# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2007--Munetoh-S-Motooka-T-Moriguchi-K-Shintani-A--Si-O # implementation = 2007--Munetoh-S--Si-O--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 O O O Si Si Si 0.02 1.523163707e+03 1.373519073e+03 1.287075281e+03 0.04 1.394159967e+03 1.276312137e+03 1.218270889e+03 0.06 1.275807940e+03 1.185713734e+03 1.153018003e+03 0.08 1.167240058e+03 1.101284461e+03 1.091137207e+03 0.10 1.067658878e+03 1.022613758e+03 1.032458025e+03 0.12 9.763314469e+02 9.493180252e+02 9.768184752e+02 0.14 8.925841028e+02 8.810388710e+02 9.240646581e+02 0.16 8.157977034e+02 8.174414663e+02 8.740503513e+02 0.18 7.454032340e+02 7.582130093e+02 8.266366325e+02 0.20 6.808777691e+02 7.030612885e+02 7.816915183e+02 0.22 6.217407585e+02 6.517133392e+02 7.390896209e+02 0.24 5.675506116e+02 6.039141875e+02 6.987118221e+02 0.26 5.179015564e+02 5.594256753e+02 6.604449626e+02 0.28 4.724207506e+02 5.180253620e+02 6.241815476e+02 0.30 4.307656253e+02 4.795054974e+02 5.898194658e+02 0.32 3.926214420e+02 4.436720613e+02 5.572617228e+02 0.34 3.576990464e+02 4.103438655e+02 5.264161877e+02 0.36 3.257328022e+02 3.793517142e+02 4.971953518e+02 0.38 2.964786920e+02 3.505376189e+02 4.695160993e+02 0.40 2.697125701e+02 3.237540647e+02 4.432994896e+02 0.42 2.452285565e+02 2.988633236e+02 4.184705498e+02 0.44 2.228375600e+02 2.757368133e+02 3.949580777e+02 0.46 2.023659201e+02 2.542544971e+02 3.726944548e+02 0.48 1.836541584e+02 2.343043233e+02 3.516154674e+02 0.50 1.665558302e+02 2.157817009e+02 3.316601384e+02 0.52 1.509364695e+02 1.985890095e+02 3.127705654e+02 0.54 1.366726177e+02 1.826351410e+02 2.948917681e+02 0.56 1.236509318e+02 1.678350715e+02 2.779715426e+02 0.58 1.117673639e+02 1.541094609e+02 2.619603234e+02 0.60 1.009264067e+02 1.413842784e+02 2.468110516e+02 0.62 9.104040058e+01 1.295904529e+02 2.324790502e+02 0.64 8.202889565e+01 1.186635462e+02 2.189219050e+02 0.66 7.381806613e+01 1.085434467e+02 2.060993519e+02 0.68 6.634017151e+01 9.917408463e+01 1.939731693e+02 0.70 5.953306139e+01 9.050316424e+01 1.825070763e+02 0.72 5.333972032e+01 8.248191478e+01 1.716666356e+02 0.74 4.770784944e+01 7.506485707e+01 1.614191612e+02 0.76 4.258948188e+01 6.820958562e+01 1.517336309e+02 0.78 3.794062935e+01 6.187656490e+01 1.425806029e+02 0.80 3.372095726e+01 5.602893906e+01 1.339321366e+02 0.82 2.989348618e+01 5.063235405e+01 1.257617176e+02 0.84 2.642431746e+01 4.565479137e+01 1.180441858e+02 0.86 2.328238107e+01 4.106641286e+01 1.107556677e+02 0.88 2.043920390e+01 3.683941553e+01 1.038735117e+02 0.90 1.786869682e+01 3.294789601e+01 9.737622664e+01 0.92 1.554695906e+01 2.936772388e+01 9.124342358e+01 0.94 1.345209844e+01 2.607642336e+01 8.545576029e+01 0.96 1.156406617e+01 2.305306272e+01 7.999488854e+01 0.98 9.864505164e+00 2.027815101e+01 7.484340405e+01 1.00 8.336610587e+00 1.773354161e+01 6.998479888e+01 1.02 6.965001827e+00 1.540234211e+01 6.540341622e+01 1.04 5.735604840e+00 1.326883014e+01 6.108440745e+01 1.06 4.635544105e+00 1.131837472e+01 5.701369125e+01 1.08 3.653043376e+00 9.537362896e+00 5.317791488e+01 1.10 2.777334535e+00 7.913131119e+00 4.956441728e+01 1.12 1.998573883e+00 6.433901235e+00 4.616119404e+01 1.14 1.307765273e+00 5.088720679e+00 4.295686416e+01 1.16 6.966895266e-01 3.867406640e+00 3.994063841e+01 1.18 1.578396221e-01 2.760493926e+00 3.710228930e+01 1.20 -3.156388016e-01 1.759186286e+00 3.443212256e+01 1.22 -7.300020693e-01 8.553109707e-01 3.192095002e+01 1.24 -1.090958611e+00 4.127630508e-02 2.956006389e+01 1.26 -1.403714985e+00 -6.899679111e-01 2.734121224e+01 1.28 -1.673018116e+00 -1.344967368e+00 2.525657582e+01 1.30 -1.903194061e+00 -1.929797747e+00 2.329874596e+01 1.32 -2.098183579e+00 -2.450096920e+00 2.146070363e+01 1.34 -2.261574764e+00 -2.911094998e+00 1.973579947e+01 1.36 -2.396632993e+00 -3.317642371e+00 1.811773496e+01 1.38 -2.506328384e+00 -3.674235873e+00 1.660054439e+01 1.40 -2.593360995e+00 -3.985043192e+00 1.517857782e+01 1.42 -2.660183926e+00 -4.253925644e+00 1.384648489e+01 1.44 -2.709024503e+00 -4.484459417e+00 1.259919941e+01 1.46 -2.741903707e+00 -4.679955386e+00 1.143192477e+01 1.48 -2.760653981e+00 -4.843477599e+00 1.034012005e+01 1.50 -2.766935551e+00 -4.977860509e+00 9.319486858e+00 1.52 -2.762251390e+00 -5.085725046e+00 8.365956793e+00 1.54 -2.747960923e+00 -5.169493611e+00 7.475679593e+00 1.56 -2.725292590e+00 -5.231404040e+00 6.645011843e+00 1.58 -2.695355348e+00 -5.273522634e+00 5.870506266e+00 1.60 -2.659149211e+00 -5.297756299e+00 5.148901563e+00 1.62 -2.617574896e+00 -5.305863862e+00 4.477112754e+00 1.64 -2.571442661e+00 -5.299466614e+00 3.852222022e+00 1.66 -2.521480386e+00 -5.280058139e+00 3.271470009e+00 1.68 -2.468340978e+00 -5.249013469e+00 