# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2015--Elliott-R-S-Akerson-A--Fr # implementation = LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 # 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 Fr Fr 0.02 3.578343117e+28 0.04 8.736189249e+24 0.06 6.733283876e+22 0.08 2.132858703e+21 0.10 1.465689340e+20 0.12 1.643868133e+19 0.14 2.585267585e+18 0.16 5.207174560e+17 0.18 1.266986148e+17 0.20 3.578343093e+16 0.22 1.140170380e+16 0.24 4.013349859e+15 0.26 1.535895755e+15 0.28 6.311688138e+14 0.30 2.757952872e+14 0.32 1.271282716e+14 0.34 6.141788502e+13 0.36 3.093227229e+13 0.38 1.616734246e+13 0.40 8.736185630e+12 0.42 4.864634365e+12 0.44 2.783617081e+12 0.46 1.632854671e+12 0.48 9.798205495e+11 0.50 6.003454050e+11 0.52 3.749738114e+11 0.54 2.384051991e+11 0.56 1.540934754e+11 0.58 1.011356649e+11 0.60 6.733252097e+10 0.62 4.542962584e+10 0.64 3.103696329e+10 0.66 2.145413809e+10 0.68 1.499445321e+10 0.70 1.058913001e+10 0.72 7.551719524e+09 0.74 5.435682461e+09 0.76 3.947029351e+09 0.78 2.889993082e+09 0.80 2.132802143e+09 0.82 1.585850869e+09 0.84 1.187613327e+09 0.86 8.954528850e+08 0.88 6.795625858e+08 0.90 5.189296282e+08 0.92 3.986220893e+08 0.94 3.079479921e+08 0.96 2.391953553e+08 0.98 1.867626816e+08 1.00 1.465541070e+08 1.02 1.155554383e+08 1.04 9.153480577e+07 1.06 7.282981742e+07 1.08 5.819519677e+07 1.10 4.669300985e+07 1.12 3.761308294e+07 1.14 3.041496141e+07 1.16 2.468533390e+07 1.18 2.010662715e+07 1.20 1.643371580e+07 1.22 1.347656080e+07 1.24 1.108720226e+07 1.26 9.149967515e+06 1.28 7.574065018e+06 1.30 6.287957406e+06 1.32 5.235067561e+06 1.34 4.370487964e+06 1.36 3.658448533e+06 1.38 3.070360343e+06 1.40 2.583298407e+06 1.42 2.178820546e+06 1.44 1.842044560e+06 1.46 1.560924647e+06 1.48 1.325682100e+06 1.50 1.128355894e+06 1.52 9.624467553e+05 1.54 8.226343746e+05 1.56 7.045520505e+05 1.58 6.046065497e+05 1.60 5.198336983e+05 1.62 4.477822850e+05 1.64 3.864204673e+05 1.66 3.340601146e+05 1.68 2.892954901e+05 1.70 2.509534254e+05 1.72 2.180527331e+05 1.74 1.897710626e+05 1.76 1.654177705e+05 1.78 1.444116615e+05 1.80 1.262626836e+05 1.82 1.105568429e+05 1.84 9.694374289e+04 1.86 8.512627070e+04 1.88 7.485204275e+04 1.90 6.590629449e+04 1.92 5.810595932e+04 1.94 5.129472779e+04 1.96 4.533891709e+04 1.98 4.012401151e+04 2.00 3.555175942e+04 2.02 3.153773302e+04 2.04 2.800927343e+04 2.06 2.490375728e+04 2.08 2.216713206e+04 2.10 1.975267649e+04 2.12 1.761994968e+04 2.14 1.573389883e+04 2.16 1.406410048e+04 2.18 1.258411422e+04 2.20 1.127093143e+04 2.22 1.010450443e+04 2.24 9.067343583e+03 2.26 8.144172212e+03 2.28 7.321630521e+03 2.30 6.588021260e+03 2.32 5.933090938e+03 2.34 5.347841369e+03 2.36 4.824367143e+03 2.38 4.355715262e+03 2.40 3.935763780e+03 2.42 3.559116738e+03 2.44 3.221013098e+03 2.46 2.917247715e+03 2.48 2.644102675e+03 2.50 2.398287577e+03 2.52 2.176887525e+03 2.54 1.977317793e+03 2.56 1.797284258e+03 