# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2015--Asadi-E-Asle-Zaeem-M-Nouranian-S-Baskes-M-I--Cu # implementation = 2015--Asadi-E--Cu--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 1.995770203e+02 nan nan nan nan 0.68 nan nan nan nan nan 1.890895296e+02 nan nan nan nan 0.70 nan nan nan nan nan 1.790890505e+02 nan nan 1.803171018e+02 nan 0.72 nan nan nan nan nan 1.695529456e+02 nan nan 1.689690546e+02 nan 0.74 nan nan nan nan nan 1.604597636e+02 nan nan 1.582817101e+02 nan 0.76 nan nan nan nan nan 1.517891914e+02 nan nan 1.482178092e+02 nan 0.78 nan 2.810396931e+02 nan nan nan 1.435220036e+02 1.899675787e+02 nan 1.387421792e+02 1.546882071e+02 0.80 nan 2.633257528e+02 nan nan nan 1.356400127e+02 1.784033003e+02 nan 1.298216168e+02 1.457833100e+02 0.82 nan 2.466522494e+02 nan nan nan 1.281260176e+02 1.674891666e+02 nan 1.214247767e+02 1.373404107e+02 0.84 nan 2.309597328e+02 2.505807844e+02 nan nan 1.209637511e+02 1.571897325e+02 nan 1.135220675e+02 1.293368924e+02 0.86 2.744075607e+02 2.161921689e+02 2.360195531e+02 2.757980574e+02 2.771885540e+02 1.141378278e+02 1.474714823e+02 2.619295888e+02 1.060855525e+02 1.217512052e+02 0.88 2.591197426e+02 2.022967358e+02 2.222364330e+02 2.604131731e+02 2.617066037e+02 1.076336906e+02 1.383027223e+02 2.469536318e+02 9.908885642e+01 1.145628172e+02 0.90 2.446142570e+02 1.892236330e+02 2.091917684e+02 2.458173116e+02 2.470203661e+02 1.014375583e+02 1.296534802e+02 2.327646139e+02 9.250707812e+01 1.077521673e+02 0.92 2.308530432e+02 1.769259018e+02 1.968478658e+02 2.319719554e+02 2.330908676e+02 9.553637312e+01 1.214954100e+02 2.193230983e+02 8.631670713e+01 1.013006209e+02 0.94 2.177998307e+02 1.653592587e+02 1.851688985e+02 2.188404087e+02 2.198809866e+02 8.991774927e+01 1.138017021e+02 2.065915715e+02 8.049554572e+01 9.519042712e+01 0.96 2.054200574e+02 1.544819375e+02 1.741208163e+02 2.063877125e+02 2.073553675e+02 8.456992297e+01 1.065469989e+02 1.945343504e+02 7.502263518e+01 8.940467765e+01 0.98 1.936807911e+02 1.442545430e+02 1.636712588e+02 1.945805647e+02 1.954803383e+02 7.948170422e+01 9.970731471e+01 1.831174946e+02 6.987818627e+01 8.392726824e+01 1.00 1.825506542e+02 1.346399123e+02 1.537894733e+02 1.833872431e+02 1.842238319e+02 7.464243066e+01 9.325996069e+01 1.723087224e+02 6.504351374e+01 7.874286132e+01 1.02 1.719997524e+02 1.256029855e+02 1.444462368e+02 1.727775318e+02 1.735553111e+02 7.004192411e+01 8.718347369e+01 1.620773307e+02 6.050097446e+01 7.383685057e+01 1.04 1.619996063e+02 1.171106842e+02 1.356137813e+02 1.627226517e+02 1.634456972e+02 6.567044981e+01 8.145754923e+01 1.523941191e+02 5.623390920e+01 6.919532704e+01 1.06 1.525230858e+02 1.091317973e+02 1.272657232e+02 1.531951937e+02 1.538673015e+02 6.151867895e+01 7.606297826e+01 1.432313176e+02 5.222658764e+01 6.480504680e+01 1.08 1.435443483e+02 1.016368739e+02 1.193769951e+02 1.441690546e+02 1.447937609e+02 5.757765426e+01 7.098158744e+01 1.345625178e+02 4.846415650e+01 6.065340006e+01 1.10 1.350387789e+02 9.459812218e+01 1.119237826e+02 