# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2003--Lee-B-J-Shim-J-H-Baskes-M-I--Pb # implementation = 2003--Lee-B-J--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 Pb Pb 0.02 1.172433319e+03 0.04 1.122077044e+03 0.06 1.073803285e+03 0.08 1.027528017e+03 0.10 9.831705488e+02 0.12 9.406533906e+02 0.14 8.999021292e+02 0.16 8.608453076e+02 0.18 8.234143090e+02 0.20 7.875432454e+02 0.22 7.531688500e+02 0.24 7.202303751e+02 0.26 6.886694927e+02 0.28 6.584301992e+02 0.30 6.294587246e+02 0.32 6.017034442e+02 0.34 5.751147942e+02 0.36 5.496451910e+02 0.38 5.252489528e+02 0.40 5.018822248e+02 0.42 4.795029071e+02 0.44 4.580705859e+02 0.46 4.375464665e+02 0.48 4.178933096e+02 0.50 3.990753699e+02 0.52 3.810583371e+02 0.54 3.638092790e+02 0.56 3.472965874e+02 0.58 3.314899254e+02 0.60 3.163601769e+02 0.62 3.018793989e+02 0.64 2.880207744e+02 0.66 2.747585682e+02 0.68 2.620680836e+02 0.70 2.499256214e+02 0.72 2.383084407e+02 0.74 2.271947198e+02 0.76 2.165635209e+02 0.78 2.063947540e+02 0.80 1.966691437e+02 0.82 1.873681966e+02 0.84 1.784741700e+02 0.86 1.699700425e+02 0.88 1.618394844e+02 0.90 1.540668311e+02 0.92 1.466370558e+02 0.94 1.395357441e+02 0.96 1.327490701e+02 0.98 1.262637721e+02 1.00 1.200671306e+02 1.02 1.141469464e+02 1.04 1.084915195e+02 1.06 1.030896296e+02 1.08 9.793051645e+01 1.10 9.300386153e+01 1.12 8.829977030e+01 1.14 8.380875517e+01 1.16 7.952171912e+01 1.18 7.542993997e+01 1.20 7.152505531e+01 1.22 6.779904799e+01 1.24 6.424423219e+01 1.26 6.085324006e+01 1.28 5.761900888e+01 1.30 5.453476873e+01 1.32 5.159403062e+01 1.34 4.879057518e+01 1.36 4.611844169e+01 1.38 4.357191760e+01 1.40 4.114552847e+01 1.42 3.883402834e+01 1.44 3.663239041e+01 1.46 3.453579810e+01 1.48 3.253963657e+01 1.50 3.063948447e+01 1.52 2.883110602e+01 1.54 2.711044351e+01 1.56 2.547360996e+01 1.58 2.391688220e+01 1.60 2.243669414e+01 1.62 2.102963036e+01 1.64 1.969241990e+01 1.66 1.842193040e+01 1.68 1.721516234e+01 1.70 1.606924366e+01 1.72 1.498142445e+01 1.74 1.394907196e+01 1.76 1.296966578e+01 1.78 1.204079319e+01 1.80 1.116014471e+01 1.82 1.032550987e+01 1.84 9.534773080e+00 1.86 8.785909715e+00 1.88 8.076982359e+00 1.90 7.406137172e+00 1.92 6.771600426e+00 1.94 6.171675183e+00 1.96 5.604738089e+00 1.98 5.069236316e+00 2.00 4.563684626e+00 2.02 4.086662544e+00 2.04 3.636811657e+00 2.06 3.212833017e+00 2.08 2.813484656e+00 2.10 2.437579193e+00 2.12 2.083981546e+00 2.14 1.751606742e+00 2.16 1.439417803e+00 2.18 1.146423729e+00 2.20 8.716775653e-01 2.22 6.142745407e-01 2.24 3.733502883e-01 2.26 1.480791407e-01 2.28 -6.232750857e-02 2.30 -2.586227747e-01 2.32 -4.415257837e-01 2.34 -6.117231146e-01 2.36 -7.698701827e-01 2.38 -9.165925634e-01 2.40 -1.052487260e+00 