# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 1999--Mishin-Y-Farkas-D-Mehl-M-J-Papaconstantopoulos-D-A--Al # implementation = 1999--Mishin-Y--Al--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 Al Al 0.02 5.673577365e+01 0.04 5.458015972e+01 0.06 5.248340018e+01 0.08 5.044469855e+01 0.10 4.846325176e+01 0.12 4.653825057e+01 0.14 4.466887968e+01 0.16 4.285431823e+01 0.18 4.109373982e+01 0.20 3.938631302e+01 0.22 3.773120145e+01 0.24 3.612756409e+01 0.26 3.457455558e+01 0.28 3.307132644e+01 0.30 3.161702320e+01 0.32 3.021078882e+01 0.34 2.885176276e+01 0.36 2.753908128e+01 0.38 2.627187764e+01 0.40 2.504928234e+01 0.42 2.387042323e+01 0.44 2.273442583e+01 0.46 2.164041341e+01 0.48 2.058750731e+01 0.50 1.957482705e+01 0.52 1.860149041e+01 0.54 1.766661385e+01 0.56 1.676931245e+01 0.58 1.590870020e+01 0.60 1.508389010e+01 0.62 1.429399439e+01 0.64 1.353812456e+01 0.66 1.281539169e+01 0.68 1.212490643e+01 0.70 1.146577921e+01 0.72 1.083712032e+01 0.74 1.023804013e+01 0.76 9.667649144e+00 0.78 9.125058076e+00 0.80 8.609378097e+00 0.82 8.119720806e+00 0.84 7.655198428e+00 0.86 7.214923865e+00 0.88 6.798010833e+00 0.90 6.403573915e+00 0.92 6.030728647e+00 0.94 5.678591681e+00 0.96 5.346280721e+00 0.98 5.032914757e+00 1.00 4.737614039e+00 1.02 4.459502126e+00 1.04 4.197727279e+00 1.06 3.951465626e+00 1.08 3.719914830e+00 1.10 3.502294020e+00 1.12 3.297843740e+00 1.14 3.105825934e+00 1.16 2.925523807e+00 1.18 2.756241773e+00 1.20 2.597305439e+00 1.22 2.448061463e+00 1.24 2.307877520e+00 1.26 2.176142201e+00 1.28 2.052264941e+00 1.30 1.935675941e+00 1.32 1.825826105e+00 1.34 1.722186926e+00 1.36 1.624250419e+00 1.38 1.531529054e+00 1.40 1.443555654e+00 1.42 1.359883337e+00 1.44 1.280085426e+00 1.46 1.203755367e+00 1.48 1.130506663e+00 1.50 1.059972813e+00 1.52 9.918072101e-01 1.54 9.256830903e-01 1.56 8.612934685e-01 1.58 7.983510607e-01 1.60 7.365882327e-01 1.62 6.757569273e-01 1.64 6.156286204e-01 1.66 5.559942514e-01 1.68 4.966641832e-01 1.70 4.374681383e-01 1.72 3.782551669e-01 1.74 3.188935936e-01 1.76 2.592709778e-01 1.78 1.992940729e-01 1.80 1.388887946e-01 1.82 7.800019187e-02 1.84 1.659240594e-02 1.86 -4.535134778e-02 1.88 -1.078288042e-01 1.90 -1.708186745e-01 1.92 -2.342806479e-01 1.94 -2.981554339e-01 1.96 -3.623647495e-01 1.98 -4.268113392e-01 2.00 -4.913789734e-01 2.02 -5.559332710e-01 2.04 -6.203304733e-01 2.06 -6.844262651e-01 2.08 -7.480765571e-01 2.10 -8.111374703e-01 2.12 -8.734653546e-01 2.14 -9.349167436e-01 2.16 -9.953483593e-01 2.18 -1.054617082e+00 2.20 -1.112579939e+00 2.22 -1.169094072e+00 2.24 -1.224016722e+00 2.26 -1.277205190e+00 2.28 -1.328516807e+00 2.30 -1.377808909e+00 2.32 -1.424938787e+00 2.34 -1.469763666e+00 2.36 -1.512140639e+00 2.38 -1.551926645e+00 