# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au # implementation = 2004--Zhou-X-W--Cu-Ag-Au--LAMMPS--ipr1 # composition = Cu # 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 2022-05-24 r A1--Cu--fcc A15--beta-W A2--W--bcc A3'--alpha-La--d A3--Mg--hcp A4--C--dc A5--beta-Sn A6--In--bct A7--alpha-As Ah--alpha-Po--sc 0.50 nan nan nan nan nan nan nan nan nan nan 0.52 nan nan nan nan nan nan nan nan nan nan 0.54 nan nan nan nan nan nan nan nan nan nan 0.56 nan nan nan nan nan nan nan nan nan nan 0.58 nan nan nan nan nan nan nan nan nan nan 0.60 nan nan nan nan nan nan nan nan nan nan 0.62 nan nan nan nan nan nan nan nan nan nan 0.64 nan nan nan nan nan nan nan nan nan nan 0.66 nan nan nan nan nan nan nan nan nan nan 0.68 nan nan nan nan nan nan nan nan nan nan 0.70 nan nan nan nan nan nan nan nan nan nan 0.72 nan nan nan nan nan nan nan nan nan nan 0.74 nan nan nan nan nan nan nan nan nan nan 0.76 nan nan nan nan nan nan nan nan nan nan 0.78 nan nan nan nan nan nan nan nan nan nan 0.80 nan nan nan nan nan nan nan nan 3.802066185e+02 nan 0.82 nan nan nan nan nan nan nan nan 3.431355874e+02 nan 0.84 nan nan nan nan nan nan nan nan 3.099490589e+02 nan 0.86 nan nan nan nan nan 2.429288906e+02 nan nan 2.802026742e+02 nan 0.88 nan nan nan nan nan 2.202272282e+02 nan nan 2.535083459e+02 nan 0.90 nan nan nan nan nan 1.998068457e+02 nan nan 2.295223867e+02 nan 0.92 nan nan nan nan nan 1.814083168e+02 nan nan 2.079402352e+02 nan 0.94 nan nan nan nan nan 1.648098610e+02 nan nan 1.884945542e+02 nan 0.96 nan nan nan nan nan 1.498279936e+02 nan nan 1.709531363e+02 nan 0.98 nan nan nan 3.820563106e+02 3.820946550e+02 1.363060494e+02 nan nan 1.551122993e+02 2.368301714e+02 1.00 nan 2.099659427e+02 nan 3.505837760e+02 3.506065910e+02 1.240986620e+02 2.178841729e+02 nan 1.407896358e+02 2.161372793e+02 1.02 nan 1.912740295e+02 nan 3.218774621e+02 3.218792345e+02 1.130609331e+02 1.987768296e+02 nan 1.278213647e+02 1.973311870e+02 1.04 nan 1.742765173e+02 nan 2.956678890e+02 2.956510209e+02 1.030516564e+02 1.814004215e+02 nan 1.160647288e+02 1.802237038e+02 1.06 nan 1.588065634e+02 nan 2.717094880e+02 2.716817274e+02 9.394766602e+01 1.655858144e+02 nan 1.053992139e+02 1.646468398e+02 1.08 nan 1.447182961e+02 nan 2.497812345e+02 2.497530477e+02 8.565070923e+01 1.511831681e+02 nan 9.572075275e+01 1.504465439e+02 1.10 nan 1.318799353e+02 2.012970736e+02 2.296888593e+02 2.296709653e+02 7.808276153e+01 1.380543383e+02 2.096929897e+02 8.693466805e+01 1.374857662e+02 1.12 2.112411746e+02 1.201724280e+02 1.847302502e+02 2.112624171e+02 2.112623556e+02 7.117907334e+01 1.260720374e+02 1.925694391e+02 7.895244492e+01 1.256490292e+02 1.14 1.943105065e+02 1.094882044e+02 1.695400924e+02 1.943505165e+02 1.943698560e+02 6.488450593e+01 1.151241759e+02 1.768711687e+02 7.169258148e+01 1.148404887e+02 1.16 1.787646437e+02 9.973099915e+01 1.556137305e+02 1.788151099e+02 1.788496707e+02 5.914993276e+01 1.051163624e+02 1.624722801e+02 6.508277775e+01 1.049748911e+02 1.18 1.644803607e+02 9.081796700e+01 1.428420976e+02 1.645319549e+02 1.645743263e+02 5.392869926e+01 9.596825853e+01 1.492578057e+02 5.906057531e+01 9.596907804e+01 1.20 1.513494076e+02 