2.42 -1.178123923e+00 2.44 -1.294046016e+00 2.46 -1.400771928e+00 2.48 -1.498796053e+00 2.50 -1.588589806e+00 2.52 -1.670602616e+00 2.54 -1.745262858e+00 2.56 -1.812978764e+00 2.58 -1.874139283e+00 2.60 -1.929114909e+00 2.62 -1.978258478e+00 2.64 -2.021905928e+00 2.66 -2.060377025e+00 2.68 -2.093976065e+00 2.70 -2.122992541e+00 2.72 -2.147701785e+00 2.74 -2.168365583e+00 2.76 -2.185232766e+00 2.78 -2.198539772e+00 2.80 -2.208511192e+00 2.82 -2.215360285e+00 2.84 -2.219289481e+00 2.86 -2.220490858e+00 2.88 -2.219146600e+00 2.90 -2.215429442e+00 2.92 -2.209503088e+00 2.94 -2.201522623e+00 2.96 -2.191634902e+00 2.98 -2.179978926e+00 3.00 -2.166686205e+00 3.02 -2.151881104e+00 3.04 -2.135681180e+00 3.06 -2.118197501e+00 3.08 -2.099534961e+00 3.10 -2.079792575e+00 3.12 -2.059063767e+00 3.14 -2.037436648e+00 3.16 -2.014994283e+00 3.18 -1.991814945e+00 3.20 -1.967972364e+00 3.22 -1.943535962e+00 3.24 -1.918571081e+00 3.26 -1.893139204e+00 3.28 -1.867298160e+00 3.30 -1.841102326e+00 3.32 -1.814602818e+00 3.34 -1.787847671e+00 3.36 -1.760882015e+00 3.38 -1.733748237e+00 3.40 -1.706486137e+00 3.42 -1.679133073e+00 3.44 -1.651724102e+00 3.46 -1.624292106e+00 3.48 -1.596867914e+00 3.50 -1.569480416e+00 3.52 -1.542156665e+00 3.54 -1.514921978e+00 3.56 -1.487800024e+00 3.58 -1.460812907e+00 3.60 -1.433981245e+00 3.62 -1.407324239e+00 3.64 -1.380859743e+00 3.66 -1.354604318e+00 3.68 -1.328573299e+00 3.70 -1.302780840e+00 3.72 -1.277239970e+00 3.74 -1.251962638e+00 3.76 -1.226959762e+00 3.78 -1.202241269e+00 3.80 -1.177816141e+00 3.82 -1.153692460e+00 3.84 -1.129877441e+00 3.86 -1.106377482e+00 3.88 -1.083198197e+00 3.90 -1.060344461e+00 3.92 -1.037820445e+00 3.94 -1.015629659e+00 3.96 -9.937749866e-01 3.98 -9.722587233e-01 4.00 -9.510826141e-01 4.02 -9.302478873e-01 4.04 -9.097552892e-01 4.06 -8.896051167e-01 4.08 -8.697972487e-01 4.10 -8.503311755e-01 4.12 -8.312060278e-01 4.14 -8.124206029e-01 4.16 -7.939733899e-01 4.18 -7.758625937e-01 4.20 -7.580861569e-01 4.22 -7.406417808e-01 4.24 -7.235269449e-01 4.26 -7.067389251e-01 4.28 -6.902748111e-01 4.30 -6.741315220e-01 4.32 -6.583058221e-01 4.34 -6.427943343e-01 4.36 -6.275935540e-01 4.38 -6.126998611e-01 4.40 -5.981095325e-01 4.42 -5.838187524e-01 4.44 -5.698236231e-01 4.46 -5.561201750e-01 4.48 -5.427043756e-01 4.50 -5.295721381e-01 4.52 -5.167193298e-01 4.54 -5.041417796e-01 4.56 -4.918352855e-01 4.58 -4.797956210e-01 4.60 -4.680185417e-01 4.62 -4.564997910e-01 4.64 -4.452351060e-01 4.66 -4.342202225e-01 4.68 -4.234508797e-01 4.70 -4.129228252e-01 4.72 -4.026318186e-01 4.74 -3.925736359e-01 4.76 -3.827440732e-01 4.78 -3.731389495e-01 4.80 -3.637541105e-01 4.82 -3.545854312e-01 4.84 -3.456288185e-01 4.86 -3.368802136e-01 4.88 -3.283355947e-01 4.90 -3.199909786e-01 4.92 -3.118424227e-01 4.94 -3.038860269e-01 4.96 -2.961179349e-01 4.98 -2.885343358e-01 5.00 -2.811314651e-01 5.02 -2.739056062e-01 5.04 -2.668530911e-01 5.06 -2.599703013e-01 5.08 -2.532536687e-01 5.10 -2.466996762e-01 5.12 -2.403048580e-01 5.14 -2.340658006e-01 5.16 -2.279791427e-01 5.18 -2.220415754e-01 5.20 -2.162498432e-01 5.22 -2.106007430e-01 5.24 -2.050911250e-01 5.26 -1.997178926e-01 5.28 -1.944780020e-01 5.30 -1.893684623e-01 5.32 -1.843863353e-01 5.34 -1.795287354e-01 5.36 -1.747928292e-01 5.38 -1.701758352e-01 5.40 -1.656750237e-01 5.42 -1.608841234e-01 5.44 -1.507519651e-01 5.46 -1.227359684e-01 5.48 -6.361798691e-02 5.50 0.000000000e+00 5.52 0.000000000e+00 5.54 0.000000000e+00 5.56 0.000000000e+00 5.58 0.000000000e+00 5.60 0.000000000e+00 5.62 0.000000000e+00 5.64 0.000000000e+00 5.66 0.000000000e+00 5.68 0.000000000e+00 5.70 0.000000000e+00 5.72 0.000000000e+00 5.74 0.000000000e+00 5.76 0.000000000e+00 5.78 0.000000000e+00 5.80 0.000000000e+00 5.82 0.000000000e+00 5.84 0.000000000e+00 5.86 0.000000000e+00 5.88 0.000000000e+00 5.90 0.000000000e+00 5.92 0.000000000e+00 5.94 0.000000000e+00 5.96 0.000000000e+00 5.98 0.000000000e+00 6.00 0.000000000e+00 6.02 0.000000000e+00 6.04 0.000000000e+00 6.06 0.000000000e+00 6.08 0.000000000e+00 6.10 0.000000000e+00 6.12 0.000000000e+00 6.14 0.000000000e+00 6.16 0.000000000e+00 6.18 0.000000000e+00 6.20 0.000000000e+00 6.22 0.000000000e+00 6.24 0.000000000e+00 6.26 0.000000000e+00 6.28 0.000000000e+00 6.30 0.000000000e+00 6.32 0.000000000e+00 6.34 0.000000000e+00 6.36 0.000000000e+00 6.38 0.000000000e+00 6.40 0.000000000e+00 6.42 0.000000000e+00 6.44 0.000000000e+00 6.46 0.000000000e+00 6.48 0.000000000e+00 6.50 0.000000000e+00 6.52 0.000000000e+00 6.54 0.000000000e+00 6.56 0.000000000e+00 6.58 0.000000000e+00 6.60 0.000000000e+00 6.62 0.000000000e+00 6.64 0.000000000e+00 6.66 0.000000000e+00 6.68 0.000000000e+00 6.70 0.000000000e+00 6.72 0.000000000e+00 6.74 0.000000000e+00 6.76 0.000000000e+00 6.78 0.000000000e+00 6.80 0.000000000e+00 6.82 0.000000000e+00 6.84 0.000000000e+00 6.86 0.000000000e+00 6.88 0.000000000e+00 6.90 0.000000000e+00 6.92 0.000000000e+00 6.94 0.000000000e+00 6.96 0.000000000e+00 6.98 0.000000000e+00 7.00 0.000000000e+00 7.02 0.000000000e+00 7.04 0.000000000e+00 7.06 0.000000000e+00 7.08 0.000000000e+00 7.10 0.000000000e+00 7.12 0.000000000e+00 7.14 0.000000000e+00 7.16 0.000000000e+00 7.18 0.000000000e+00 7.20 0.000000000e+00 7.22 0.000000000e+00 7.24 0.000000000e+00 7.26 0.000000000e+00 7.28 0.000000000e+00 7.30 0.000000000e+00 7.32 0.000000000e+00 7.34 0.000000000e+00 7.36 0.000000000e+00 7.38 0.000000000e+00 7.40 0.000000000e+00 7.42 0.000000000e+00 