# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2015--Elliott-R-S-Akerson-A--Cd # 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 Cd Cd 0.02 3.000608390e+24 0.04 7.325704077e+20 0.06 5.646174062e+18 0.08 1.788501970e+17 0.10 1.229049192e+16 0.12 1.378460450e+15 0.14 2.167867964e+14 0.16 4.366459636e+13 0.18 1.062427135e+13 0.20 3.000607717e+12 0.22 9.560859250e+11 0.24 3.365379739e+11 0.26 1.287919211e+11 0.28 5.292637598e+10 0.30 2.312666987e+10 0.32 1.066026235e+10 0.34 5.150150392e+09 0.36 2.593796767e+09 0.38 1.355693534e+09 0.40 7.325598909e+08 0.42 4.079147667e+08 0.44 2.334135716e+08 0.46 1.369181005e+08 0.48 8.215912428e+07 0.50 5.033909818e+07 0.52 3.144119533e+07 0.54 1.998970597e+07 0.56 1.292010360e+07 0.58 8.479600549e+06 0.60 5.645250779e+06 0.62 3.808750517e+06 0.64 2.601986059e+06 0.66 1.798523889e+06 0.68 1.256932042e+06 0.70 8.875925956e+05 0.72 6.329467894e+05 0.74 4.555526859e+05 0.76 3.307598166e+05 0.78 2.421537015e+05 0.80 1.786858726e+05 0.82 1.328434201e+05 0.84 9.946786051e+04 0.86 7.498451783e+04 0.88 5.689442764e+04 0.90 4.343596422e+04 0.92 3.335733863e+04 0.94 2.576224270e+04 0.96 2.000420787e+04 0.98 1.561370166e+04 1.00 1.224741528e+04 1.02 9.652718182e+03 1.04 7.642560900e+03 1.06 6.077630620e+03 1.08 4.853577857e+03 1.10 3.891813857e+03 1.12 3.132839198e+03 1.14 2.531378344e+03 1.16 2.052810767e+03 1.18 1.670538534e+03 1.20 1.364034195e+03 1.22 1.117385659e+03 1.24 9.182060816e+02 1.26 7.568132713e+02 1.28 6.256090669e+02 1.30 5.186078455e+02 1.32 4.310767482e+02 1.34 3.592599923e+02 1.36 3.001667463e+02 1.38 2.514072637e+02 1.40 2.110658066e+02 1.42 1.776017309e+02 1.44 1.497722106e+02 1.46 1.265716557e+02 1.48 1.071840531e+02 1.50 9.094534909e+01 1.52 7.731366183e+01 1.54 6.584561927e+01 1.56 5.617750524e+01 1.58 4.801019192e+01 1.60 4.109706323e+01 1.62 3.523430803e+01 1.64 3.025309659e+01 1.66 2.601325801e+01 1.68 2.239815722e+01 1.70 1.931053337e+01 1.72 1.666911082e+01 1.74 1.440583246e+01 1.76 1.246359595e+01 1.78 1.079439686e+01 1.80 9.357802485e+00 1.82 8.119694353e+00 1.84 7.051230136e+00 1.86 6.127984722e+00 1.88 5.329238148e+00 1.90 4.637384060e+00 1.92 4.037437349e+00 1.94 3.516623539e+00 1.96 3.064035713e+00 1.98 2.670347349e+00 2.00 2.327571504e+00 2.02 2.028858535e+00 2.04 1.768325873e+00 2.06 1.540914546e+00 2.08 1.342268047e+00 2.10 1.168629894e+00 2.12 1.016756867e+00 2.14 8.838454104e-01 2.16 7.674691011e-01 2.18 6.655254520e-01 2.20 5.761905782e-01 2.22 4.978805188e-01 2.24 4.292181861e-01 2.26 3.690050870e-01 2.28 3.161970947e-01 2.30 2.698836631e-01 2.32 2.292699728e-01 2.34 1.936615752e-01 2.36 1.624511689e-01 2.38 1.351071991e-01 2.40 1.111640172e-01 2.42 9.021337648e-02 2.44 7.189707471e-02 2.46 5.590058214e-02 2.48 4.194751644e-02 2.50 2.979484722e-02 2.52 1.922872935e-02 2.54 1.006087907e-02 2.56 2.125418896e-03 2.58 -4.723871884e-03 2.60 -1.061595560e-02 2.62 -1.566463024e-02 2.64 -1.997035945e-02 2.66 -2.362187316e-02 2.68 -2.669756890e-02 2.70 -2.926673953e-02 2.72 -3.139064991e-02 2.74 -3.312348179e-02 2.76 -3.451316373e-02 2.78 -3.560210054e-02 2.80 -3.642781503e-02 2.82 -3.702351284e-02 2.84 -3.741858008e-02 2.86 -3.763902197e-02 2.88 -3.770784980e-02 2.90 -3.764542250e-02 2.92 -3.746974832e-02 