1.356193769e+02 1.361999750e+02 5.383875916e+01 6.619618281e+01 1.263626068e+02 4.493259073e+01 5.672838175e+01 1.12 1.269829334e+02 8.798931517e+01 1.048834621e+02 1.275224905e+02 1.280620476e+02 5.029369022e+01 6.169049659e+01 1.186077055e+02 4.161864733e+01 5.301856334e+01 1.14 1.193544847e+02 8.178570146e+01 9.823454318e+01 1.198558573e+02 1.203572298e+02 4.693443303e+01 5.744913697e+01 1.112751085e+02 3.850982185e+01 4.951306600e+01 1.16 1.121321704e+02 7.596392144e+01 9.195661314e+01 1.125980185e+02 1.130638666e+02 4.375324131e+01 5.345754067e+01 1.043432280e+02 3.559430738e+01 4.620153502e+01 1.18 1.052957437e+02 7.050192860e+01 8.603028402e+01 1.057285444e+02 1.061613450e+02 4.074261916e+01 4.970192818e+01 9.779153949e+01 3.286095580e+01 4.307411529e+01 1.20 9.882592635e+01 6.537891528e+01 8.043714251e+01 9.922798600e+01 9.963004565e+01 3.789530616e+01 4.616926142e+01 9.160053068e+01 3.029924123e+01 4.012142800e+01 1.22 9.270436330e+01 6.057524293e+01 7.515970217e+01 9.307782945e+01 9.345129561e+01 3.520426514e+01 4.284720382e+01 8.575165264e+01 2.789922556e+01 3.733454836e+01 1.24 8.691357999e+01 5.607237632e+01 7.018135791e+01 8.726045206e+01 8.760732414e+01 3.266267230e+01 3.972408253e+01 8.022727322e+01 2.565152590e+01 3.470498433e+01 1.26 8.143694126e+01 5.185282163e+01 6.548634273e+01 8.175908068e+01 8.208122011e+01 3.026390943e+01 3.678885277e+01 7.501063279e+01 2.354728385e+01 3.222465636e+01 1.28 7.625861223e+01 4.790006811e+01 6.105968647e+01 7.655775186e+01 7.685689149e+01 2.800155786e+01 3.403106411e+01 7.008580206e+01 2.157813649e+01 2.988587801e+01 1.30 7.136352090e+01 4.419853310e+01 5.688717662e+01 7.164127382e+01 7.191902674e+01 2.586939389e+01 3.144082856e+01 6.543764192e+01 1.973618900e+01 2.768133745e+01 1.32 6.673732257e+01 4.073351022e+01 5.295532105e+01 6.699519028e+01 6.725305799e+01 2.386138550e+01 2.900879050e+01 6.105176524e+01 1.801398881e+01 2.560407994e+01 1.34 6.236636576e+01 3.749112048e+01 4.925131242e+01 6.260574580e+01 6.284512585e+01 2.197168982e+01 2.672609816e+01 5.691450042e+01 1.640450117e+01 2.364749089e+01 1.36 5.823765979e+01 3.445826619e+01 4.576299443e+01 5.845985288e+01 5.868204597e+01 2.019465142e+01 2.458437671e+01 5.301285676e+01 1.490108613e+01 2.180527991e+01 1.38 5.433884376e+01 3.162258758e+01 4.247882966e+01 5.454506042e+01 5.475127707e+01 1.852480099e+01 2.257570273e+01 4.933449143e+01 1.349747668e+01 2.007146546e+01 1.40 5.065815707e+01 2.897242168e+01 3.938786900e+01 5.084952378e+01 5.104089049e+01 1.695685424e+01 2.069258022e+01 4.586767806e+01 1.218775828e+01 1.844036026e+01 1.42 4.718441111e+01 2.649676375e+01 3.647972245e+01 4.736197614e+01 4.753954116e+01 1.548571101e+01 1.892791771e+01 4.260127679e+01 1.096634935e+01 1.690655738e+01 1.44 4.390696246e+01 2.418523067e+01 3.374453153e+01 4.407170116e+01 4.423643986e+01 1.410645419e+01 1.727500675e+01 3.952470582e+01 9.827982927e+00 1.546491692e+01 1.46 4.081568714e+01 2.202802656e+01 3.117294284e+01 4.096850702e+01 4.112132689e+01 1.281434860e+01 1.572750153e+01 