2.40 -1.588978409e+00 2.42 -1.623186518e+00 2.44 -1.654577727e+00 2.46 -1.683212539e+00 2.48 -1.709151031e+00 2.50 -1.732452793e+00 2.52 -1.753176855e+00 2.54 -1.771381626e+00 2.56 -1.787124824e+00 2.58 -1.800463391e+00 2.60 -1.811453421e+00 2.62 -1.820150075e+00 2.64 -1.826607495e+00 2.66 -1.830878713e+00 2.68 -1.833015557e+00 2.70 -1.833068535e+00 2.72 -1.831086750e+00 2.74 -1.827117788e+00 2.76 -1.821207580e+00 2.78 -1.813400308e+00 2.80 -1.803738247e+00 2.82 -1.792264929e+00 2.84 -1.779035612e+00 2.86 -1.764108590e+00 2.88 -1.747542225e+00 2.90 -1.729395155e+00 2.92 -1.709726457e+00 2.94 -1.688595802e+00 2.96 -1.666063629e+00 2.98 -1.642191265e+00 3.00 -1.617041100e+00 3.02 -1.590676795e+00 3.04 -1.563164453e+00 3.06 -1.534575807e+00 3.08 -1.504985202e+00 3.10 -1.474468987e+00 3.12 -1.443105639e+00 3.14 -1.410975820e+00 3.16 -1.378162517e+00 3.18 -1.344751111e+00 3.20 -1.310829529e+00 3.22 -1.276484401e+00 3.24 -1.241790027e+00 3.26 -1.206819538e+00 3.28 -1.171648750e+00 3.30 -1.136356205e+00 3.32 -1.101023046e+00 3.34 -1.065733123e+00 3.36 -1.030572883e+00 3.38 -9.956313493e-01 3.40 -9.610000770e-01 3.42 -9.267730282e-01 3.44 -8.930464524e-01 3.46 -8.599188184e-01 3.48 -8.274906876e-01 3.50 -7.958644653e-01 3.52 -7.651291257e-01 3.54 -7.353133393e-01 3.56 -7.064294308e-01 3.58 -6.784884377e-01 3.60 -6.515001095e-01 3.62 -6.254729455e-01 3.64 -6.004142676e-01 3.66 -5.763302744e-01 3.68 -5.532260169e-01 3.70 -5.311055152e-01 3.72 -5.099670254e-01 3.74 -4.897889929e-01 3.76 -4.705442454e-01 3.78 -4.522046718e-01 3.80 -4.347413077e-01 3.82 -4.181243737e-01 3.84 -4.023233106e-01 3.86 -3.873068146e-01 3.88 -3.730428858e-01 3.90 -3.594988421e-01 3.92 -3.466413764e-01 3.94 -3.344366082e-01 3.96 -3.228500677e-01 3.98 -3.118467814e-01 4.00 -3.013912685e-01 4.02 -2.914499700e-01 4.04 -2.819984090e-01 4.06 -2.730140641e-01 4.08 -2.644740554e-01 4.10 -2.563551496e-01 4.12 -2.486338065e-01 4.14 -2.412861750e-01 4.16 -2.342881447e-01 4.18 -2.276153445e-01 4.20 -2.212431783e-01 4.22 -2.151468485e-01 4.24 -2.093013481e-01 4.26 -2.036815066e-01 4.28 -1.982651529e-01 4.30 -1.930424749e-01 4.32 -1.880066550e-01 4.34 -1.831508244e-01 4.36 -1.784680567e-01 4.38 -1.739513765e-01 4.40 -1.695937670e-01 4.42 -1.653881553e-01 4.44 -1.613274316e-01 4.46 -1.574044488e-01 4.48 -1.536120144e-01 4.50 -1.499429052e-01 4.52 -1.463898610e-01 4.54 -1.429455900e-01 4.56 -1.396027750e-01 4.58 -1.363540635e-01 4.60 -1.331920815e-01 4.62 -1.301094278e-01 4.64 -1.270986803e-01 4.66 -1.241523924e-01 4.68 -1.212630991e-01 4.70 -1.184240059e-01 4.72 -1.156317620e-01 4.74 -1.128840813e-01 4.76 -1.101786570e-01 4.78 -1.075131698e-01 4.80 -1.048852836e-01 4.82 -1.022926494e-01 4.84 -9.973290278e-02 4.86 -9.720366670e-02 