# 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 = 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 1.433157519e+02 nan 0.76 nan nan nan nan nan nan nan nan 1.358498575e+02 nan 0.78 nan nan nan nan nan 9.564982934e+01 nan nan 1.291009397e+02 nan 0.80 nan nan nan nan nan 8.905461870e+01 nan nan 1.228194453e+02 nan 0.82 nan nan nan nan nan 8.346994260e+01 nan nan 1.168874263e+02 nan 0.84 nan nan nan nan nan 7.854308158e+01 nan nan 1.111774446e+02 nan 0.86 nan nan nan nan nan 7.425243135e+01 nan nan 1.056648921e+02 nan 0.88 nan nan nan nan nan 7.045911507e+01 nan nan 1.003432325e+02 nan 0.90 nan 1.364781200e+02 nan 1.535956091e+02 1.535840653e+02 6.701964506e+01 nan nan 9.516999489e+01 1.233972826e+02 0.92 nan 1.318547530e+02 nan 1.514450877e+02 1.514333490e+02 6.382411080e+01 1.255053637e+02 nan 9.008517698e+01 1.186421148e+02 0.94 nan 1.268719262e+02 nan 1.491092991e+02 1.491004206e+02 6.087958156e+01 1.206274941e+02 nan 8.516335263e+01 1.139119083e+02 0.96 nan 1.216177953e+02 nan 1.464820258e+02 1.464750453e+02 5.812320065e+01 1.156653094e+02 nan 8.040420402e+01 1.091861304e+02 0.98 nan 1.161633034e+02 nan 1.433532216e+02 1.433492467e+02 5.545650746e+01 1.105642026e+02 nan 7.574891376e+01 1.043785643e+02 1.00 nan 1.105500411e+02 nan 1.398326959e+02 1.398325241e+02 5.289052540e+01 1.053850028e+02 nan 7.123852943e+01 9.955756968e+01 1.02 1.360019664e+02 1.048388045e+02 1.297972811e+02 1.360137793e+02 1.360173518e+02 5.042405183e+01 1.001969418e+02 1.317324716e+02 6.690018403e+01 9.477482228e+01 1.04 1.318973056e+02 9.911349296e+01 1.250279210e+02 1.319088463e+02 1.319134468e+02 4.804437329e+01 9.502829826e+01 1.271703607e+02 6.272735032e+01 9.006012786e+01 1.06 1.273725632e+02 9.340966632e+01 1.199407059e+02 1.273803155e+02 1.273868634e+02 4.568593658e+01 8.986284344e+01 1.223455231e+02 5.868412509e+01 8.533771012e+01 1.08 1.226569637e+02 8.776393140e+01 1.147425487e+02 1.226593806e+02 1.226643785e+02 4.340320081e+01 8.477942833e+01 1.173608233e+02 5.482439543e+01 8.071001843e+01 1.10 1.177864519e+02 8.223577180e+01 1.094710788e+02 1.177869359e+02 1.177900865e+02 4.119287105e+01 7.981522347e+01 1.122038578e+02 5.114297461e+01 7.618849497e+01 1.12 1.127716565e+02 7.685624593e+01 1.041313619e+02 1.127704479e+02 1.127732924e+02 3.903867502e+01 7.497857805e+01 1.069666558e+02 4.763282329e+01 7.177271529e+01 1.14 1.076110514e+02 7.163493986e+01 9.873977482e+01 1.076099161e+02 1.076135104e+02 3.691957936e+01 7.025326158e+01 1.016816180e+02 4.428179540e+01 6.745706950e+01 1.16 1.024242099e+02 6.660734232e+01 9.339904149e+01 1.024296584e+02 1.024345872e+02 3.486591552e+01 6.570143859e+01 9.640280172e+01 4.111125164e+01 6.329368014e+01 1.18 9.725525939e+01 6.180139168e+01 8.813436671e+01 9.726428508e+01 9.726974716e+01 3.288437953e+01 6.133568543e+01 9.114711026e+01 3.812110903e+01 5.928594902e+01 1.20 9.209851264e+01 5.721650030e+01 8.295864954e+01 9.210569042e+01 9.211153955e+01 3.096644972e+01 5.713990429e+01 