3.662791422e+01 8.767689348e+00 1.411055336e+01 1.48 3.790095615e+01 2.001591017e+01 2.875608302e+01 3.804270149e+01 3.818444683e+01 1.160483957e+01 1.427939953e+01 3.390135614e+01 7.780779828e+00 1.283882346e+01 1.50 3.515361210e+01 1.814016423e+01 2.648553491e+01 3.528506834e+01 3.541652458e+01 1.047355128e+01 1.292502329e+01 3.133596620e+01 6.862830984e+00 1.164531475e+01 1.52 3.256494692e+01 1.639256639e+01 2.435331481e+01 3.268684469e+01 3.280874247e+01 9.416284679e+00 1.165900311e+01 2.892313607e+01 6.009670198e+00 1.052583450e+01 1.54 3.012668062e+01 1.476536186e+01 2.235185092e+01 3.023969952e+01 3.035271842e+01 8.429015135e+00 1.047626069e+01 2.665469215e+01 5.217361783e+00 9.476399283e+00 1.56 2.783094095e+01 1.325123751e+01 2.047396280e+01 2.793571307e+01 2.804048519e+01 7.507889667e+00 9.371993651e+00 2.452287439e+01 4.482193911e+00 8.493224914e+00 1.58 2.567024413e+01 1.184329743e+01 1.871284183e+01 2.576735732e+01 2.586447051e+01 6.649223845e+00 8.341660852e+00 2.252031602e+01 3.800666257e+00 7.572716968e+00 1.60 2.363747633e+01 1.053503986e+01 1.706203263e+01 2.372747727e+01 2.381747821e+01 5.849498337e+00 7.380968522e+00 2.064002433e+01 3.169478316e+00 6.711461653e+00 1.62 2.172587613e+01 9.320335318e+00 1.551541539e+01 2.180927316e+01 2.189267020e+01 5.105355158e+00 6.485857119e+00 1.887536237e+01 2.585518369e+00 5.906217155e+00 1.64 1.992901769e+01 8.193406026e+00 1.406718903e+01 2.000628348e+01 2.008354927e+01 4.413593621e+00 5.652488872e+00 1.722003145e+01 2.045853037e+00 5.153905364e+00 1.66 1.824079478e+01 7.148806408e+00 1.271185526e+01 1.831236878e+01 1.838394279e+01 3.771166054e+00 4.877236006e+00 1.566805458e+01 1.547717426e+00 4.451603994e+00 1.68 1.665540551e+01 6.181404670e+00 1.144420332e+01 1.672169626e+01 1.678798702e+01 3.175173296e+00 4.156669575e+00 1.421376065e+01 1.088505791e+00 3.796539071e+00 1.70 1.516733774e+01 5.286365402e+00 1.025929557e+01 1.522872503e+01 1.529011231e+01 2.622860026e+00 3.487548891e+00 1.285176938e+01 6.657627258e-01 3.186077766e+00 1.72 1.377135528e+01 4.459133122e+00 9.152453694e+00 1.382819209e+01 1.388502890e+01 2.111609955e+00 2.866811517e+00 1.157697698e+01 2.771748217e-01 2.617721572e+00 1.74 1.246248457e+01 3.695416727e+00 8.119245666e+00 1.251509899e+01 1.256771342e+01 1.638940913e+00 2.291563778e+00 1.038454250e+01 -7.943721091e-02 2.089099787e+00 1.76 1.123600212e+01 2.991174792e+00 7.155473281e+00 1.128469907e+01 1.133339603e+01 1.202499885e+00 1.759071786e+00 9.269874913e+00 -4.061259918e-01 1.597963322e+00 1.78 1.008742247e+01 2.342601671e+00 6.257160346e+00 1.013248529e+01 1.017754812e+01 8.000579980e-01 1.266752920e+00 8.228620679e+00 -7.048245198e-01 1.142178774e+00 1.80 9.012486733e+00 1.746114366e+00 5.420541441e+00 9.054178699e+00 9.095870664e+00 4.295055234e-01 8.121677790e-01 7.256652031e+00 -9.773528275e-01 7.197228036e-01 1.82 8.007151631e+00 1.198340099e+00 4.642051228e+00 8.045717348e+00 8.084283066e+00 8.884688804e-02 3.930125364e-01 6.350055769e+00 -1.225424283e+00 3.286767573e-01 1.84 