4.88 -9.470254838e-02 4.90 -9.222714259e-02 4.92 -8.977503057e-02 4.94 -8.734377799e-02 4.96 -8.493093636e-02 4.98 -8.253404122e-02 5.00 -8.015061200e-02 5.02 -7.777917415e-02 5.04 -7.542233584e-02 5.06 -7.308371820e-02 5.08 -7.076692644e-02 5.10 -6.847554811e-02 5.12 -6.621315152e-02 5.14 -6.398328471e-02 5.16 -6.178947158e-02 5.18 -5.963521210e-02 5.20 -5.752398169e-02 5.22 -5.545843039e-02 5.24 -5.343800414e-02 5.26 -5.146132124e-02 5.28 -4.952696581e-02 5.30 -4.763348579e-02 5.32 -4.577939076e-02 5.34 -4.396315011e-02 5.36 -4.218319428e-02 5.38 -4.043791663e-02 5.40 -3.872567093e-02 5.42 -3.704478094e-02 5.44 -3.539354221e-02 5.46 -3.377023448e-02 5.48 -3.217313689e-02 5.50 -3.060054598e-02 5.52 -2.905080114e-02 5.54 -2.752232403e-02 5.56 -2.601366280e-02 5.58 -2.452354897e-02 5.60 -2.305097225e-02 5.62 -2.159526679e-02 5.64 -2.015621608e-02 5.66 -1.873417478e-02 5.68 -1.733019513e-02 5.70 -1.594616626e-02 5.72 -1.458494385e-02 5.74 -1.325045993e-02 5.76 -1.194778788e-02 5.78 -1.068313778e-02 5.80 -9.463758441e-03 5.82 -8.297718393e-03 5.84 -7.193557757e-03 5.86 -6.159802841e-03 5.88 -5.204392607e-03 5.90 -4.334040883e-03 5.92 -3.553562987e-03 5.94 -2.865672760e-03 5.96 -2.270507580e-03 5.98 -1.765533364e-03 6.00 -1.345762914e-03 6.02 -1.004188404e-03 6.04 -7.323516450e-04 6.06 -5.209756442e-04 6.08 -3.605708546e-04 6.10 -2.419583477e-04 6.12 -1.566696002e-04 6.14 -9.721072927e-05 6.16 -5.719883395e-05 6.18 -3.138877045e-05 6.20 -1.561619470e-05 6.22 -6.681388531e-06 6.24 -2.195476648e-06 6.26 -4.274745543e-07 6.28 -7.838633287e-09 6.30 2.084444214e-10 6.32 2.084444214e-10 6.34 2.084444214e-10 6.36 2.084444214e-10 6.38 2.084444214e-10 6.40 2.084444214e-10 6.42 2.084444214e-10 6.44 2.084444214e-10 6.46 2.084444214e-10 6.48 2.084444214e-10 6.50 2.084444214e-10 6.52 2.084444214e-10 6.54 2.084444214e-10 6.56 2.084444214e-10 6.58 2.084444214e-10 6.60 2.084444214e-10 6.62 2.084444214e-10 6.64 2.084444214e-10 6.66 2.084444214e-10 6.68 2.084444214e-10 6.70 2.084444214e-10 6.72 2.084444214e-10 6.74 2.084444214e-10 6.76 2.084444214e-10 6.78 2.084444214e-10 6.80 2.084444214e-10 6.82 2.084444214e-10 6.84 2.084444214e-10 6.86 2.084444214e-10 6.88 2.084444214e-10 6.90 2.084444214e-10 6.92 2.084444214e-10 6.94 2.084444214e-10 6.96 2.084444214e-10 6.98 2.084444214e-10 7.00 2.084444214e-10 7.02 2.084444214e-10 7.04 2.084444214e-10 7.06 2.084444214e-10 7.08 2.084444214e-10 7.10 2.084444214e-10 7.12 2.084444214e-10 7.14 2.084444214e-10 7.16 2.084444214e-10 7.18 2.084444214e-10 7.20 2.084444214e-10 7.22 2.084444214e-10 7.24 2.084444214e-10 7.26 2.084444214e-10 7.28 2.084444214e-10 7.30 2.084444214e-10 7.32 2.084444214e-10 7.34 2.084444214e-10 7.36 2.084444214e-10 7.38 2.084444214e-10 7.40 2.084444214e-10 