126e+00 -3.249391956e+00 2.82 -2.323113507e+00 -3.146730622e+00 -3.209187982e+00 2.84 -2.251869459e+00 -3.112455359e+00 -3.166638132e+00 2.86 -2.179912109e+00 -3.075209114e+00 -3.122174191e+00 2.88 -2.107759717e+00 -3.034409672e+00 -3.076074038e+00 2.90 -2.035892478e+00 -2.989400362e+00 -3.028409469e+00 2.92 -1.964785727e+00 -2.939575529e+00 -2.979258312e+00 2.94 -1.894988140e+00 -2.884374859e+00 -2.928726912e+00 2.96 -1.827068585e+00 -2.823392818e+00 -2.877068798e+00 2.98 -1.761475072e+00 -2.757195231e+00 -2.824650847e+00 3.00 -1.698377312e+00 -2.686889212e+00 -2.771788339e+00 3.02 -1.637640648e+00 -2.613605444e+00 -2.718751476e+00 3.04 -1.579104316e+00 -2.538471837e+00 -2.665731598e+00 3.06 -1.522603295e+00 -2.462584811e+00 -2.612922809e+00 3.08 -1.467970849e+00 -2.386981509e+00 -2.560615282e+00 3.10 -1.415035899e+00 -2.312564474e+00 -2.509132110e+00 3.12 -1.363966217e+00 -2.239271728e+00 -2.458837676e+00 3.14 -1.315168393e+00 -2.167305215e+00 -2.409722343e+00 3.16 -1.268960394e+00 -2.097101349e+00 -2.361237661e+00 3.18 -1.225469545e+00 -2.029016218e+00 -2.312820831e+00 3.20 -1.184432728e+00 -1.963349399e+00 -2.263927391e+00 3.22 -1.145406783e+00 -1.900313584e+00 -2.214036172e+00 3.24 -1.107875813e+00 -1.839952924e+00 -2.162678595e+00 3.26 -1.071311941e+00 -1.780682179e+00 -2.109385359e+00 3.28 -1.035200887e+00 -1.722209216e+00 -2.054029148e+00 3.30 -9.989960371e-01 -1.664644878e+00 -1.997172438e+00 3.32 -9.621302207e-01 -1.608087460e+00 -1.939450322e+00 3.34 -9.261704441e-01 -1.552630667e+00 -1.881330643e+00 3.36 -8.919228754e-01 -1.498373786e+00 -1.823215484e+00 3.38 -8.595084489e-01 -1.445419206e+00 -1.765505266e+00 3.40 -8.291590414e-01 -1.393873559e+00 -1.708609229e+00 3.42 -8.007642992e-01 -1.343831711e+00 -1.652881257e+00 3.44 -7.746647173e-01 -1.295393831e+00 -1.598430544e+00 3.46 -7.500404606e-01 -1.248692878e+00 -1.545382653e+00 3.48 -7.263839591e-01 -1.203882026e+00 -1.493876924e+00 3.50 -7.036967723e-01 -1.161022477e+00 -1.444058083e+00 3.52 -6.819790405e-01 -1.120093655e+00 -1.396088489e+00 3.54 -6.612495338e-01 -1.081097191e+00 -1.350214522e+00 3.56 -6.415542733e-01 -1.044058550e+00 -1.306087290e+00 3.58 -6.230077823e-01 -1.009009131e+00 -1.263956307e+00 3.60 -6.053606877e-01 -9.759869786e-01 -1.222997116e+00 3.62 -5.884022960e-01 -9.450226888e-01 -1.183155721e+00 3.64 -5.720856468e-01 -9.159798453e-01 -1.144425801e+00 3.66 -5.563496374e-01 -8.886037973e-01 -1.106741314e+00 3.68 -5.411211797e-01 -8.626300180e-01 -1.069988871e+00 3.70 -5.263103467e-01 -8.377744313e-01 -1.034054008e+00 3.72 -5.118268899e-01 -8.137027980e-01 -9.987511029e-01 3.74 -4.976146312e-01 -7.900791121e-01 -9.639087837e-01 3.76 -4.836212318e-01 -7.665775845e-01 -9.294301253e-01 3.78 -4.697857972e-01 -7.428633311e-01 -8.952542829e-01 3.80 -4.560425828e-01 -7.185795462e-01 -8.613391706e-01 3.82 -4.423762530e-01 -6.942614407e-01 -8.276621268e-01 3.84 -4.288342080e-01 -6.704502467e-01 -7.942167221e-01 