7.067579117e+00 6.961045774e-01 3.918314294e+00 7.103245829e+00 7.138912541e+00 -2.238042520e-01 7.111711355e-03 5.505122601e+00 -1.450651537e+00 -3.277844584e-02 1.86 6.190126420e+00 2.364208886e-01 3.246135487e+00 6.223105216e+00 6.256084012e+00 -5.102298769e-01 -3.475886870e-01 4.718337007e+00 -1.654552159e+00 -3.663671940e-01 1.88 5.371336585e+00 -1.835209920e-01 2.622490741e+00 5.401823532e+00 5.432310478e+00 -7.721123732e-01 -6.730276506e-01 3.986367591e+00 -1.838553951e+00 -6.737238250e-01 1.90 4.607929453e+00 -5.663641250e-01 2.044518341e+00 4.636106644e+00 4.664283836e+00 -1.011039204e+00 -9.710353247e-01 3.306057896e+00 -2.003999981e+00 -9.563970552e-01 1.92 3.896793060e+00 -9.145939865e-01 1.509510635e+00 3.922829597e+00 3.948866133e+00 -1.228507456e+00 -1.243338836e+00 2.674417661e+00 -2.152153339e+00 -1.215854196e+00 1.94 3.234975450e+00 -1.230547336e+00 1.014906145e+00 3.259028348e+00 3.283081246e+00 -1.425928268e+00 -1.491567813e+00 2.088614515e+00 -2.284201633e+00 -1.453485169e+00 1.96 2.619676857e+00 -1.516420603e+00 5.582820713e-01 2.641891898e+00 2.664106939e+00 -1.604631108e+00 -1.717259619e+00 1.545966055e+00 -2.401261239e+00 -1.670606339e+00 1.98 2.048242276e+00 -1.774277807e+00 1.373471793e-01 2.068754796e+00 2.089267316e+00 -1.765867920e+00 -1.921864309e+00 1.043932326e+00 -2.504381319e+00 -1.868464149e+00 2.00 1.518154367e+00 -2.006058059e+00 -2.500649776e-01 1.537089990e+00 1.556025613e+00 -1.910817118e+00 -2.106749325e+00 5.801086505e-01 -2.594547617e+00 -2.048238601e+00 2.02 1.027026707e+00 -2.213582637e+00 -6.060024806e-01 1.044502030e+00 1.061977354e+00 -2.040587425e+00 -2.273203945e+00 1.522188238e-01 -2.672686052e+00 -2.211046559e+00 2.04 5.725973516e-01 -2.398561683e+00 -9.324011620e-01 5.887205805e-01 6.048438093e-01 -2.156221568e+00 -2.422443503e+00 -2.418913774e-01 -2.739666112e+00 -2.357944896e+00 2.06 1.527227096e-01 -2.562600536e+00 -1.231090405e+00 1.675942503e-01 1.824657910e-01 -2.258699810e+00 -2.555613377e+00 -6.042603561e-01 -2.796304054e+00 -2.489933493e+00 2.08 -2.346282985e-01 -2.707205707e+00 -1.503798666e+00 -2.209152882e-01 -2.072022780e-01 -2.348943339e+00 -2.673792777e+00 -9.368165623e-01 -2.843365946e+00 -2.607958096e+00 2.10 -5.913797988e-01 -2.833790540e+00 -1.752158706e+00 -5.787388971e-01 -5.660979954e-01 -2.427817497e+00 -2.777998330e+00 -1.241384073e+00 -2.881570522e+00 -2.712913031e+00 2.12 -9.193542626e-01 -2.943680548e+00 -1.977712576e+00 -9.077053064e-01 -8.960563503e-01 -2.496134873e+00 -2.869187476e+00 -1.519687897e+00 -2.911591895e+00 -2.805643795e+00 2.14 -1.220277551e+00 -3.038118467e+00 -2.181916341e+00 -1.209546192e+00 -1.198814834e+00 -2.554658234e+00 -2.948261685e+00 -1.773359024e+00 -2.934062114e+00 -2.886949515e+00 2.16 -1.495783715e+00 -3.118269028e+00 -2.366144573e+00 -1.485901009e+00 -1.476018303e+00 -2.604103330e+00 -3.016069509e+00 -2.003939223e+00 -2.949573580e+00 -2.957585296e+00 2.18 -1.747419578e+00 -3.185223461e+00 -2.531694614e+00 -1.738321598e+00 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