# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2003--Hoyt-J-J-Garvin-J-W-Webb-E-B-Asta-M--Cu-Pb # implementation = 2003--Hoyt-J-J--Cu-Pb--LAMMPS--ipr1 # composition = Pb # 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 3.233567778e+02 nan 0.76 nan nan nan nan nan nan nan nan 2.972519419e+02 nan 0.78 nan nan nan nan nan 2.361062237e+02 nan nan 2.737781466e+02 nan 0.80 nan nan nan nan nan 2.178548414e+02 nan nan 2.526165293e+02 nan 0.82 nan nan nan nan nan 2.012952045e+02 nan nan 2.335028119e+02 nan 0.84 nan nan nan nan nan 1.862058371e+02 nan nan 2.161815403e+02 nan 0.86 nan nan nan nan nan 1.724402501e+02 nan nan 2.004496329e+02 nan 0.88 nan nan nan nan nan 1.599483690e+02 nan nan 1.861408750e+02 nan 0.90 nan 2.360497671e+02 nan 3.402211382e+02 3.402569233e+02 1.486222906e+02 nan nan 1.730888768e+02 2.360967684e+02 0.92 nan 2.200134096e+02 nan 3.174946724e+02 3.174925135e+02 1.383336868e+02 2.233007358e+02 nan 1.611409268e+02 2.201037780e+02 0.94 nan 2.053123993e+02 nan 2.966870404e+02 2.966523967e+02 1.289333801e+02 2.084033797e+02 nan 1.501786609e+02 2.054771085e+02 0.96 nan 1.918174816e+02 nan 2.775954248e+02 2.775443750e+02 1.202639671e+02 1.947597334e+02 nan 1.401173050e+02 1.920413669e+02 0.98 nan 1.794247960e+02 nan 2.600301732e+02 2.599815355e+02 1.122536532e+02 1.822515502e+02 nan 1.308853902e+02 1.796309096e+02 1.00 nan 1.680103429e+02 nan 2.438413237e+02 2.438182787e+02 1.048681192e+02 1.707205753e+02 nan 1.223963428e+02 1.681510918e+02 1.02 2.288302195e+02 1.574650376e+02 2.090045804e+02 2.288891088e+02 2.289013513e+02 9.805889156e+01 1.600364094e+02 2.148247936e+02 1.145624695e+02 1.575641592e+02 1.04 2.149522763e+02 1.477268920e+02 1.962585303e+02 2.150626168e+02 2.151016617e+02 9.178403014e+01 1.501234687e+02 2.017806484e+02 1.073135837e+02 1.478244603e+02 1.06 2.021516385e+02 1.387120767e+02 1.844864828e+02 2.022597078e+02 2.023070108e+02 8.600896489e+01 1.409436348e+02 1.897486814e+02 1.005888321e+02 1.388664332e+02 1.08 1.903155643e+02 1.303529693e+02 1.735806210e+02 1.903853294e+02 1.904260124e+02 8.068293971e+01 1.324686245e+02 1.786193274e+02 9.435869079e+01 1.306033812e+02 1.10 1.793613320e+02 1.226246064e+02 1.634699009e+02 1.793654832e+02 1.793920903e+02 7.575504235e+01 1.246446735e+02 1.683014165e+02 8.858308853e+01 1.229286744e+02 1.12 1.692093976e+02 1.154588389e+02 1.541028404e+02 1.691419551e+02 1.691499426e+02 7.118375713e+01 1.174038198e+02 1.587039965e+02 8.322168270e+01 1.157488450e+02 1.14 1.597428420e+02 1.087883561e+02 1.454289357e+02 1.596446116e+02 1.596350629e+02 6.693346141e+01 1.106721032e+02 1.497493160e+02 7.824496640e+01 1.090254545e+02 1.16 1.508810455e+02 1.025635348e+02 1.373761570e+02 1.508003196e+02 1.507758809e+02 6.297202266e+01 1.043876429e+02 1.413879450e+02 7.362473137e+01 1.027432414e+02 1.18 1.425792848e+02 9.676406309e+01 1.298639975e+02 1.425467294e+02 1.425148741e+02 5.928346452e+01 9.849450824e+01 1.335835260e+02 6.932578510e+01 9.688021695e+01 1.20 1.348296792e+02 