3.86 -4.154661660e-01 -6.471257539e-01 -7.610186049e-01 3.88 -4.023202020e-01 -6.242711061e-01 -7.281073259e-01 3.90 -3.894393735e-01 -6.018717514e-01 -6.955406174e-01 3.92 -3.768669738e-01 -5.799168879e-01 -6.634024246e-01 3.94 -3.646448965e-01 -5.584045633e-01 -6.317941340e-01 3.96 -3.528093142e-01 -5.373559359e-01 -6.008348588e-01 3.98 -3.413934228e-01 -5.168061708e-01 -5.706609719e-01 4.00 -3.304331337e-01 -4.968174220e-01 -5.414666565e-01 4.02 -3.199670507e-01 -4.774727393e-01 -5.134957602e-01 4.04 -3.100263113e-01 -4.588454572e-01 -4.870008859e-01 4.06 -3.006120559e-01 -4.409831942e-01 -4.621333238e-01 4.08 -2.916561819e-01 -4.239224774e-01 -4.390040488e-01 4.10 -2.830568956e-01 -4.076918909e-01 -4.176984803e-01 4.12 -2.747101509e-01 -3.923130582e-01 -3.982792269e-01 4.14 -2.665102758e-01 -3.778013541e-01 -3.807891373e-01 4.16 -2.583516604e-01 -3.641663620e-01 -3.652532603e-01 4.18 -2.501641807e-01 -3.514106831e-01 -3.516737997e-01 4.20 -2.419155828e-01 -3.395250077e-01 -3.399448189e-01 4.22 -2.335752612e-01 -3.284941754e-01 -3.298989776e-01 4.24 -2.251120386e-01 -3.182997310e-01 -3.213608985e-01 4.26 -2.164940362e-01 -3.089203795e-01 -3.141467138e-01 4.28 -2.076862652e-01 -3.003305210e-01 -3.080631396e-01 4.30 -1.986506021e-01 -2.924977371e-01 -3.029047946e-01 4.32 -1.893614043e-01 -2.853661707e-01 -2.984607731e-01 4.34 -1.798542845e-01 -2.788539292e-01 -2.945152523e-01 4.36 -1.701819961e-01 -2.728799581e-01 -2.908547657e-01 4.38 -1.604006886e-01 -2.673684995e-01 -2.872711258e-01 4.40 -1.505646023e-01 -2.622428068e-01 -2.837320898e-01 4.42 -1.407196280e-01 -2.574294637e-01 -2.806539121e-01 4.44 -1.309104683e-01 -2.528733020e-01 -2.779826739e-01 4.46 -1.211770960e-01 -2.485230721e-01 -2.756329395e-01 4.48 -1.115493071e-01 -2.443265604e-01 -2.735182706e-01 4.50 -1.020559670e-01 -2.402308849e-01 -2.715512244e-01 4.52 -9.272648267e-02 -2.361822530e-01 -2.696433752e-01 4.54 -8.359032454e-02 -2.321266474e-01 -2.677060345e-01 4.56 -7.468564339e-02 -2.280173748e-01 -2.656619670e-01 4.58 -6.608557726e-02 -2.238189278e-01 -2.634436650e-01 4.60 -5.788029951e-02 -2.195257890e-01 -2.609829919e-01 4.62 -5.016045442e-02 -2.151413582e-01 -2.582115001e-01 4.64 -4.301559340e-02 -2.106686271e-01 -2.550599551e-01 4.66 -3.653685338e-02 -2.061109894e-01 -2.514753271e-01 4.68 -3.082877606e-02 -2.014684957e-01 -2.474793453e-01 4.70 -2.599763763e-02 -1.967402758e-01 -2.431172624e-01 4.72 -2.214560313e-02 -1.919256518e-01 -2.384343011e-01 4.74 -1.937197343e-02 -1.870242289e-01 -2.334761113e-01 4.76 -1.778212532e-02 -1.820360664e-01 -2.282885647e-01 4.78 -1.748177565e-02 -1.769615842e-01 -2.229179550e-01 4.80 -1.857564709e-02 -1.718012321e-01 -2.174108350e-01 4.82 -2.111014002e-02 -1.665547547e-01 -2.118125135e-01 4.84 -2.493070175e-02 -1.612152985e-01 -2.061590953e-01 4.86 -2.978130518e-02 -1.557690375e-01 -2.004832217e-01 4.88 -3.540701600e-02 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