2.94 -3.719675145e-02 2.96 -3.684050781e-02 2.98 -3.641345370e-02 3.00 -3.592657050e-02 3.02 -3.538954824e-02 3.04 -3.481093065e-02 3.06 -3.419824371e-02 3.08 -3.355810966e-02 3.10 -3.289634829e-02 3.12 -3.221806673e-02 3.14 -3.152773931e-02 3.16 -3.082927849e-02 3.18 -3.012609787e-02 3.20 -2.942116827e-02 3.22 -2.871706758e-02 3.24 -2.801602510e-02 3.26 -2.731996103e-02 3.28 -2.663052157e-02 3.30 -2.594911025e-02 3.32 -2.527691569e-02 3.34 -2.461493650e-02 3.36 -2.396400327e-02 3.38 -2.332479830e-02 3.40 -2.269787310e-02 3.42 -2.208366398e-02 3.44 -2.148250594e-02 3.46 -2.089464506e-02 3.48 -2.032024951e-02 3.50 -1.975941934e-02 3.52 -1.921219520e-02 3.54 -1.867856612e-02 3.56 -1.815847642e-02 3.58 -1.765183179e-02 3.60 -1.715850481e-02 3.62 -1.667833971e-02 3.64 -1.621115672e-02 3.66 -1.575675586e-02 3.68 -1.531492029e-02 3.70 -1.488541929e-02 3.72 -1.446801090e-02 3.74 -1.406244427e-02 3.76 -1.366846164e-02 3.78 -1.328580019e-02 3.80 -1.291419362e-02 3.82 -1.255337348e-02 3.84 -1.220307045e-02 3.86 -1.186301532e-02 3.88 -1.153293996e-02 3.90 -1.121257806e-02 3.92 -1.090166585e-02 3.94 -1.059994265e-02 3.96 -1.030715136e-02 3.98 -1.002303889e-02 4.00 -9.747356518e-03 4.02 -9.479860144e-03 4.04 -9.220310541e-03 4.06 -8.968473536e-03 4.08 -8.724120154e-03 4.10 -8.487026718e-03 4.12 -8.256974929e-03 4.14 -8.033751908e-03 4.16 -7.817150212e-03 4.18 -7.606967838e-03 4.20 -7.403008200e-03 4.22 -7.205080093e-03 4.24 -7.012997638e-03 4.26 -6.826580225e-03 4.28 -6.645652436e-03 4.30 -6.470043966e-03 4.32 -6.299589530e-03 4.34 -6.134128773e-03 4.36 -5.973506166e-03 4.38 -5.817570907e-03 4.40 -5.666176809e-03 4.42 -5.519182195e-03 4.44 -5.376449788e-03 4.46 -5.237846597e-03 4.48 -5.103243810e-03 4.50 -4.972516675e-03 4.52 -4.845544397e-03 4.54 -4.722210022e-03 4.56 -4.602400328e-03 4.58 -4.486005722e-03 4.60 -4.372920125e-03 4.62 -4.263040876e-03 4.64 -4.156268622e-03 4.66 -4.052507220e-03 4.68 -3.951663637e-03 4.70 -3.853647855e-03 4.72 -3.758372776e-03 4.74 -3.665754124e-03 4.76 -3.575710365e-03 4.78 -3.488162610e-03 4.80 -3.403034536e-03 4.82 -3.320252296e-03 4.84 -3.239744448e-03 4.86 -3.161441866e-03 4.88 -3.085277670e-03 4.90 -3.011187152e-03 4.92 -2.939107700e-03 4.94 -2.868978734e-03 4.96 -2.800741634e-03 4.98 -2.734339676e-03 5.00 -2.669717969e-03 5.02 -2.606823396e-03 5.04 -2.545604549e-03 5.06 -2.486011677e-03 5.08 -2.427996628e-03 5.10 -2.371512796e-03 5.12 -2.316515068e-03 5.14 -2.262959775e-03 5.16 -2.210804644e-03 5.18 -2.160008748e-03 5.20 -2.110532465e-03 5.22 -2.062337429e-03 5.24 -2.015386495e-03 5.26 -1.969643689e-03 5.28 -1.925074177e-03 5.30 -1.881644222e-03 5.32 -1.839321146e-03 5.34 -1.798073301e-03 5.36 -1.757870028e-03 5.38 -1.718681625e-03 5.40 -1.680479319e-03 5.42 -1.643235230e-03 5.44 -1.606922346e-03 5.46 -1.571514490e-03 5.48 -1.536986293e-03 5.50 -1.503313171e-03 5.52 -1.470471292e-03 5.54 -1.438437560e-03 5.56 -1.407189582e-03 5.58 -1.376705650e-03 5.60 -1.346964717e-03 5.62 -1.317946377e-03 5.64 -1.289630839e-03 5.66 -1.261998914e-03 5.68 -1.235031989e-03 5.70 -1.208712011e-03 5.72 -1.183021470e-03 5.74 -1.157943378e-03 5.76 -1.133461256e-03 5.78 -1.109559113e-03 5.80 -1.086221435e-03 5.82 -1.063433167e-03 5.84 -1.041179697e-03 5.86 -1.019446844e-03 