9.135742895e+01 1.228065164e+02 1.348387187e+02 1.348062030e+02 5.583464743e+01 9.296152798e+01 1.263029645e+02 6.532396865e+01 9.141737651e+01 1.22 1.275949165e+02 8.629692872e+01 1.161588297e+02 1.276300779e+02 1.276010001e+02 5.259802568e+01 8.776523731e+01 1.195099049e+02 6.159475477e+01 8.632474097e+01 1.24 1.208439648e+02 8.155253737e+01 1.099212320e+02 1.208846054e+02 1.208613672e+02 4.955977305e+01 8.290181001e+01 1.131679711e+02 5.811226883e+01 8.157154208e+01 1.26 1.145413194e+02 7.710335127e+01 1.040955571e+02 1.145742085e+02 1.145624365e+02 4.671531277e+01 7.836265457e+01 1.072430957e+02 5.486100228e+01 7.712904232e+01 1.28 1.086485353e+02 7.293500549e+01 9.865139217e+01 1.086661700e+02 1.086698032e+02 4.405136217e+01 7.412164506e+01 1.016952663e+02 5.181448785e+01 7.297798527e+01 1.30 1.031280496e+02 6.902696481e+01 9.355923826e+01 1.031251893e+02 1.031420645e+02 4.155331464e+01 7.015557098e+01 9.648124588e+01 4.894984489e+01 6.910345423e+01 1.32 9.793545028e+01 6.535606652e+01 8.879943224e+01 9.791437198e+01 9.793799943e+01 3.921679872e+01 6.644471886e+01 9.156233464e+01 4.625540714e+01 6.547632247e+01 1.34 9.303393357e+01 6.189914746e+01 8.434136557e+01 9.300230536e+01 9.302473895e+01 3.703285185e+01 6.296986442e+01 8.691348151e+01 4.372323261e+01 6.207719259e+01 1.36 8.839490936e+01 5.863630403e+01 8.013763909e+01 8.836532396e+01 8.838233696e+01 3.498391700e+01 5.971131617e+01 8.252204731e+01 4.134312183e+01 5.888511611e+01 1.38 8.399767779e+01 5.556601357e+01 7.615391703e+01 8.398696171e+01 8.400140084e+01 3.305497103e+01 5.664909460e+01 7.837641852e+01 3.910571516e+01 5.587527598e+01 1.40 7.983479110e+01 5.268978327e+01 7.236704974e+01 7.985264214e+01 7.986846106e+01 3.123158598e+01 5.376325919e+01 7.447134532e+01 3.699920568e+01 5.302986493e+01 1.42 7.591216566e+01 4.999711976e+01 6.877174155e+01 7.595304944e+01 7.596940244e+01 2.950610034e+01 5.103429711e+01 7.080511838e+01 3.501376546e+01 5.034233459e+01 1.44 7.222910365e+01 4.746968754e+01 6.536922572e+01 7.227835231e+01 7.229274623e+01 2.787276296e+01 4.845325319e+01 6.736510485e+01 3.314331897e+01 4.780697758e+01 1.46 6.876759187e+01 4.509012659e+01 6.215089411e+01 6.881309111e+01 6.882366524e+01 2.632382229e+01 4.601532206e+01 6.413183071e+01 3.138049731e+01 4.541118048e+01 1.48 6.551319182e+01 4.284257508e+01 5.910717710e+01 6.554660688e+01 6.555168480e+01 2.485349165e+01 4.371789181e+01 6.108557204e+01 2.971875511e+01 4.314565703e+01 1.50 6.245149689e+01 4.071517730e+01 5.623836628e+01 6.246744095e+01 6.246552983e+01 2.346449650e+01 4.155562122e+01 5.820533241e+01 2.814760058e+01 4.099930167e+01 1.52 5.956683464e+01 3.869493544e+01 5.354568650e+01 5.955882854e+01 5.954871996e+01 2.216239075e+01 3.951919242e+01 5.547228577e+01 2.665714205e+01 3.897083426e+01 1.54 5.683579695e+01 3.676711555e+01 5.101617432e+01 5.680276477e+01 5.678512066e+01 2.094109569e+01 3.759763205e+01 5.287128669e+01 2.524105437e+01 3.705426862e+01 1.56 5.422696458e+01 