8.597148289e+01 3.529640255e+01 5.542412720e+01 1.22 8.698632318e+01 5.284842189e+01 7.789186440e+01 8.699655520e+01 8.700419686e+01 2.911073759e+01 5.312584846e+01 8.090431720e+01 3.263442528e+01 5.170924657e+01 1.24 8.199127814e+01 4.872311183e+01 7.298644739e+01 8.200184675e+01 8.201091595e+01 2.733632321e+01 4.930944734e+01 7.595794783e+01 3.013941640e+01 4.817424188e+01 1.26 7.712808729e+01 4.483857061e+01 6.825860196e+01 7.713789384e+01 7.714645191e+01 2.564052981e+01 4.569080677e+01 7.116865198e+01 2.780091349e+01 4.481636795e+01 1.28 7.238206395e+01 4.117462676e+01 6.370012432e+01 7.238803695e+01 7.239484338e+01 2.401448918e+01 4.225826613e+01 6.654347213e+01 2.560792577e+01 4.161939911e+01 1.30 6.778849867e+01 3.774358918e+01 5.933418594e+01 6.779555202e+01 6.780146042e+01 2.246790958e+01 3.902503807e+01 6.209912016e+01 2.356230358e+01 3.859630433e+01 1.32 6.337697212e+01 3.454258635e+01 5.516713299e+01 6.338126896e+01 6.338559800e+01 2.100046689e+01 3.598921519e+01 5.783723332e+01 2.165946651e+01 3.574688000e+01 1.34 5.915046390e+01 3.156072347e+01 5.120582413e+01 5.915165726e+01 5.915454389e+01 1.961046937e+01 3.313994617e+01 5.377473905e+01 1.988924909e+01 3.305495111e+01 1.36 5.509688247e+01 2.878343933e+01 4.743996612e+01 5.509281274e+01 5.509451843e+01 1.829103058e+01 3.046671710e+01 4.990781666e+01 1.824248900e+01 3.051722260e+01 1.38 5.123549832e+01 2.620381507e+01 4.387954769e+01 5.123067069e+01 5.123185054e+01 1.704473640e+01 2.797202117e+01 4.623731707e+01 1.671974783e+01 2.813948490e+01 1.40 4.756222715e+01 2.381790988e+01 4.052684543e+01 4.756303221e+01 4.756467420e+01 1.587452065e+01 2.564697332e+01 4.276408767e+01 1.531060293e+01 2.591402578e+01 1.42 4.408228498e+01 2.161470086e+01 3.737261731e+01 4.408624165e+01 4.408818942e+01 1.475281076e+01 2.348284811e+01 3.949079560e+01 1.400853722e+01 2.383526899e+01 1.44 4.078887134e+01 1.958403503e+01 3.440672147e+01 4.079582357e+01 4.079888076e+01 1.365187057e+01 2.147057971e+01 3.641092361e+01 1.280315978e+01 2.189541752e+01 1.46 3.768706200e+01 1.771653119e+01 3.162334663e+01 3.769528171e+01 3.769896278e+01 1.257729150e+01 1.960233781e+01 3.351983596e+01 1.165655014e+01 2.009189952e+01 1.48 3.477291006e+01 1.599917893e+01 2.902061571e+01 3.477984189e+01 3.478353103e+01 1.153535370e+01 1.787543607e+01 3.081206168e+01 1.056169612e+01 1.841802090e+01 1.50 3.203512221e+01 1.442210468e+01 2.659311284e+01 3.204096034e+01 3.204483082e+01 1.053173517e+01 1.628066979e+01 2.828055521e+01 9.520928715e+00 1.686327488e+01 1.52 2.946853852e+01 1.297943453e+01 2.433403879e+01 2.947453806e+01 2.947896795e+01 9.569954505e+00 1.481105438e+01 2.591973303e+01 8.534943580e+00 1.542117890e+01 1.54 2.707210058e+01 1.166282975e+01 2.223482355e+01 2.707778339e+01 2.708264889e+01 8.651640221e+00 1.345930220e+01 2.372250056e+01 7.602457476e+00 1.408983433e+01 1.56 2.483781270e+01 1.044749687e+01 2.028930901e+01 2.484081523e+01 2.484604974e+01 7.780014749e+00 