5.88 -9.982208455e-04 5.90 -9.774883395e-04 5.92 -9.572363559e-04 5.94 -9.374523022e-04 5.96 -9.181239519e-04 5.98 -8.992394329e-04 6.00 -8.807872163e-04 6.02 -8.627561054e-04 6.04 -8.451352258e-04 6.06 -8.279140144e-04 6.08 -8.110822105e-04 6.10 -7.946298461e-04 6.12 -7.785472364e-04 6.14 -7.628249714e-04 6.16 -7.474539075e-04 6.18 -7.324251588e-04 6.20 -7.177300894e-04 6.22 -7.033603059e-04 6.24 -6.893076496e-04 6.26 -6.755641893e-04 6.28 -6.621222150e-04 6.30 -6.489742301e-04 6.32 -6.361129459e-04 6.34 -6.235312747e-04 6.36 -6.112223239e-04 6.38 -5.991793902e-04 6.40 -5.873959537e-04 6.42 -5.758656727e-04 6.44 -5.645823778e-04 6.46 -5.535400677e-04 6.48 -5.427329030e-04 6.50 -5.321552023e-04 6.52 -5.218014374e-04 6.54 -5.116662282e-04 6.56 -5.017443390e-04 6.58 -4.920306739e-04 6.60 -4.825202726e-04 6.62 -4.732083069e-04 6.64 -4.640900763e-04 6.66 -4.551610046e-04 6.68 -4.464166362e-04 6.70 -4.378526327e-04 6.72 -4.294647693e-04 6.74 -4.212489316e-04 6.76 -4.132011128e-04 6.78 -4.053174099e-04 6.80 -3.975940214e-04 6.82 -3.900272439e-04 6.84 -3.826134697e-04 6.86 -3.753491839e-04 6.88 -3.682309616e-04 6.90 -3.612554658e-04 6.92 -3.544194445e-04 6.94 -3.477197285e-04 6.96 -3.411532291e-04 6.98 -3.347169359e-04 7.00 -3.284079142e-04 7.02 -3.222233035e-04 7.04 -3.161603150e-04 7.06 -3.102162300e-04 7.08 -3.043883974e-04 7.10 -2.986742324e-04 7.12 -2.930712144e-04 7.14 -2.875768852e-04 7.16 -2.821888476e-04 7.18 -2.769047633e-04 7.20 -2.717223516e-04 7.22 -2.666393878e-04 7.24 -2.616537015e-04 7.26 -2.567631755e-04 7.28 -2.519657440e-04 7.30 -2.472593912e-04 7.32 -2.426421506e-04 7.34 -2.381121026e-04 7.36 -2.336673744e-04 7.38 -2.293061379e-04 7.40 -2.250266088e-04 7.42 -2.208270457e-04 7.44 -2.167057485e-04 7.46 -2.126610577e-04 7.48 -2.086913531e-04 7.50 -2.047950528e-04 7.52 -2.009706124e-04 7.54 -1.972165238e-04 7.56 -1.935313142e-04 7.58 -1.899135456e-04 7.60 -1.863618132e-04 7.62 -1.828747454e-04 7.64 -1.794510022e-04 7.66 -1.760892748e-04 7.68 -1.727882846e-04 7.70 -1.695467826e-04 7.72 -1.663635485e-04 7.74 -1.632373902e-04 7.76 -1.601671426e-04 7.78 -1.571516675e-04 7.80 -1.541898525e-04 7.82 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-6.106762987e-05 8.74 -5.973174426e-05 8.76 -5.841706375e-05 8.78 -5.712320478e-05 8.80 -5.584979158e-05 8.82 -5.459645597e-05 8.84 -5.336283723e-05 8.86 -5.214858188e-05 8.88 -5.095334357e-05 8.90 -4.977678289e-05 8.92 -4.861856721e-05 8.94 -4.747837057e-05 8.96 -4.635587348e-05 8.98 -4.525076281e-05 9.00 -4.416273166e-05 9.02 -4.309147920e-05 9.04 -4.203671051e-05 9.06 -4.099813653e-05 9.08 -3.997547387e-05 9.10 -3.896844468e-05 9.12 -3.797677659e-05 9.14 -3.700020252e-05 9.16 -3.603846062e-05 9.18 -3.509129412e-05 9.20 -3.415845126e-05 9.22 -3.323968512e-05 9.24 -3.233475360e-05 9.26 -3.144341923e-05 9.28 -3.056544915e-05 9.30 -2.970061493e-05 9.32 -2.884869257e-05 9.34 -2.800946231e-05 9.36 -2.718270861e-05 9.38 -2.636822004e-05 9.40 -2.556578918e-05 9.42 -2.477521254e-05 9.44 -2.399629050e-05 9.46 -2.322882719e-05 9.48 -2.247263046e-05 9.50 -2.172751175e-05 9.52 -2.099328605e-05 9.54 -2.026977183e-05 9.56 -1.955679092e-05 9.58 -1.885416852e-05 9.60 -1.816173304e-05 9.62 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