# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2000--Landa-A-Wynblatt-P-Siegel-D-J-et-al--Al-Pb # implementation = 2000--Landa-A--Al-Pb--LAMMPS--ipr1 # NOTE: These values only provide a look at the purely pair interaction # of the potential and therefore exclude multi-body interactions. # Calculations from the NIST Interatomic Potential Repository Project: # http://www.ctcms.nist.gov/potentials/ # Table generated 2022-05-24 r Al Al Al Pb Pb Pb 0.02 1.512340071e+01 1.801823115e+01 1.080875099e+01 0.04 1.502064157e+01 1.784319813e+01 1.069263547e+01 0.06 1.491327574e+01 1.766803166e+01 1.057705184e+01 0.08 1.480146862e+01 1.749275510e+01 1.046215178e+01 0.10 1.468538563e+01 1.731739179e+01 1.034803497e+01 0.12 1.456519218e+01 1.714196512e+01 1.023481188e+01 0.14 1.444105370e+01 1.696649848e+01 1.012257445e+01 0.16 1.431313559e+01 1.679101524e+01 1.001140757e+01 0.18 1.418160327e+01 1.661553880e+01 9.901386983e+00 0.20 1.404662216e+01 1.644009254e+01 9.792578200e+00 0.22 1.390835767e+01 1.626469984e+01 9.685038654e+00 0.24 1.376697521e+01 1.608938409e+01 9.578814990e+00 0.26 1.362264020e+01 1.591416868e+01 9.473945387e+00 0.28 1.347551805e+01 1.573907687e+01 9.370458666e+00 0.30 1.332577418e+01 1.556413241e+01 9.268373483e+00 0.32 1.317357401e+01 1.538935814e+01 9.167700213e+00 0.34 1.301908294e+01 1.521477848e+01 9.068438686e+00 0.36 1.286246640e+01 1.504040944e+01 8.970580420e+00 0.38 1.270388980e+01 1.486625094e+01 8.874106923e+00 0.40 1.254351855e+01 1.469230219e+01 8.778990182e+00 0.42 1.238151806e+01 1.451855897e+01 8.685193728e+00 0.44 1.221805376e+01 1.434501888e+01 8.592670388e+00 0.46 1.205329106e+01 1.417167918e+01 8.501364894e+00 0.48 1.188739536e+01 1.399853711e+01 8.411211675e+00 0.50 1.172053210e+01 1.382558995e+01 8.322136042e+00 0.52 1.155286667e+01 1.365283495e+01 8.234054528e+00 0.54 1.138456451e+01 1.348026935e+01 8.146873051e+00 0.56 1.121579101e+01 1.330789043e+01 8.060489485e+00 0.58 1.104671160e+01 1.313569543e+01 7.974791293e+00 0.60 1.087749169e+01 1.296368161e+01 7.889657096e+00 0.62 1.070829669e+01 1.279184623e+01 7.804956229e+00 0.64 1.053929203e+01 1.262018654e+01 7.720547901e+00 0.66 1.037064311e+01 1.244869999e+01 7.636284825e+00 0.68 1.020251535e+01 1.227738300e+01 7.552001194e+00 0.70 1.003507417e+01 1.210623394e+01 7.467538196e+00 0.72 9.868320664e+00 1.193524680e+01 7.382713279e+00 0.74 9.702022283e+00 1.176441143e+01 7.297465106e+00 0.76 9.536168005e+00 1.159372850e+01 7.211792744e+00 0.78 9.370752598e+00 1.142319784e+01 7.125705387e+00 0.80 9.205770829e+00 1.125281958e+01 7.039219037e+00 0.82 9.041217465e+00 1.108259375e+01 6.952342982e+00 0.84 8.877087275e+00 1.091252042e+01 6.865088184e+00 0.86 8.713375026e+00 1.074259964e+01 6.777465628e+00 0.88 8.550078316e+00 1.057283155e+01 6.689486257e+00 0.90 8.387198212e+00 1.040321631e+01 6.601161013e+00 0.92 8.224732166e+00 1.023375406e+01 6.512500861e+00 0.94 8.062677562e+00 1.006444489e+01 6.423516758e+00 0.96 7.901031784e+00 9.895288937e+00 