3.492868589e+01 4.863638908e+01 5.417999981e+01 5.415793360e+01 1.979615427e+01 3.578083124e+01 5.039160244e+01 2.389382747e+01 3.523867534e+01 1.58 5.172769980e+01 3.318284403e+01 4.639229237e+01 5.168061748e+01 5.165776316e+01 1.872329968e+01 3.405916150e+01 4.803175073e+01 2.261353678e+01 3.351733983e+01 1.60 4.933858021e+01 3.153159588e+01 4.426924387e+01 4.930040798e+01 4.927957285e+01 1.771803771e+01 3.242267596e+01 4.579163886e+01 2.140097897e+01 3.188378887e+01 1.62 4.706677739e+01 2.997260170e+01 4.225014695e+01 4.704105916e+01 4.702392460e+01 1.677532172e+01 3.086021749e+01 4.366989767e+01 2.025476530e+01 3.033095072e+01 1.64 4.491083465e+01 2.850316294e+01 4.032113482e+01 4.489692739e+01 4.488431277e+01 1.588683724e+01 2.936403419e+01 4.165949490e+01 1.917049948e+01 2.885328586e+01 1.66 4.286763863e+01 2.711754160e+01 3.848214955e+01 4.286362193e+01 4.285678945e+01 1.504891188e+01 2.793218569e+01 3.975365894e+01 1.814488046e+01 2.744697428e+01 1.68 4.093133412e+01 2.580930409e+01 3.673281464e+01 4.093551556e+01 4.093493023e+01 1.426066529e+01 2.656478975e+01 3.794636517e+01 1.717423770e+01 2.610594686e+01 1.70 3.909547426e+01 2.457289671e+01 3.507359149e+01 3.910739494e+01 3.911242610e+01 1.352203335e+01 2.526210154e+01 3.623306414e+01 1.625447298e+01 2.482492835e+01 1.72 3.735609368e+01 2.340226722e+01 3.349835533e+01 3.737432819e+01 3.738331504e+01 1.282890187e+01 2.402313025e+01 3.460962262e+01 1.538139128e+01 2.360391361e+01 1.74 3.571005638e+01 2.229072133e+01 3.200012876e+01 3.573059744e+01 3.574144256e+01 1.217744225e+01 2.284582402e+01 3.306933045e+01 1.455205319e+01 2.244669514e+01 1.76 3.415014787e+01 2.123183100e+01 3.057288797e+01 3.416951860e+01 3.418051843e+01 1.156472782e+01 2.172788045e+01 3.160426352e+01 1.376488206e+01 2.135152172e+01 1.78 3.266723274e+01 2.021981669e+01 2.921115322e+01 3.268428279e+01 3.269497678e+01 1.098787582e+01 2.066710463e+01 3.020782105e+01 1.301752943e+01 2.031159277e+01 1.80 3.125457112e+01 1.924950032e+01 2.791003707e+01 3.126838287e+01 3.127855893e+01 1.044406649e+01 1.965908470e+01 2.887586036e+01 1.230759909e+01 1.932193699e+01 1.82 2.990599667e+01 1.831655193e+01 2.666574639e+01 2.991572908e+01 2.992525287e+01 9.931177067e+00 1.869921813e+01 2.760514005e+01 1.163342163e+01 1.837786614e+01 1.84 2.861607471e+01 1.741913755e+01 2.547584088e+01 2.862113861e+01 2.862982076e+01 9.448191986e+00 1.778506728e+01 2.639124559e+01 1.099349199e+01 1.747530905e+01 1.86 2.737653029e+01 1.655706934e+01 2.433535889e+01 2.737859044e+01 2.738686482e+01 8.992771034e+00 1.691407446e+01 2.522873095e+01 1.038551132e+01 1.660802491e+01 1.88 2.618583901e+01 1.572982513e+01 2.324162075e+01 2.618664206e+01 2.619462302e+01 8.563199475e+00 1.608194174e+01 2.411615289e+01 9.807599415e+00 1.577454553e+01 1.90 2.504697461e+01 1.493693788e+01 2.219396000e+01 2.504710964e+01 2.505378724e+01 8.158806699e+00 1.528482602e+01 2.305378820e+01 9.258990009e+00 1.497807792e+01 1.92 2.396167216e+01 1.417829958e+01 