# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 1987--Biswas-R-Hamann-D-R--Si # implementation = ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 # 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 2024-11-27 r Si Si 0.02 3.524669283e+01 0.04 3.521193801e+01 0.06 3.515408050e+01 0.08 3.507321385e+01 0.10 3.496946868e+01 0.12 3.484301239e+01 0.14 3.469404874e+01 0.16 3.452281737e+01 0.18 3.432959318e+01 0.20 3.411468567e+01 0.22 3.387843819e+01 0.24 3.362122712e+01 0.26 3.334346092e+01 0.28 3.304557917e+01 0.30 3.272805149e+01 0.32 3.239137643e+01 0.34 3.203608027e+01 0.36 3.166271576e+01 0.38 3.127186081e+01 0.40 3.086411715e+01 0.42 3.044010888e+01 0.44 3.000048105e+01 0.46 2.954589812e+01 0.48 2.907704249e+01 0.50 2.859461288e+01 0.52 2.809932279e+01 0.54 2.759189886e+01 0.56 2.707307928e+01 0.58 2.654361211e+01 0.60 2.600425368e+01 0.62 2.545576695e+01 0.64 2.489891982e+01 0.66 2.433448358e+01 0.68 2.376323121e+01 0.70 2.318593584e+01 0.72 2.260336913e+01 0.74 2.201629973e+01 0.76 2.142549179e+01 0.78 2.083170338e+01 0.80 2.023568512e+01 0.82 1.963817874e+01 0.84 1.903991570e+01 0.86 1.844161586e+01 0.88 1.784398623e+01 0.90 1.724771976e+01 0.92 1.665349414e+01 0.94 1.606197073e+01 0.96 1.547379349e+01 0.98 1.488958803e+01 1.00 1.430996067e+01 1.02 1.373549757e+01 1.04 1.316676398e+01 1.06 1.260430352e+01 1.08 1.204863747e+01 1.10 1.150026429e+01 1.12 1.095965899e+01 1.14 1.042727278e+01 1.16 9.903532648e+00 1.18 9.388841043e+00 1.20 8.883575661e+00 1.22 8.388089255e+00 1.24 7.902709528e+00 1.26 7.427739086e+00 1.28 6.963455457e+00 1.30 6.510111169e+00 1.32 6.067933886e+00 1.34 5.637126607e+00 1.36 5.217867912e+00 1.38 4.810312270e+00 1.40 4.414590392e+00 1.42 4.030809633e+00 1.44 3.659054447e+00 1.46 3.299386874e+00 1.48 2.951847078e+00 1.50 2.616453919e+00 1.52 2.293205559e+00 1.54 1.982080104e+00 1.56 1.683036276e+00 1.58 1.396014106e+00 1.60 1.120935662e+00 1.62 8.577057865e-01 1.64 6.062128618e-01 1.66 3.663295872e-01 1.68 1.379137697e-01 1.70 -7.919087454e-02 1.72 -2.851539107e-01 1.74 -4.801573708e-01 1.76 -6.643949364e-01 1.78 -8.380711210e-01 1.80 -1.001400454e+00 1.82 -1.154606671e+00 1.84 -1.297921906e+00 1.86 -1.431585898e+00 1.88 -1.555845203e+00 1.90 -1.670952423e+00 1.92 -1.777165442e+00 1.94 -1.874746689e+00 1.96 -1.963962406e+00 1.98 -2.045081944e+00 2.00 -2.118377073e+00 2.02 -2.184121317e+00 2.04 -2.242589313e+00 2.06 -2.294056183e+00 2.08 -2.338796944e+00 2.10 -2.377085935e+00 2.12 -2.409196268e+00 2.14 -2.435399312e+00 2.16 -2.455964195e+00 2.18 -2.471157341e+00 2.20 -2.481242027e+00 2.22 -2.486477971e+00 2.24 -2.487120948e+00 2.26 -2.483422427e+00 2.28 -2.475629244e+00 2.30 -2.463983293e+00 2.32 -2.448721248e+00 2.34 -2.430074311e+00 2.36 -2.408267984e+00 2.38 -2.383521865e+00 2.40 -2.356049473e+00 2.42 -2.326058092e+00 2.44 -2.293748639e+00 2.46 -2.259315558e+00 2.48 -2.222946730e+00 2.50 -2.184823409e+00 2.52 -2.145120177e+00 2.54 -2.104004916e+00 2.56 -2.061638797e+00 2.58 -2.018176294e+00 2.60 -1.973765209e+00 2.62 -1.928546710e+00 2.64 -1.882655391e+00 2.66 -1.836219340e+00 2.68 -1.789360222e+00 2.70 -1.742193377e+00 2.72 -1.694827923e+00 2.74 -1.647366874e+00 2.76 -1.599907266e+00 2.78 -1.552540292e+00 2.80 -1.505351440e+00 2.82 -1.458420650e+00 2.84 -1.411822460e+00 2.86 -1.365626171e+00 2.88 -1.319896013e+00 2.90 -1.274691307e+00 2.92 -1.230066642e+00 2.94 -1.186072047e+00 2.96 -1.142753164e+00 2.98 -1.100151425e+00 3.00 -1.058304231e+00 3.02 -1.017245122e+00 3.04 -9.770039607e-01 3.06 -9.376070972e-01 3.08 -8.990775480e-01 3.10 -8.614351622e-01 3.12 -8.246967895e-01 3.14 -7.888764432e-01 3.16 -7.539854605e-01 3.18 -7.200326583e-01 3.20 -6.870244843e-01 3.22 -6.549651643e-01 3.24 -6.238568435e-01 3.26 -5.936997230e-01 3.28 -5.644921908e-01 3.30 -5.362309466e-01 3.32 -5.089111215e-01 3.34 -4.825263905e-01 3.36 -4.570690797e-01 3.38 -4.325302669e-01 3.40 -4.088998762e-01 3.42 -3.861667658e-01 3.44 -3.643188101e-01 3.46 -3.433429755e-01 3.48 -3.232253908e-01 3.50 -3.039514111e-01 3.52 -2.855056769e-01 3.54 -2.678721686e-01 3.56 -2.510342554e-01 3.58 -2.349747411e-01 3.60 -2.196759053e-01 3.62 -2.051195427e-01 3.64 -1.912869988e-01 3.66 -1.781592045e-01 3.68 -1.657167095e-01 3.70 -1.539397145e-01 3.72 -1.428081042e-01 3.74 -1.323014804e-01 3.76 -1.223991966e-01 3.78 -1.130803943e-01 3.80 -1.043240407e-01 3.82 -9.610896959e-02 3.84 -8.841392394e-02 3.86 -8.121760165e-02 3.88 -7.449870341e-02 3.90 -6.823598287e-02 3.92 -6.240829892e-02 3.94 -5.699466934e-02 3.96 -5.197432556e-02 3.98 -4.732676774e-02 4.00 -4.303181956e-02 4.02 -3.906968203e-02 4.04 -3.542098551e-02 4.06 -3.206683932e-02 4.08 -2.898887811e-02 4.10 -2.616930454e-02 4.12 -2.359092751e-02 4.14 -2.123719561e-02 4.16 -1.909222547e-02 4.18 -1.714082454e-02 4.20 -1.536850846e-02 4.22 -1.376151271e-02 4.24 -1.230679885e-02 4.26 -1.099205543e-02 4.28 -9.805693802e-03 4.30 -8.736839339e-03 4.32 -7.775318255e-03 4.34 -6.911640668e-03 4.36 -6.136980274e-03 4.38 -5.443151178e-03 4.40 -4.822582361e-03 4.42 -4.268290290e-03 4.44 -3.773850125e-03 4.46 -3.333365983e-03 4.48 -2.941440662e-03 4.50 -2.593145192e-03 4.52 -2.283988554e-03 4.54 -2.009887846e-03 4.56 -1.767139151e-03 4.58 -1.552389303e-03 4.60 -1.362608721e-03 4.62 -1.195065438e-03 4.64 -1.047300419e-03 4.66 -9.171042375e-04 4.68 -8.024951356e-04 4.70 -7.016984957e-04 4.72 -6.131277082e-04 4.74 -5.353664163e-04 4.76 -4.671521015e-04 4.78 -4.073609613e-04 4.80 -3.549940257e-04 4.82 -3.091644500e-04 4.84 -2.690859182e-04 4.86 -2.340620908e-04 4.88 -2.034770268e-04 4.90 -1.767865116e-04 4.92 -1.535102245e-04 4.94 -1.332246781e-04 4.96 -1.155568697e-04 4.98 -1.001785807e-04 5.00 -8.680127068e-05 5.02 -7.517151016e-05 5.04 -6.506690299e-05 5.06 -5.629245154e-05 5.08 -4.867732150e-05 5.10 -4.207196670e-05 5.12 -3.634557721e-05 5.14 -3.138381760e-05 5.16 -2.708682478e-05 5.18 -2.336743774e-05 5.20 -2.014963425e-05 5.22 -1.736715181e-05 5.24 -1.496227239e-05 5.26 -1.288475266e-05 5.28 -1.109088315e-05 5.30 -9.542661707e-06 5.32 -8.207067877e-06 5.34 -7.055426529e-06 5.36 -6.062850228e-06 5.38 -5.207750971e-06 5.40 -4.471413026e-06 5.42 -3.837619497e-06 5.44 -3.292326121e-06 5.46 -2.823376502e-06 5.48 -2.420253721e-06 5.50 -2.073863801e-06 5.52 -1.776347083e-06 5.54 -1.520914007e-06 5.56 -1.301702251e-06 5.58 -1.113652499e-06 5.60 -9.524005053e-07 5.62 -8.141833488e-07 5.64 -6.957580669e-07 5.66 -5.943310789e-07 5.68 -5.074969946e-07 5.70 -4.331855941e-07 5.72 -3.696159098e-07 5.74 -3.152564809e-07 5.76 -2.687909684e-07 5.78 -2.290884239e-07 5.80 -1.951775926e-07 5.82 -1.662247177e-07 5.84 -1.415143749e-07 5.86 -1.204329346e-07 5.88 -1.024542953e-07 5.90 -8.712758488e-08 5.92 -7.406656121e-08 5.94 -6.294048244e-08 5.96 -5.346624671e-08 5.98 -4.540162768e-08 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