7.44 0.000000000e+00 7.46 0.000000000e+00 7.48 0.000000000e+00 7.50 0.000000000e+00 7.52 0.000000000e+00 7.54 0.000000000e+00 7.56 0.000000000e+00 7.58 0.000000000e+00 7.60 0.000000000e+00 7.62 0.000000000e+00 7.64 0.000000000e+00 7.66 0.000000000e+00 7.68 0.000000000e+00 7.70 0.000000000e+00 7.72 0.000000000e+00 7.74 0.000000000e+00 7.76 0.000000000e+00 7.78 0.000000000e+00 7.80 0.000000000e+00 7.82 0.000000000e+00 7.84 0.000000000e+00 7.86 0.000000000e+00 7.88 0.000000000e+00 7.90 0.000000000e+00 7.92 0.000000000e+00 7.94 0.000000000e+00 7.96 0.000000000e+00 7.98 0.000000000e+00 8.00 0.000000000e+00 8.02 0.000000000e+00 8.04 0.000000000e+00 8.06 0.000000000e+00 8.08 0.000000000e+00 8.10 0.000000000e+00 8.12 0.000000000e+00 8.14 0.000000000e+00 8.16 0.000000000e+00 8.18 0.000000000e+00 8.20 0.000000000e+00 8.22 0.000000000e+00 8.24 0.000000000e+00 8.26 0.000000000e+00 8.28 0.000000000e+00 8.30 0.000000000e+00 8.32 0.000000000e+00 8.34 0.000000000e+00 8.36 0.000000000e+00 8.38 0.000000000e+00 8.40 0.000000000e+00 8.42 0.000000000e+00 8.44 0.000000000e+00 8.46 0.000000000e+00 8.48 0.000000000e+00 8.50 0.000000000e+00 8.52 0.000000000e+00 8.54 0.000000000e+00 8.56 0.000000000e+00 8.58 0.000000000e+00 8.60 0.000000000e+00 8.62 0.000000000e+00 8.64 0.000000000e+00 8.66 0.000000000e+00 8.68 0.000000000e+00 8.70 0.000000000e+00 8.72 0.000000000e+00 8.74 0.000000000e+00 8.76 0.000000000e+00 8.78 0.000000000e+00 8.80 0.000000000e+00 8.82 0.000000000e+00 8.84 0.000000000e+00 8.86 0.000000000e+00 8.88 0.000000000e+00 8.90 0.000000000e+00 8.92 0.000000000e+00 8.94 0.000000000e+00 8.96 0.000000000e+00 8.98 0.000000000e+00 9.00 0.000000000e+00 9.02 0.000000000e+00 9.04 0.000000000e+00 9.06 0.000000000e+00 9.08 0.000000000e+00 9.10 0.000000000e+00 9.12 0.000000000e+00 9.14 0.000000000e+00 9.16 0.000000000e+00 9.18 0.000000000e+00 9.20 0.000000000e+00 9.22 0.000000000e+00 9.24 0.000000000e+00 9.26 0.000000000e+00 9.28 0.000000000e+00 9.30 0.000000000e+00 9.32 0.000000000e+00 9.34 0.000000000e+00 9.36 0.000000000e+00 9.38 0.000000000e+00 9.40 0.000000000e+00 9.42 0.000000000e+00 9.44 0.000000000e+00 9.46 0.000000000e+00 9.48 0.000000000e+00 9.50 0.000000000e+00 9.52 0.000000000e+00 9.54 0.000000000e+00 9.56 0.000000000e+00 9.58 0.000000000e+00 9.60 0.000000000e+00 9.62 0.000000000e+00 9.64 0.000000000e+00 9.66 0.000000000e+00 9.68 0.000000000e+00 9.70 0.000000000e+00 9.72 0.000000000e+00 9.74 0.000000000e+00 9.76 0.000000000e+00 9.78 0.000000000e+00 9.80 0.000000000e+00 9.82 0.000000000e+00 9.84 0.000000000e+00 9.86 0.000000000e+00 9.88 0.000000000e+00 9.90 0.000000000e+00 9.92 0.000000000e+00 9.94 0.000000000e+00 9.96 0.000000000e+00 9.98 0.000000000e+00 10.00 0.000000000e+00