6.334219664e+00 0.98 7.739792216e+00 9.726286297e+00 6.244620525e+00 1.00 7.578956243e+00 9.557437103e+00 6.154730289e+00 1.02 7.418521246e+00 9.388741430e+00 6.064559930e+00 1.04 7.258484612e+00 9.220199461e+00 5.974120407e+00 1.06 7.098843722e+00 9.051811084e+00 5.883422645e+00 1.08 6.939595962e+00 8.883578111e+00 5.792477612e+00 1.10 6.780738715e+00 8.715503152e+00 5.701296284e+00 1.12 6.622269364e+00 8.547589420e+00 5.609889600e+00 1.14 6.464185294e+00 8.379840163e+00 5.518268510e+00 1.16 6.306483889e+00 8.212258508e+00 5.426443978e+00 1.18 6.149162531e+00 8.044847616e+00 5.334426960e+00 1.20 5.992218606e+00 7.877610644e+00 5.242228410e+00 1.22 5.835649497e+00 7.710550753e+00 5.149859280e+00 1.24 5.679452587e+00 7.543671101e+00 5.057330524e+00 1.26 5.523625262e+00 7.376974849e+00 4.964653107e+00 1.28 5.368164903e+00 7.210465154e+00 4.871837980e+00 1.30 5.213068896e+00 7.044145178e+00 4.778896089e+00 1.32 5.058334624e+00 6.878018078e+00 4.685838396e+00 1.34 4.903959470e+00 6.712087014e+00 4.592675865e+00 1.36 4.749940820e+00 6.546355104e+00 4.499419441e+00 1.38 4.596276056e+00 6.380825564e+00 4.406080078e+00 1.40 4.442962562e+00 6.215501898e+00 4.312668738e+00 1.42 4.289997722e+00 6.050386160e+00 4.219196375e+00 1.44 4.137378921e+00 5.885479334e+00 4.125673942e+00 1.46 3.985103541e+00 5.720777926e+00 4.032112396e+00 1.48 3.833168968e+00 5.556278604e+00 3.938522691e+00 1.50 3.681572583e+00 5.391977984e+00 3.844915783e+00 1.52 3.530311772e+00 5.227872731e+00 3.751302629e+00 1.54 3.379383918e+00 5.063959498e+00 3.657694182e+00 1.56 3.228786405e+00 4.900234939e+00 3.564101398e+00 1.58 3.078516617e+00 4.736695703e+00 3.470535231e+00 1.60 2.928571938e+00 4.573338444e+00 3.377006641e+00 1.62 2.778949751e+00 4.410159811e+00 3.283526580e+00 1.64 2.629647440e+00 4.247156457e+00 3.190106003e+00 1.66 2.480662390e+00 4.084325033e+00 3.096755865e+00 1.68 2.331991983e+00 3.921662191e+00 3.003487123e+00 1.70 2.183633605e+00 3.759164532e+00 2.910310733e+00 1.72 2.035584637e+00 3.596828802e+00 2.817237649e+00 1.74 1.887842466e+00 3.434651066e+00 2.724278823e+00 1.76 1.740404473e+00 3.272630194e+00 2.631445215e+00 1.78 1.593268044e+00 3.110759802e+00 2.538747785e+00 1.80 1.446430562e+00 2.949013199e+00 2.446197477e+00 1.82 1.299889410e+00 2.787357816e+00 2.353805246e+00 1.84 1.153641966e+00 2.625751040e+00 2.261582064e+00 1.86 1.007685610e+00 2.464154279e+00 2.169538879e+00 1.88 8.620177319e-01 2.302528437e+00 2.077686632e+00 1.90 7.166357222e-01 2.140834399e+00 1.986036292e+00 1.92 5.715369707e-01 1.979033033e+00 1.894598816e+00 1.94 4.267188674e-01 1.817085211e+00 1.803385154e+00 1.96 2.821788023e-01 1.654951803e+00 1.712406260e+00 1.98 1.379141652e-01 1.492593678e+00 1.621673089e+00 2.00 -6.077885196e-03 1.329980129e+00 1.531196603e+00 2.02 -1.498000578e-01 1.167113910e+00 1.440989347e+00 2.04 -2.932539900e-01 1.007719651e+00 1.351055794e+00 2.06 -4.360426596e-01 8.550024126e-01 1.262752487e+00 2.08 -5.724504167e-01 7.088922947e-01 1.177369293e+00 