7.42 2.084444214e-10 7.44 2.084444214e-10 7.46 2.084444214e-10 7.48 2.084444214e-10 7.50 2.084444214e-10 7.52 2.084444214e-10 7.54 2.084444214e-10 7.56 2.084444214e-10 7.58 2.084444214e-10 7.60 2.084444214e-10 7.62 2.084444214e-10 7.64 2.084444214e-10 7.66 2.084444214e-10 7.68 2.084444214e-10 7.70 2.084444214e-10 7.72 2.084444214e-10 7.74 2.084444214e-10 7.76 2.084444214e-10 7.78 2.084444214e-10 7.80 2.084444214e-10 7.82 2.084444214e-10 7.84 2.084444214e-10 7.86 2.084444214e-10 7.88 2.084444214e-10 7.90 2.084444214e-10 7.92 2.084444214e-10 7.94 2.084444214e-10 7.96 2.084444214e-10 7.98 2.084444214e-10 8.00 2.084444214e-10 8.02 2.084444214e-10 8.04 2.084444214e-10 8.06 2.084444214e-10 8.08 2.084444214e-10 8.10 2.084444214e-10 8.12 2.084444214e-10 8.14 2.084444214e-10 8.16 2.084444214e-10 8.18 2.084444214e-10 8.20 2.084444214e-10 8.22 2.084444214e-10 8.24 2.084444214e-10 8.26 2.084444214e-10 8.28 2.084444214e-10 8.30 2.084444214e-10 8.32 2.084444214e-10 8.34 2.084444214e-10 8.36 2.084444214e-10 8.38 2.084444214e-10 8.40 2.084444214e-10 8.42 2.084444214e-10 8.44 2.084444214e-10 8.46 2.084444214e-10 8.48 2.084444214e-10 8.50 2.084444214e-10 8.52 2.084444214e-10 8.54 2.084444214e-10 8.56 2.084444214e-10 8.58 2.084444214e-10 8.60 2.084444214e-10 8.62 2.084444214e-10 8.64 2.084444214e-10 8.66 2.084444214e-10 8.68 2.084444214e-10 8.70 2.084444214e-10 8.72 2.084444214e-10 8.74 2.084444214e-10 8.76 2.084444214e-10 8.78 2.084444214e-10 8.80 2.084444214e-10 8.82 2.084444214e-10 8.84 2.084444214e-10 8.86 2.084444214e-10 8.88 2.084444214e-10 8.90 2.084444214e-10 8.92 2.084444214e-10 8.94 2.084444214e-10 8.96 2.084444214e-10 8.98 2.084444214e-10 9.00 2.084444214e-10 9.02 2.084444214e-10 9.04 2.084444214e-10 9.06 2.084444214e-10 9.08 2.084444214e-10 9.10 2.084444214e-10 9.12 2.084444214e-10 9.14 2.084444214e-10 9.16 2.084444214e-10 9.18 2.084444214e-10 9.20 2.084444214e-10 9.22 2.084444214e-10 9.24 2.084444214e-10 9.26 2.084444214e-10 9.28 2.084444214e-10 9.30 2.084444214e-10 9.32 2.084444214e-10 9.34 2.084444214e-10 9.36 2.084444214e-10 9.38 2.084444214e-10 9.40 2.084444214e-10 9.42 2.084444214e-10 9.44 2.084444214e-10 9.46 2.084444214e-10 9.48 2.084444214e-10 9.50 2.084444214e-10 9.52 2.084444214e-10 9.54 2.084444214e-10 9.56 2.084444214e-10 9.58 2.084444214e-10 9.60 2.084444214e-10 9.62 2.084444214e-10 9.64 2.084444214e-10 9.66 2.084444214e-10 9.68 2.084444214e-10 9.70 2.084444214e-10 9.72 2.084444214e-10 9.74 2.084444214e-10 9.76 2.084444214e-10 9.78 2.084444214e-10 9.80 2.084444214e-10 9.82 2.084444214e-10 9.84 2.084444214e-10 9.86 2.084444214e-10 9.88 2.084444214e-10 9.90 2.084444214e-10 9.92 2.084444214e-10 9.94 2.084444214e-10 9.96 2.084444214e-10 9.98 2.084444214e-10 10.00 2.084444214e-10