8.267751340e+01 1.311209564e+02 1.513919340e+02 1.514339961e+02 4.917417604e+01 8.760665173e+01 1.371241071e+02 5.357136401e+01 8.773897255e+01 1.22 1.392756039e+02 7.524327366e+01 1.203560438e+02 1.392998844e+02 1.393346046e+02 4.484004369e+01 7.996179101e+01 1.259774884e+02 4.856676813e+01 8.020353061e+01 1.24 1.281683474e+02 6.845140678e+01 1.104651057e+02 1.281705595e+02 1.281932136e+02 4.088268300e+01 7.296785916e+01 1.157313502e+02 4.400374345e+01 7.329110397e+01 1.26 1.179416016e+02 6.224272461e+01 1.013761230e+02 1.179256674e+02 1.179343704e+02 3.726404084e+01 6.656410110e+01 1.063065498e+02 3.984319303e+01 6.694221738e+01 1.28 1.085174318e+02 5.656448086e+01 9.302280700e+01 1.084922812e+02 1.084877124e+02 3.395210778e+01 6.069497432e+01 9.763181698e+01 3.604866086e+01 6.110811840e+01 1.30 9.982790225e+01 5.136883382e+01 8.534088699e+01 9.980234029e+01 9.978694727e+01 3.091898789e+01 5.531013602e+01 8.964326976e+01 3.258615326e+01 5.574796396e+01 1.32 9.181308525e+01 4.661070282e+01 7.826852577e+01 9.179256752e+01 9.176970115e+01 2.813897928e+01 5.036535715e+01 8.228304689e+01 2.942453232e+01 5.082578741e+01 1.34 8.441834419e+01 4.224796627e+01 7.175004962e+01 8.440485952e+01 8.437829270e+01 2.558847184e+01 4.582309531e+01 7.549854803e+01 2.653603548e+01 4.630813036e+01 1.36 7.759323008e+01 3.824368391e+01 6.573829564e+01 7.758684426e+01 7.756071791e+01 2.324661948e+01 4.165158474e+01 6.924232958e+01 2.389635166e+01 4.216298785e+01 1.38 7.129158704e+01 3.456752646e+01 6.019362661e+01 7.129171313e+01 7.127042268e+01 2.109544602e+01 3.782242449e+01 6.347197014e+01 2.148381315e+01 3.836003244e+01 1.40 6.547137292e+01 3.119497646e+01 5.508131125e+01 6.547705770e+01 6.546461560e+01 1.911949251e+01 3.430871091e+01 5.814898894e+01 1.927853636e+01 3.487072598e+01 1.42 6.009431395e+01 2.810462750e+01 5.036983736e+01 6.010411335e+01 6.010309731e+01 1.730543335e+01 3.108453142e+01 5.323775455e+01 1.726234711e+01 3.166843580e+01 1.44 5.512576285e+01 2.527588535e+01 4.602982824e+01 5.513777599e+01 5.514844612e+01 1.564155330e+01 2.812544693e+01 4.870529718e+01 1.541914218e+01 2.872873082e+01 1.46 5.053404449e+01 2.268791312e+01 4.203271655e+01 5.054633052e+01 5.056657441e+01 1.411665097e+01 2.540896442e+01 4.452136030e+01 1.373476643e+01 2.602947382e+01 1.48 4.628988070e+01 2.032017721e+01 3.835018480e+01 4.630125242e+01 4.632747901e+01 1.271941307e+01 2.291480982e+01 4.065836734e+01 1.219648121e+01 2.355047476e+01 1.50 4.236584120e+01 1.815361288e+01 3.495463872e+01 4.237649670e+01 4.240487926e+01 1.143843880e+01 2.062484697e+01 3.709142602e+01 1.079247863e+01 2.127293069e+01 1.52 3.873666850e+01 1.617133189e+01 3.182045767e+01 3.874793331e+01 3.877526939e+01 1.026277340e+01 1.852256197e+01 3.379821634e+01 9.511535210e+00 1.917942945e+01 1.54 3.537991527e+01 1.435842284e+01 2.892498429e+01 3.539312305e+01 3.541709294e+01 9.182278569e+00 1.659263183e+01 3.075906734e+01 8.343081190e+00 1.725426928e+01 1.56 3.227612006e+01 1.270124574e+01 2.624851689e+01 3.229151044e+01 3.231058704e+01 8.187601648e+00 1.482084864e+01 2.795635630e+01 7.277469711e+00 1.548345049e+01 1.58 2.940796022e+01 1.118675927e+01 2.377354322e+01 