1.221570978e+01 2.168109040e+01 6.722883908e+00 1.286211631e+01 1.58 2.275202072e+01 9.309690485e+00 1.848720728e+01 2.275452481e+01 2.276005118e+01 6.955467721e+00 1.105252046e+01 1.978466094e+01 5.896060954e+00 1.170489668e+01 1.60 2.081293245e+01 8.246110751e+00 1.682224156e+01 2.081460500e+01 2.081932205e+01 6.178412663e+00 9.955047316e+00 1.802816004e+01 5.121325888e+00 1.060704705e+01 1.62 1.901401212e+01 7.250428839e+00 1.528607488e+01 1.901353353e+01 1.901610746e+01 5.448209435e+00 8.918180044e+00 1.640338351e+01 4.397614928e+00 9.568515969e+00 1.64 1.734741688e+01 6.320117199e+00 1.387085797e+01 1.734505348e+01 1.734575610e+01 4.764054428e+00 7.942747732e+00 1.490399031e+01 3.723208498e+00 8.587799849e+00 1.66 1.580150932e+01 5.452686684e+00 1.256509186e+01 1.579939132e+01 1.579909596e+01 4.123506362e+00 7.026576169e+00 1.351925441e+01 3.096075729e+00 7.660525828e+00 1.68 1.437051162e+01 4.645463996e+00 1.136278431e+01 1.437035314e+01 1.436977590e+01 3.525341899e+00 6.166358918e+00 1.224414680e+01 2.513561324e+00 6.785973896e+00 1.70 1.305087519e+01 3.895609844e+00 1.024347752e+01 1.305240774e+01 1.305158776e+01 2.968999630e+00 5.360884718e+00 1.107063685e+01 1.974423702e+00 5.965117453e+00 1.72 1.183583255e+01 3.200097898e+00 9.191862227e+00 1.183817430e+01 1.183712939e+01 2.452885461e+00 4.607318434e+00 9.971812525e+00 1.476146003e+00 5.196129805e+00 1.74 1.071093378e+01 2.555932495e+00 8.204735875e+00 1.071229997e+01 1.071111601e+01 1.975051441e+00 3.903685930e+00 8.939866670e+00 1.016802879e+00 4.476970757e+00 1.76 9.652841619e+00 1.959186244e+00 7.276718198e+00 9.653635867e+00 9.652599765e+00 1.531688915e+00 3.247130711e+00 7.970877114e+00 5.944753088e-01 3.804503117e+00 1.78 8.657301537e+00 1.407267524e+00 6.405312074e+00 8.657915455e+00 8.657309382e+00 1.123618293e+00 2.637054290e+00 7.061903610e+00 2.071647750e-01 3.176736523e+00 1.80 7.722528939e+00 8.985211491e-01 5.589922381e+00 7.722937455e+00 7.722644425e+00 7.487742007e-01 2.071149610e+00 6.210095574e+00 -1.471429499e-01 2.592969329e+00 1.82 6.845048332e+00 4.294554628e-01 4.827886200e+00 6.845316773e+00 6.845322432e+00 4.043951091e-01 1.546899424e+00 5.410719738e+00 -4.698298473e-01 2.050750704e+00 1.84 6.022165506e+00 -2.206776731e-03 4.115934996e+00 6.021685105e+00 6.021909499e+00 8.843088793e-02 1.061712799e+00 4.663015676e+00 -7.617244501e-01 1.547952305e+00 1.86 5.251011004e+00 -3.999890571e-01 3.451766466e+00 5.249546518e+00 5.249963852e+00 -2.007046219e-01 6.138934095e-01 3.962505248e+00 -1.027483892e+00 1.082468086e+00 1.88 4.526141988e+00 -7.635105273e-01 2.833035774e+00 4.525127253e+00 4.526122120e+00 -4.646085777e-01 2.015217827e-01 3.307213776e+00 -1.269013370e+00 6.526968721e-01 1.90 3.844678459e+00 -1.095098890e+00 2.257107389e+00 3.845479758e+00 3.847440679e+00 -7.050849222e-01 -1.777340038e-01 2.696777140e+00 -1.486928848e+00 2.562855567e-01 1.92 3.208487072e+00 -1.396908215e+00 1.721002410e+00 3.210685771e+00 