2.10 -7.005196519e-01 5.693360549e-01 1.094850321e+00 2.12 -8.206074208e-01 4.361579498e-01 1.015144279e+00 2.14 -9.330074095e-01 3.091964090e-01 9.381979739e-01 2.16 -1.038001125e+00 1.883331343e-01 8.639580535e-01 2.18 -1.135858695e+00 7.354519743e-02 7.923709029e-01 2.20 -1.226840116e+00 -3.522084443e-02 7.233828976e-01 2.22 -1.311196352e+00 -1.380282492e-01 6.569404632e-01 2.24 -1.389170508e+00 -2.349553062e-01 5.929900320e-01 2.26 -1.460999079e+00 -3.260961170e-01 5.314781484e-01 2.28 -1.526912609e+00 -4.115566961e-01 4.723515733e-01 2.30 -1.587136653e+00 -4.914544457e-01 4.155572482e-01 2.32 -1.641893343e+00 -5.659199390e-01 3.610423438e-01 2.34 -1.691422093e+00 -6.351102201e-01 3.087543844e-01 2.36 -1.735982834e+00 -6.991994051e-01 2.586412557e-01 2.38 -1.775835602e+00 -7.583694734e-01 2.106511284e-01 2.40 -1.811240558e+00 -8.128094188e-01 1.647326038e-01 2.42 -1.842458573e+00 -8.627145310e-01 1.208347350e-01 2.44 -1.869751995e+00 -9.082857789e-01 7.890697942e-02 2.46 -1.893385429e+00 -9.497290495e-01 3.889929960e-02 2.48 -1.913626336e+00 -9.872546019e-01 7.621826618e-04 2.50 -1.930745481e+00 -1.021076553e+00 -3.555346253e-02 2.52 -1.945017370e+00 -1.051412399e+00 -7.009618091e-02 2.54 -1.956720716e+00 -1.078482490e+00 -1.029139544e-01 2.56 -1.966138460e+00 -1.102509487e+00 -1.340542523e-01 2.58 -1.973548797e+00 -1.123716550e+00 -1.635640002e-01 2.60 -1.979098121e+00 -1.142306859e+00 -1.914895379e-01 2.62 -1.982833470e+00 -1.158469081e+00 -2.178766643e-01 2.64 -1.984797510e+00 -1.172390958e+00 -2.427706395e-01 2.66 -1.985029856e+00 -1.184253554e+00 -2.662161358e-01 2.68 -1.983567178e+00 -1.194177139e+00 -2.882572480e-01 2.70 -1.980443035e+00 -1.202251704e+00 -3.089375595e-01 2.72 -1.975687683e+00 -1.208566650e+00 -3.283000632e-01 2.74 -1.969327838e+00 -1.213210507e+00 -3.463871828e-01 2.76 -1.961386415e+00 -1.216270728e+00 -3.632408329e-01 2.78 -1.951882214e+00 -1.217833650e+00 -3.789023626e-01 2.80 -1.940829522e+00 -1.217985364e+00 -3.934125559e-01 2.82 -1.928237580e+00 -1.216810580e+00 -4.068117083e-01 2.84 -1.914117851e+00 -1.214395615e+00 -4.191395759e-01 2.86 -1.898533167e+00 -1.210848460e+00 -4.304353812e-01 2.88 -1.881575924e+00 -1.206286703e+00 -4.407378621e-01 2.90 -1.863343586e+00 -1.200826895e+00 -4.500852641e-01 2.92 -1.843939320e+00 -1.194584571e+00 -4.585153257e-01 2.94 -1.823472461e+00 -1.187674139e+00 -4.660653153e-01 2.96 -1.802058957e+00 -1.180208894e+00 -4.727720472e-01 2.98 -1.779821744e+00 -1.172301080e+00 -4.786718630e-01 3.00 -1.756891036e+00 -1.164059879e+00 -4.838006505e-01 3.02 -1.733404501e+00 -1.155561308e+00 -4.881938867e-01 3.04 -1.709507387e+00 -1.146854723e+00 -4.918866052e-01 3.06 -1.685352512e+00 -1.137987946e+00 -4.949134179e-01 3.08 -1.661100508e+00 -1.129007864e+00 -4.973085566e-01 3.10 -1.636892954e+00 -1.119955652e+00 -4.991058485e-01 3.12 -1.612758367e+00 -1.110850122e+00 -5.003387282e-01 3.14 -1.588687259e+00 -1.101702292e+00 -5.010402788e-01 3.16 -1.564667493e+00 -1.092522017e+00 -5.012432159e-01 3.18 -1.540684112e+00 -1.083317992e+00 -5.009798952e-01 3.20 -1.516719411e+00 -1.074097791e+00 -5.002823423e-01 3.22 -1.492753012e+00 -1.064867922e+00 -4.991822527e-01 3.24 -1.468761934e+00 -1.055633882e+00 -4.977109925e-01 3.26 -1.444720646e+00 -1.046400185e+00 -4.958996181e-01 3.28 -1.420601102e+00 -1.037170416e+00 -4.937788881e-01 3.30 -1.396372779e+00 -1.027947290e+00 -4.913792600e-01 3.32 -1.372002718e+00 -1.018732682e+00 -4.887309031e-01 3.34 -1.347455463e+00 -1.009527725e+00 -4.858637152e-01 3.36 -1.322709232e+00 -1.000338328e+00 -4.828073166e-01 3.38 -1.297787785e+00 -9.911813715e-01 -4.795910618e-01 3.40 -1.272724083e+00 -9.820748861e-01 -4.762440532e-01 3.42 -1.247552062e+00 -9.730363874e-01 -4.727951375e-01 3.44 -1.222306640e+00 -9.640829100e-01 -4.692729142e-01 3.46 -1.197023719e+00 -9.552310233e-01 -4.657057422e-01 3.48 -1.171740184e+00 -9.464970166e-01 -4.621218623e-01 3.50 -1.146493894e+00 -9.379016518e-01 -4.585504729e-01 3.52 -1.121323672e+00 -9.294714719e-01 -4.550158347e-01 3.54 -1.096269305e+00 -9.212332298e-01 -4.515318773e-01 3.56 -1.071371525e+00 -9.132135629e-01 -4.481037042e-01 3.58 -1.046671986e+00 -9.054389899e-01 -4.447292183e-01 3.60 -1.022212976e+00 -8.979358739e-01 -4.414006361e-01 3.62 -9.979999798e-01 -8.907254810e-01 -4.381058932e-01 3.64 -9.739694549e-01 -8.838198869e-01 -4.348299408e-01 3.66 -9.500473939e-01 -8.772298990e-01 -4.315559263e-01 3.68 -9.261571171e-01 -8.709659683e-01 -4.282662598e-01 3.70 -9.022191781e-01 -8.650185180e-01 -4.249435665e-01 3.72 -8.781513515e-01 -8.593412858e-01 -4.215715348e-01 3.74 -8.538686050e-01 -8.538835680e-01 -4.181356412e-01 3.76 -8.292830437e-01 -8.485944842e-01 -4.146237621e-01 3.78 -8.043038236e-01 -8.434229344e-01 -4.110266883e-01 3.80 -7.788370572e-01 -8.383176004e-01 -4.073385113e-01 3.82 -7.527856774e-01 -8.332269442e-01 -4.035568953e-01 3.84 -7.260493397e-01 -8.280992087e-01 -3.996832471e-01 3.86 -6.985278128e-01 -8.228829294e-01 -3.957227673e-01 3.88 -6.702470482e-01 -8.175448213e-01 -3.916843904e-01 3.90 -6.413925759e-01 -8.120735166e-01 -3.875806086e-01 3.92 -6.121651716e-01 -8.064591361e-01 -3.834271860e-01 3.94 -5.827722200e-01 -8.006919821e-01 -3.792427597e-01 3.96 -5.534298215e-01 -7.947625823e-01 -3.750483290e-01 3.98 -5.243628917e-01 -7.886616912e-01 -3.708666269e-01 4.00 -4.958050701e-01 -7.823802909e-01 -3.667213825e-01 4.02 -4.679984230e-01 -7.759094832e-01 -3.626364751e-01 4.04 -4.411929774e-01 -7.692512602e-01 -3.586349630e-01 4.06 -4.156460652e-01 -7.624379215e-01 -3.547380097e-01 4.08 -3.916213755e-01 -7.555079082e-01 -3.509636987e-01 4.10 -3.693420962e-01 -7.484979102e-01 -3.473257322e-01 4.12 -3.490156786e-01 -7.414427148e-01 -3.438320006e-01 4.14 -3.307411677e-01 -7.343531931e-01 -3.404830674e-01 4.16 -3.144285867e-01 -7.272176522e-01 -3.372705265e-01 4.18 -2.999632056e-01 -7.200230386e-01 -3.341752521e-01 4.20 -2.872141934e-01 -7.127555612e-01 -3.311655195e-01 4.22 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