2.732247569e+00 1.70 -2.412609139e+00 -5.207597606e+00 2.232087920e+00 1.72 -2.329078461e+00 -5.156973472e+00 1.768659217e+00 1.74 -2.196178590e+00 -5.098209302e+00 1.339757487e+00 1.76 -2.021404070e+00 -5.032285536e+00 9.432999284e-01 1.78 -1.813841461e+00 -4.960101226e+00 5.773185577e-01 1.80 -1.583618343e+00 -4.882480013e+00 2.399541719e-01 1.82 -1.341337386e+00 -4.800175678e+00 -7.054937522e-02 1.84 -1.097526146e+00 -4.713877317e+00 -3.558506059e-01 1.86 -8.621297362e-01 -4.624214147e+00 -6.175155727e-01 1.88 -6.440689477e-01 -4.531759984e+00 -8.570227492e-01 1.90 -4.508810922e-01 -4.437037408e+00 -1.075767669e+00 1.92 -2.884551415e-01 -4.340521626e+00 -1.275067330e+00 1.94 -1.608669728e-01 -4.242644080e+00 -1.456164363e+00 1.96 -7.031499981e-02 -4.143795784e+00 -1.620231000e+00 1.98 -1.715142566e-02 -4.044330438e+00 -1.768372825e+00 2.00 0.000000000e+00 -3.944567312e+00 -1.901632342e+00 2.02 0.000000000e+00 -3.844793934e+00 -2.020992346e+00 2.04 0.000000000e+00 -3.745268574e+00 -2.127379136e+00 2.06 0.000000000e+00 -3.646222566e+00 -2.221665549e+00 2.08 0.000000000e+00 -3.515910051e+00 -2.304673839e+00 2.10 0.000000000e+00 -3.316745734e+00 -2.377178413e+00 2.12 0.000000000e+00 -3.058863349e+00 -2.439908421e+00 2.14 0.000000000e+00 -2.754671909e+00 -2.493550206e+00 2.16 0.000000000e+00 -2.417947557e+00 -2.538749637e+00 2.18 0.000000000e+00 -2.063136922e+00 -2.576114310e+00 2.20 0.000000000e+00 -1.704672318e+00 -2.606215643e+00 2.22 0.000000000e+00 -1.356329629e+00 -2.629590857e+00 2.24 0.000000000e+00 -1.030655673e+00 -2.646744850e+00 2.26 0.000000000e+00 -7.384867529e-01 -2.658151981e+00 2.28 0.000000000e+00 -4.885744496e-01 -2.664257752e+00 2.30 0.000000000e+00 -2.873286546e-01 -2.665480409e+00 2.32 0.000000000e+00 -1.386817846e-01 -2.662212451e+00 2.34 0.000000000e+00 -4.407230849e-02 -2.654822067e+00 2.36 0.000000000e+00 -2.540400603e-03 -2.643654491e+00 2.38 0.000000000e+00 0.000000000e+00 -2.629033289e+00 2.40 0.000000000e+00 0.000000000e+00 -2.611261576e+00 2.42 0.000000000e+00 0.000000000e+00 -2.590623169e+00 2.44 0.000000000e+00 0.000000000e+00 -2.567383677e+00 2.46 0.000000000e+00 0.000000000e+00 -2.541791537e+00 2.48 0.000000000e+00 0.000000000e+00 -2.514078992e+00 2.50 0.000000000e+00 0.000000000e+00 -2.484463012e+00 2.52 0.000000000e+00 0.000000000e+00 -2.426342613e+00 2.54 0.000000000e+00 0.000000000e+00 -2.315693782e+00 2.56 0.000000000e+00 0.000000000e+00 -2.158295865e+00 2.58 0.000000000e+00 0.000000000e+00 -1.961910747e+00 2.60 0.000000000e+00 0.000000000e+00 -1.735847473e+00 2.62 0.000000000e+00 0.000000000e+00 -1.490468155e+00 2.64 0.000000000e+00 0.000000000e+00 -1.236662043e+00 2.66 0.000000000e+00 0.000000000e+00 -9.853149037e-01 2.68 0.000000000e+00 0.000000000e+00 -7.467997675e-01 2.70 0.000000000e+00 0.000000000e+00 -5.305128169e-01 2.72 0.000000000e+00 0.000000000e+00 -3.444747953e-01 2.74 0.000000000e+00 0.000000000e+00 -1.950141705e-01 2.76 0.000000000e+00 0.000000000e+00 -8.654351776e-02 2.78 0.000000000e+00 0.000000000e+00 -2.143553534e-02 2.80 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.82 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.84 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.86 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.88 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.90 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.92 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.94 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.96 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.98 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.00 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.02 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.04 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.06 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.08 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.10 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.12 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.14 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.16 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.18 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.20 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.22 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.24 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.26 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.28 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.30 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.32 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.34 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.36 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.38 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.40 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.42 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.44 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.46 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.48 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.50 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.52 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.54 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.56 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.58 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.60 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.62 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.64 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.66 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.68 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.70 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.72 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.74 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.76 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.78 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.80 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.82 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.84 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.86 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.88 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.90 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.92 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.94 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.96 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.98 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.00 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.02 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.04 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.06 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.08 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.10 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.12 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.14 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.16 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.18 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.20 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.22 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.24 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.26 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.28 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.30 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.32 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.34 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.36 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.38 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.40 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.42 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.44 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.46 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.48 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.50 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.52 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.54 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.56 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.58 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.60 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.62 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.64 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.66 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.68 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.70 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.72 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.74 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.76 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.78 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.80 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.82 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.84 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.86 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.88 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.90 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.92 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.94 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.96 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.98 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.00 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.02 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