3.213316831e+00 -9.237437777e-01 -5.256944025e-01 2.128729497e+00 -1.683102881e+00 -1.086905554e-01 1.94 2.615445109e+00 -1.670673846e+00 1.220642208e+00 2.618110308e+00 2.620588794e+00 -1.121932277e+00 -8.446803960e-01 1.600860530e+00 -1.859139710e+00 -4.438084040e-01 1.96 2.063223815e+00 -1.918292611e+00 7.571040705e-01 2.066269971e+00 2.068601564e+00 -1.301005480e+00 -1.136215970e+00 1.111116768e+00 -2.015952791e+00 -7.508630086e-01 1.98 1.549362250e+00 -2.140768429e+00 3.260069844e-01 1.552198686e+00 1.554401228e+00 -1.463468871e+00 -1.402509353e+00 6.571437104e-01 -2.155001234e+00 -1.031667623e+00 2.00 1.071707480e+00 -2.338538047e+00 -7.327786811e-02 1.074087696e+00 1.076168098e+00 -1.609009930e+00 -1.643133673e+00 2.359238296e-01 -2.277558086e+00 -1.286020767e+00 2.02 6.285723453e-01 -2.515295811e+00 -4.413019297e-01 6.305575639e-01 6.325264104e-01 -1.738702815e+00 -1.859423539e+00 -1.533323234e-01 -2.384785341e+00 -1.516348573e+00 2.04 2.169683214e-01 -2.672580015e+00 -7.800130437e-01 2.188355022e-01 2.207026829e-01 -1.854187781e+00 -2.054586849e+00 -5.122290513e-01 -2.478120636e+00 -1.727782001e+00 2.06 -1.640188076e-01 -2.811666826e+00 -1.091246662e+00 -1.622442269e-01 -1.604696462e-01 -1.956564626e+00 -2.230058300e+00 -8.428542510e-01 -2.557601957e+00 -1.919072213e+00 2.08 -5.161648037e-01 -2.933827346e+00 -1.376656802e+00 -5.145189269e-01 -5.128730502e-01 -2.046809522e+00 -2.387080125e+00 -1.146796283e+00 -2.625661532e+00 -2.091383754e+00 2.10 -8.406484099e-01 -3.040178294e+00 -1.637527631e+00 -8.397558710e-01 -8.388633321e-01 -2.125698532e+00 -2.526847513e+00 -1.425551581e+00 -2.682513226e+00 -2.245698053e+00 2.12 -1.139510044e+00 -3.132222351e+00 -1.875618215e+00 -1.139301833e+00 -1.139093622e+00 -2.194236637e+00 -2.650527748e+00 -1.681413399e+00 -2.729257353e+00 -2.383502683e+00 2.14 -1.414129579e+00 -3.210994640e+00 -2.092252461e+00 -1.414521280e+00 -1.414912981e+00 -2.253126381e+00 -2.759256920e+00 -1.915023851e+00 -2.767230886e+00 -2.505813926e+00 2.16 -1.665895016e+00 -3.277145517e+00 -2.288325619e+00 -1.666822390e+00 -1.667749764e+00 -2.303874124e+00 -2.854363823e+00 -2.127654509e+00 -2.796533064e+00 -2.613671928e+00 2.18 -1.896035657e+00 -3.332767692e+00 -2.463912991e+00 -1.897433450e+00 -1.898831243e+00 -2.346453951e+00 -2.937048790e+00 -2.319258148e+00 -2.817802967e+00 -2.708085021e+00 2.20 -2.105981883e+00 -3.377517405e+00 -2.622063493e+00 -2.107802659e+00 -2.109623435e+00 -2.381485888e+00 -3.007646906e+00 -2.491167790e+00 -2.831875864e+00 -2.789992702e+00 2.22 -2.296944487e+00 -3.411492406e+00 -2.763812926e+00 -2.298957099e+00 -2.300969711e+00 -2.409517266e+00 -3.067033603e+00 -2.647094407e+00 -2.839337270e+00 -2.861219515e+00 2.24 -2.469992661e+00 -3.436091920e+00 -2.890143455e+00 -2.471719144e+00 -2.473445627e+00 -2.431127924e+00 -3.115136510e+00 -2.787486281e+00 -2.840742018e+00 -2.922585383e+00 2.26 -2.626190568e+00 -3.452125235e+00 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