2.58 1.634748828e+03 2.60 1.487899218e+03 2.62 1.355122472e+03 2.64 1.234981769e+03 2.66 1.126196071e+03 2.68 1.027622254e+03 2.70 9.382393926e+02 2.72 8.571349406e+02 2.74 7.834925564e+02 2.76 7.165813705e+02 2.78 6.557465160e+02 2.80 6.004007654e+02 2.82 5.500171385e+02 2.84 5.041223612e+02 2.86 4.622910742e+02 2.88 4.241406999e+02 2.90 3.893268896e+02 2.92 3.575394812e+02 2.94 3.284989084e+02 2.96 3.019530069e+02 2.98 2.776741729e+02 3.00 2.554568322e+02 3.02 2.351151843e+02 3.04 2.164811898e+02 3.06 1.994027748e+02 3.08 1.837422260e+02 3.10 1.693747558e+02 3.12 1.561872197e+02 3.14 1.440769666e+02 3.16 1.329508097e+02 3.18 1.227241039e+02 3.20 1.133199173e+02 3.22 1.046682882e+02 3.24 9.670555719e+01 3.26 8.937376708e+01 3.28 8.262012266e+01 3.30 7.639650472e+01 3.32 7.065903227e+01 3.34 6.536766798e+01 3.36 6.048586227e+01 3.38 5.598023229e+01 3.40 5.182027196e+01 3.42 4.797809004e+01 3.44 4.442817332e+01 3.46 4.114717247e+01 3.48 3.811370815e+01 3.50 3.530819553e+01 3.52 3.271268518e+01 3.54 3.031071892e+01 3.56 2.808719903e+01 3.58 2.602826951e+01 3.60 2.412120836e+01 3.62 2.235432959e+01 3.64 2.071689425e+01 3.66 1.919902947e+01 3.68 1.779165478e+01 3.70 1.648641506e+01 3.72 1.527561943e+01 3.74 1.415218565e+01 3.76 1.310958929e+01 3.78 1.214181749e+01 3.80 1.124332668e+01 3.82 1.040900402e+01 3.84 9.634132184e+00 3.86 8.914357107e+00 3.88 8.245658586e+00 3.90 7.624323336e+00 3.92 7.046920341e+00 3.94 6.510278301e+00 3.96 6.011464958e+00 3.98 5.547768168e+00 4.00 5.116678540e+00 4.02 4.715873518e+00 4.04 4.343202780e+00 4.06 3.996674829e+00 4.08 3.674444689e+00 4.10 3.374802601e+00 4.12 3.096163629e+00 4.14 2.837058118e+00 4.16 2.596122905e+00 4.18 2.372093241e+00 4.20 2.163795356e+00 4.22 1.970139613e+00 4.24 1.790114198e+00 4.26 1.622779319e+00 4.28 1.467261841e+00 4.30 1.322750356e+00 4.32 1.188490630e+00 4.34 1.063781393e+00 4.36 9.479704732e-01 4.38 8.404512061e-01 4.40 7.406591339e-01 4.42 6.480689478e-01 4.44 5.621916650e-01 4.46 4.825720177e-01 4.48 4.087860396e-01 4.50 3.404388319e-01 4.52 2.771624966e-01 4.54 2.186142236e-01 4.56 1.644745191e-01 4.58 1.144455643e-01 4.60 6.824969596e-02 4.62 2.562799677e-02 4.64 -1.366101063e-02 4.66 -4.984257488e-02 4.68 -8.312683955e-02 4.70 -1.137098856e-01 4.72 -1.417746989e-01 4.74 -1.674920685e-01 4.76 -1.910214208e-01 4.78 -2.125115943e-01 4.80 -2.321015594e-01 4.82 -2.499210872e-01 4.84 -2.660913719e-01 4.86 -2.807256087e-01 4.88 -2.939295313e-01 4.90 -3.058019131e-01 4.92 -3.164350316e-01 4.94 -3.259151025e-01 4.96 -3.343226829e-01 4.98 -3.417330466e-01 5.00 -3.482165344e-01 5.02 -3.538388796e-01 5.04 -3.586615118e-01 5.06 -3.627418400e-01 5.08 -3.661335165e-01 5.10 -3.688866826e-01 5.12 -3.710481984e-01 5.14 -3.726618567e-01 5.16 -3.737685823e-01 5.18 -3.744066188e-01 5.20 -3.746117025e-01 5.22 -3.744172243e-01 5.24 -3.738543818e-01 5.26 -3.729523204e-01 5.28 -3.717382658e-01 5.30 -3.702376478e-01 5.32 -3.684742149e-01 5.34 -3.664701431e-01 5.36 -3.642461360e-01 5.38 -3.618215197e-01 5.40 -3.592143303e-01 5.42 -3.564413969e-01 5.44 -3.535184181e-01 5.46 -3.504600347e-01 5.48 -3.472798967e-01 5.50 -3.439907268e-01 5.52 -3.406043792e-01 5.54 -3.371318951e-01 5.56 -3.335835542e-01 5.58 -3.299689234e-01 5.60 -3.262969023e-01 5.62 -3.225757653e-01 5.64 -3.188132017e-01 5.66 -3.150163529e-01 5.68 -3.111918472e-01 5.70 -3.073458328e-01 5.72 -3.034840082e-01 5.74 -2.996116510e-01 5.76 -2.957336449e-01 5.78 -2.918545048e-01 5.80 -2.879784006e-01 5.82 -2.841091791e-01 5.84 -2.802503852e-01 5.86 -2.764052811e-01 5.88 -2.725768644e-01 5.90 -2.687678856e-01 5.92 -2.649808641e-01 5.94 -2.612181029e-01 5.96 -2.574817032e-01 5.98 -2.537735773e-01 6.00 -2.500954611e-01 6.02 -2.464489259e-01 6.04 -2.428353892e-01 6.06 -2.392561247e-01 6.08 -2.357122726e-01 6.10 -2.322048478e-01 6.12 -2.287347489e-01 6.14 -2.253027659e-01 6.16 -2.219095876e-01 6.18 -2.185558088e-01 6.20 -2.152419365e-01 6.22 -2.119683965e-01 6.24 -2.087355385e-01 6.26 -2.055436422e-01 6.28 -2.023929217e-01 6.30 -1.992835307e-01 6.32 -1.962155668e-01 6.34 -1.931890756e-01 6.36 -1.902040546e-01 6.38 -1.872604569e-01 6.40 -1.843581947e-01 6.42 -1.814971423e-01 6.44 -1.786771393e-01 6.46 -1.758979933e-01 6.48 -1.731594826e-01 6.50 -1.704613587e-01 6.52 -1.678033483e-01 6.54 -1.651851560e-01 6.56 -1.626064658e-01 6.58 -1.600669434e-01 6.60 -1.575662375e-01 6.62 -1.551039819e-01 6.64 -1.526797970e-01 6.66 -1.502932907e-01 6.68 -1.479440606e-01 6.70 -1.456316944e-01 6.72 -1.433557717e-01 6.74 -1.411158648e-01 6.76 -1.389115397e-01 6.78 -1.367423571e-01 6.80 -1.346078735e-01 6.82 -1.325076416e-01 6.84 -1.304412113e-01 6.86 -1.284081304e-01 6.88 -1.264079453e-01 6.90 -1.244402013e-01 6.92 -1.225044437e-01 6.94 -1.206002179e-01 6.96 -1.187270699e-01 6.98 -1.168845470e-01 7.00 -1.150721979e-01 7.02 -1.132895734e-01 7.04 -1.115362264e-01 7.06 -1.098117125e-01 7.08 -1.081155901e-01 7.10 -1.064474209e-01 7.12 -1.048067698e-01 7.14 -1.031932055e-01 7.16 -1.016063003e-01 7.18 -1.000456307e-01 7.20 -9.851077724e-02 7.22 -9.700132476e-02 7.24 -9.551686257e-02 7.26 -9.405698449e-02 7.28 -9.262128901e-02 7.30 -9.120937934e-02 7.32 -8.982086352e-02 7.34 -8.845535445e-02 7.36 -8.711246998e-02 7.38 -8.579183292e-02 7.40 -8.449307113e-02 7.42 -8.321581748e-02 7.44 -8.195970992e-02 7.46 -8.072439149e-02 7.48 -7.950951030e-02 7.50 -7.831471957e-02 7.52 -7.713967758e-02 7.54 -7.598404769e-02 7.56 -7.484749834e-02 7.58 -7.372970297e-02 7.60 -7.263034006e-02 7.62 -7.154909309e-02 7.64 -7.048565046e-02 7.66 -6.943970552e-02 7.68 -6.841095650e-02 7.70 -6.739910648e-02 7.72 -6.640386333e-02 7.74 -6.542493970e-02 7.76 -6.446205294e-02 7.78 -6.351492507e-02 7.80 -6.258328272e-02 7.82 -6.166685711e-02 7.84 -6.076538394e-02 7.86 -5.987860339e-02 7.88 -5.900626004e-02 7.90 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