2.119252645e+01 2.396074556e+01 2.396446595e+01 7.779177425e+00 1.451976261e+01 2.204009084e+01 8.739292616e+00 1.422131056e+01 1.94 2.292723163e+01 1.345308224e+01 2.023770432e+01 2.292406669e+01 2.292375853e+01 7.423983211e+00 1.378591490e+01 2.107134954e+01 8.248149270e+00 1.350269202e+01 1.96 2.194002773e+01 1.276008665e+01 1.932811451e+01 2.193401714e+01 2.192932440e+01 7.091879216e+00 1.308188653e+01 2.014356933e+01 7.784535037e+00 1.281965316e+01 1.98 2.099582640e+01 1.209747257e+01 1.846081071e+01 2.098742458e+01 2.097891854e+01 6.779931372e+00 1.240674755e+01 1.925292869e+01 7.347363437e+00 1.216864094e+01 2.00 2.009061026e+01 1.146463808e+01 1.763405349e+01 2.008088548e+01 2.006971636e+01 6.487033375e+00 1.175986317e+01 1.839665744e+01 6.935598900e+00 1.154707381e+01 2.02 1.922050812e+01 1.086077669e+01 1.684547527e+01 1.921093031e+01 1.919867664e+01 6.211867833e+00 1.114174797e+01 1.757175811e+01 6.548256834e+00 1.095276617e+01 2.04 1.838240389e+01 1.028392025e+01 1.609213915e+01 1.837449453e+01 1.836292124e+01 5.952811690e+00 1.055306306e+01 1.677641930e+01 6.184399441e+00 1.038421880e+01 2.06 1.757434107e+01 9.732272026e+00 1.537078305e+01 1.756879649e+01 1.755951863e+01 5.707984954e+00 9.992712657e+00 1.601085747e+01 5.842477660e+00 9.839947748e+00 2.08 1.679569030e+01 9.203294072e+00 1.467807032e+01 1.679256555e+01 1.678680929e+01 5.475303268e+00 9.459133778e+00 1.527460579e+01 5.520673843e+00 9.318983718e+00 2.10 1.604406825e+01 8.696166137e+00 1.401108133e+01 1.604386366e+01 1.604258274e+01 5.252568721e+00 8.950749137e+00 1.456652745e+01 5.216756104e+00 8.820998013e+00 2.12 1.531814711e+01 8.210550894e+00 1.336763428e+01 1.532152415e+01 1.532501904e+01 5.037558937e+00 8.466024421e+00 1.388703355e+01 4.929523868e+00 8.346368411e+00 2.14 1.461999293e+01 7.745890075e+00 1.274579620e+01 1.462655975e+01 1.463403523e+01 4.828307786e+00 8.003559789e+00 1.323654441e+01 4.657679142e+00 7.895603667e+00 2.16 1.394996359e+01 7.300765796e+00 1.214140769e+01 1.395834580e+01 1.396797890e+01 4.623472758e+00 7.562129976e+00 1.261464591e+01 4.399604835e+00 7.468378084e+00 2.18 1.330793375e+01 6.873738316e+00 1.155329620e+01 1.331662059e+01 1.332640778e+01 4.422619554e+00 7.140903721e+00 1.202044436e+01 4.154562699e+00 7.064155413e+00 2.20 1.269349882e+01 6.463286863e+00 1.098217558e+01 1.270128767e+01 1.270965222e+01 4.226189328e+00 6.738923643e+00 1.145279669e+01 3.922274788e+00 6.682337212e+00 2.22 1.210646016e+01 6.068282943e+00 1.042940930e+01 1.211248306e+01 1.211869924e+01 4.035066325e+00 6.355703941e+00 1.091003987e+01 3.702388706e+00 6.322763787e+00 2.24 1.154607108e+01 5.688255910e+00 9.897167901e+00 1.155005918e+01 1.155405947e+01 3.850614861e+00 5.990597856e+00 1.038986479e+01 3.494537850e+00 5.985023081e+00 2.26 1.101072414e+01 5.323516988e+00 9.385514597e+00 1.101262755e+01 1.101453096e+01 3.673177603e+00 5.643097088e+00 9.890200739e+00 3.298418620e+00 5.667681115e+00 2.28 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