2.942434197e+01 2.943762880e+01 7.269900097e+00 1.319417659e+01 2.537365912e+01 6.306034316e+00 1.385423110e+01 1.60 2.675959641e+01 9.802239067e+00 2.148452152e+01 2.677474581e+01 2.678183407e+01 6.421155515e+00 1.170097224e+01 2.299488311e+01 5.421013090e+00 1.235496950e+01 1.62 2.431609896e+01 8.535349849e+00 1.936814661e+01 2.432741290e+01 2.432826109e+01 5.634766355e+00 1.033088271e+01 2.080386900e+01 4.615232251e+00 1.097527473e+01 1.64 2.206279363e+01 7.374463424e+00 1.741336051e+01 2.206790442e+01 2.206278330e+01 4.905869075e+00 9.074633944e+00 1.878441350e+01 3.881754703e+00 9.706154774e+00 1.66 1.998466883e+01 6.308987639e+00 1.561082636e+01 1.998201911e+01 1.997155217e+01 4.231081747e+00 7.923714442e+00 1.692064509e+01 3.213749921e+00 8.539820148e+00 1.68 1.806625335e+01 5.329823220e+00 1.395203306e+01 1.805563501e+01 1.804088954e+01 3.607927350e+00 6.870179101e+00 1.519785782e+01 2.604677699e+00 7.469363559e+00 1.70 1.629210207e+01 4.429636318e+00 1.242825380e+01 1.627491758e+01 1.625741526e+01 3.034201291e+00 5.906504010e+00 1.360314017e+01 2.048621129e+00 6.488374823e+00 1.72 1.464812542e+01 3.602830758e+00 1.103004692e+01 1.462711497e+01 1.460867970e+01 2.507577847e+00 5.025503592e+00 1.212581129e+01 1.540589400e+00 5.590785503e+00 1.74 1.312252371e+01 2.845090342e+00 9.747117893e+00 1.310102220e+01 1.308352076e+01 2.025322920e+00 4.220251376e+00 1.075717555e+01 1.076539879e+00 4.770688966e+00 1.76 1.170602086e+01 2.152843241e+00 8.568781223e+00 1.168712765e+01 1.167224632e+01 1.584225826e+00 3.484141330e+00 9.490000257e+00 6.532046714e-01 4.022249407e+00 1.78 1.039126760e+01 1.522831502e+00 7.484768050e+00 1.037730051e+01 1.036643391e+01 1.180719840e+00 2.811051854e+00 8.317973272e+00 2.677834313e-01 3.339575479e+00 1.80 9.172054214e+00 9.518156768e-01 6.485875176e+00 9.164394998e+00 9.158610320e+00 8.111872580e-01 2.195554155e+00 7.235394480e+00 -8.235381619e-02 2.716703655e+00 1.82 8.042791911e+00 4.364644842e-01 5.564347309e+00 8.041990507e+00 8.041983380e+00 4.722870663e-01 1.632991341e+00 6.237042598e+00 -3.998793129e-01 2.147736381e+00 1.84 6.998354823e+00 -2.673956429e-02 4.713856933e+00 7.004288995e+00 7.010289823e+00 1.611464080e-01 1.119403012e+00 5.318111260e+00 -6.875738856e-01 1.627200191e+00 1.86 6.034067660e+00 -4.415171613e-01 3.929181050e+00 6.046037221e+00 6.057697455e+00 -1.246433411e-01 6.513574751e-01 4.474088299e+00 -9.482412498e-01 1.150460689e+00 1.88 5.145746862e+00 -8.118007870e-01 3.205815332e+00 5.162516062e+00 5.178850789e+00 -3.871448774e-01 2.257555789e-01 3.700612510e+00 -1.184556610e+00 7.139447732e-01 1.90 4.329528298e+00 -1.141707438e+00 2.539618538e+00 4.349402711e+00 4.368856354e+00 -6.282227274e-01 -1.603334462e-01 2.993269795e+00 -1.398941429e+00 3.149882764e-01 1.92 3.581639124e+00 -1.435464607e+00 1.926676023e+00 3.602637873e+00 3.623286887e+00 -8.496032472e-01 -5.097537123e-01 2.347554592e+00 -1.593489085e+00 -4.854630558e-02 1.94 2.898055296e+00 -1.697254163e+00 1.363274209e+00 2.918167954e+00 2.938012997e+00 -1.052876591e+00 -8.252936523e-01 1.758838274e+00 -1.769978078e+00 -3.787592535e-01 1.96 2.274291914e+00 -1.931030095e+00 8.459747642e-01 2.291757139e+00 2.309027487e+00 -1.239425605e+00 -1.109659003e+00 1.222413916e+00 -1.929912972e+00 -6.780574340e-01 1.98 1.705402927e+00 -2.140318323e+00 3.717024688e-01 1.718930842e+00 1.732321084e+00 -1.410366189e+00 -1.365438817e+00 7.335765141e-01 -2.074594552e+00 -9.492609627e-01 2.00 1.186168595e+00 -2.328084672e+00 -6.225471541e-02 1.195057586e+00 1.203851129e+00 -1.566832607e+00 -1.595111665e+00 2.878051137e-01 -2.205198135e+00 -1.195474757e+00 2.02 7.115059175e-01 -2.496691354e+00 -4.582841564e-01 7.156310423e-01 7.196906929e-01 -1.710290000e+00 -1.801074139e+00 -1.190597128e-01 -2.322812398e+00 -1.419756038e+00 2.04 2.768257028e-01 -2.647942297e+00 -8.185599945e-01 2.765202778e-01 2.761702396e-01 -1.840185296e+00 -1.985681151e+00 -4.906407093e-01 -2.428449302e+00 -1.624790727e+00 2.06 -1.216959916e-01 -2.783192295e+00 -1.145127912e+00 -1.258155691e-01 -1.299654280e-01 -1.956049044e+00 -2.151227963e+00 -8.299626275e-01 -2.523904310e+00 -1.812673841e+00 2.08 -4.871225225e-01 -2.903488236e+00 -1.439983152e+00 -4.943273404e-01 -5.015527250e-01 -2.057756566e+00 -2.299901079e+00 -1.139553682e+00 -2.609753367e+00 -1.984914415e+00 2.10 -8.218968935e-01 -3.009691752e+00 -1.705100086e+00 -8.314705005e-01 -8.410580892e-01 -2.145479108e+00 -2.433711105e+00 -1.421568620e+00 -2.685390596e+00 -2.142570031e+00 2.12 -1.128061814e+00 -3.102578935e+00 -1.942438188e+00 -1.139364970e+00 -1.150677650e+00 -2.219619962e+00 -2.554445875e+00 -1.677978470e+00 -2.750479292e+00 -2.286441353e+00 2.14 -1.407428754e+00 -3.182902859e+00 -2.153911187e+00 -1.419910363e+00 -1.432398478e+00 -2.280728888e+00 -2.663614792e+00 -1.910661539e+00 -2.804886224e+00 -2.417218442e+00 2.16 -1.661747800e+00 -3.251435071e+00 -2.341405331e+00 -1.674919055e+00 -1.688094728e+00 -2.329520186e+00 -2.762419420e+00 -2.121457612e+00 -2.848641329e+00 -2.535597070e+00 2.18 -1.892771940e+00 -3.308979833e+00 -2.506762184e+00 -1.906161455e+00 -1.919554008e+00 -2.366814040e+00 -2.851737256e+00 -2.312158062e+00 -2.881897604e+00 -2.642318037e+00 2.20 -2.102289176e+00 -3.356373891e+00 -2.651796088e+00 -2.115396314e+00 -2.128505549e+00 -2.393401871e+00 -2.932149685e+00 -2.484438899e+00 -2.904946085e+00 -2.738171918e+00 2.22 -2.292094930e+00 -3.394474442e+00 -2.778307920e+00 -2.304362072e+00 -2.316630667e+00 -2.410043080e+00 -3.004018368e+00 -2.639813448e+00 -2.918289031e+00 -2.823969327e+00 2.24 -2.463916602e+00 -3.425003981e+00 -2.888089727e+00 -2.474731493e+00 -2.485547439e+00 -2.417493698e+00 -3.067750826e+00 -2.779594346e+00 -2.922515745e+00 -2.900567998e+00 2.26 -2.619338378e+00 -3.448534325e+00 -2.982939280e+00 -2.628077489e+00 -2.636817336e+00 -2.416553779e+00 -3.124487790e+00 -2.904887966e+00 -2.918277648e+00 -2.969603265e+00 2.28 -2.759694372e+00 -3.464517861e+00 -3.064642444e+00 -2.765796890e+00 -2.771899923e+00 -2.408105443e+00 -3.173634467e+00 -3.016596779e+00 -2.906287424e+00 -3.030966978e+00 2.30 -2.886072801e+00 -3.472620811e+00 -3.134987430e+00 -2.889130716e+00 -2.892188994e+00 -2.393150906e+00 -3.214612330e+00 -3.115471529e+00 -2.887315238e+00 -3.084111250e+00 2.32 -2.999299659e+00 -3.472709484e+00 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