# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Al # implementation = 2004--Zhou-X-W--Al--LAMMPS--ipr2 # 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 1.674465466e+03 0.04 8.344185590e+02 0.06 5.544029234e+02 0.08 4.143951056e+02 0.10 3.303904149e+02 0.12 2.743872878e+02 0.14 2.343850541e+02 0.16 2.043833789e+02 0.18 1.810487426e+02 0.20 1.623810335e+02 0.22 1.471074534e+02 0.24 1.343794700e+02 0.26 1.236096378e+02 0.28 1.143783531e+02 0.30 1.063779064e+02 0.32 9.937751552e+01 0.34 9.320070003e+01 0.36 8.771019737e+01 0.38 8.279764236e+01 0.40 7.837634285e+01 0.42 7.437611948e+01 0.44 7.073955279e+01 0.46 6.741920928e+01 0.48 6.437556107e+01 0.50 6.157178985e+01 0.52 5.839388107e+01 0.54 5.536136257e+01 0.56 5.247105995e+01 0.58 4.971642140e+01 0.60 4.708905061e+01 0.62 4.458255424e+01 0.64 4.219199994e+01 0.66 3.991262252e+01 0.68 3.773982078e+01 0.70 3.566915429e+01 0.72 3.369633992e+01 0.74 3.181724826e+01 0.76 3.002789998e+01 0.78 2.832446208e+01 0.80 2.670324408e+01 0.82 2.516069423e+01 0.84 2.369338836e+01 0.86 2.229800554e+01 0.88 2.097134550e+01 0.90 1.971033800e+01 0.92 1.851203768e+01 0.94 1.737361967e+01 0.96 1.629237542e+01 0.98 1.526570847e+01 1.00 1.429113045e+01 1.02 1.336625709e+01 1.04 1.248880441e+01 1.06 1.165658495e+01 1.08 1.086750417e+01 1.10 1.011955688e+01 1.12 9.410823833e+00 1.14 8.739468411e+00 1.16 8.103733399e+00 1.18 7.501937873e+00 1.20 6.932474182e+00 1.22 6.393805037e+00 1.24 5.884460691e+00 1.26 5.403036220e+00 1.28 4.948188897e+00 1.30 4.518635651e+00 1.32 4.113150628e+00 1.34 3.730562829e+00 1.36 3.369753838e+00 1.38 3.029655637e+00 1.40 2.709248493e+00 1.42 2.407558932e+00 1.44 2.123657787e+00 1.46 1.856658316e+00 1.48 1.605714399e+00 1.50 1.370018804e+00 1.52 1.148801511e+00 1.54 9.413281149e-01 1.56 7.468982843e-01 1.58 5.648442810e-01 1.60 3.945295418e-01 1.62 2.353473156e-01 1.64 8.671935626e-02 1.66 -5.190533214e-02 1.68 -1.810516977e-01 1.70 -3.012197944e-01 1.72 -4.128858880e-01 1.74 -5.165035157e-01 1.76 -6.125045023e-01 1.78 -7.012999332e-01 1.80 -7.832810869e-01 1.82 -8.588203277e-01 1.84 -9.282719613e-01 1.86 -9.919730530e-01 1.88 -1.050244212e+00 1.90 -1.103390342e+00 1.92 -1.151701356e+00 1.94 -1.195452870e+00 1.96 -1.234906853e+00 1.98 -1.270312260e+00 2.00 -1.301905631e+00 2.02 -1.329911669e+00 2.04 -1.354543786e+00 2.06 -1.376004631e+00 2.08 -1.394486595e+00 2.10 -1.410172284e+00 2.12 -1.423234985e+00 2.14 -1.433839102e+00 2.16 -1.442140573e+00 2.18 -1.448287276e+00 2.20 -1.452419405e+00 2.22 -1.454669838e+00 2.24 -1.455164488e+00 2.26 -1.454022631e+00 2.28 -1.451357230e+00 2.30 -1.447275233e+00 2.32 -1.441877868e+00 2.34 -1.435260913e+00 2.36 -1.427514967e+00 2.38 -1.418725699e+00 2.40 -1.408974088e+00 2.42 -1.398336650e+00 2.44 -1.386885663e+00 2.46 -1.374689371e+00 2.48 -1.361812183e+00 2.50 -1.348314866e+00 2.52 -1.334254722e+00 2.54 -1.319685765e+00 2.56 -1.304658883e+00 2.58 -1.289221995e+00 2.60 -1.273420201e+00 2.62 -1.257295926e+00 2.64 -1.240889054e+00 2.66 -1.224237059e+00 2.68 -1.207375128e+00 2.70 -1.190336279e+00 2.72 -1.173151473e+00 2.74 -1.155849723e+00 2.76 -1.138458193e+00 2.78 -1.121002296e+00 2.80 -1.103505791e+00 2.82 -1.085990863e+00 2.84 -1.068478217e+00 2.86 -1.050987151e+00 2.88 -1.033535636e+00 2.90 -1.016140390e+00 2.92 -9.988169443e-01 2.94 -9.815797151e-01 2.96 -9.644420633e-01 2.98 -9.474163569e-01 3.00 -9.305140291e-01 3.02 -9.137456342e-01 3.04 -8.971209002e-01 3.06 -8.806487805e-01 3.08 -8.643375020e-01 3.10 -8.481946126e-01 3.12 -8.322270255e-01 3.14 -8.164410626e-01 3.16 -8.008424953e-01 3.18 -7.854365846e-01 3.20 -7.702281187e-01 3.22 -7.552214493e-01 3.24 -7.404205265e-01 3.26 -7.258289313e-01 3.28 -7.114499077e-01 3.30 -6.972863915e-01 3.32 -6.833410379e-01 3.34 -6.696162469e-01 3.36 -6.561141856e-01 3.38 -6.428368079e-01 3.40 -6.297858707e-01 3.42 -6.169629454e-01 3.44 -6.043694249e-01 3.46 -5.920065249e-01 3.48 -5.798752775e-01 3.50 -5.679765178e-01 3.52 -5.563108602e-01 3.54 -5.448786647e-01 3.56 -5.336799924e-01 3.58 -5.227145470e-01 3.60 -5.119816060e-01 3.62 -5.014799378e-01 3.64 -4.912077101e-01 3.66 -4.811623904e-01 3.68 -4.713406444e-01 3.70 -4.617382392e-01 3.72 -4.523499601e-01 3.74 -4.431695518e-01 3.76 -4.341896965e-01 3.78 -4.254020393e-01 3.80 -4.167972732e-01 3.82 -4.083652882e-01 3.84 -4.000953880e-01 3.86 -3.919765661e-01 3.88 -3.839978290e-01 3.90 -3.761485454e-01 3.92 -3.684187937e-01 3.94 -3.607996798e-01 3.96 -3.532835968e-01 3.98 -3.458644064e-01 4.00 -3.385375266e-01 4.02 -3.312999237e-01 4.04 -3.241500166e-01 4.06 -3.170875057e-01 4.08 -3.101131505e-01 4.10 -3.032285157e-01 4.12 -2.964357093e-01 4.14 -2.897371292e-01 4.16 -2.831352345e-01 4.18 -2.766323477e-01 4.20 -2.702304926e-01 4.22 -2.639312693e-01 4.24 -2.577357609e-01 4.26 -2.516444705e-01 4.28 -2.456572803e-01 4.30 -2.397734296e-01 4.32 -2.339915053e-01 4.34 -2.283094408e-01 4.36 -2.227245192e-01 4.38 -2.172333796e-01 4.40 -2.118320223e-01 4.42 -2.065158133e-01 4.44 -2.012794877e-01 4.46 -1.961171517e-01 4.48 -1.910222852e-01 4.50 -1.859877454e-01 4.52 -1.810057763e-01 4.54 -1.760680246e-01 4.56 -1.711655686e-01 4.58 -1.662889640e-01 4.60 -1.614283120e-01 4.62 -1.565733580e-01 4.64 -1.517136263e-01 4.66 -1.468385984e-01 4.68 -1.419379467e-01 4.70 -1.370018243e-01 4.72 -1.320212150e-01 4.74 -1.269883462e-01 4.76 -1.218971595e-01 4.78 -1.167438256e-01 4.80 -1.115272830e-01 4.82 -1.062497686e-01 4.84 -1.009173006e-01 4.86 -9.554006507e-02 4.88 -9.013263721e-02 4.90 -8.471400707e-02 4.92 -7.930735715e-02 4.94 -7.393955628e-02 4.96 -6.864037225e-02 4.98 -6.344143177e-02 5.00 -5.837498868e-02 5.02 -5.347258889e-02 5.04 -4.876361321e-02 5.06 -4.427349935e-02 5.08 -4.002448744e-02 5.10 -3.603397488e-02 5.12 -3.231387053e-02 5.14 -2.887053407e-02 5.16 -2.570502041e-02 5.18 -2.281357190e-02 5.20 -2.018828644e-02 5.22 -1.781788662e-02 5.24 -1.568852091e-02 5.26 -1.378453976e-02 5.28 -1.208920469e-02 5.30 -1.058530382e-02 5.32 -9.255661030e-03 5.34 -8.083536700e-03 5.36 -7.052926271e-03 5.38 -6.148767596e-03 5.40 -5.357070756e-03 5.42 -4.664984647e-03 5.44 -4.060814156e-03 5.46 -3.534000293e-03 5.48 -3.075073951e-03 5.50 -2.675592069e-03 5.52 -2.328063213e-03 5.54 -2.025867948e-03 5.56 -1.763178004e-03 5.58 -1.534877081e-03 5.60 -1.336485235e-03 5.62 -1.164088081e-03 5.64 -1.014271475e-03 5.66 -8.840619750e-04 5.68 -7.708730924e-04 5.70 -6.724571444e-04 5.72 -5.868624032e-04 5.74 -5.123951569e-04 5.76 -4.475862721e-04 5.78 -3.911618305e-04 5.80 -3.420174227e-04 5.82 -2.991956976e-04 5.84 -2.618668002e-04 5.86 -2.293113544e-04 5.88 -2.009056816e-04 5.90 -1.761089744e-04 5.92 -1.544521793e-04 5.94 -1.355283674e-04 5.96 -1.189843980e-04 5.98 -1.045137051e-04 6.00 -9.185005723e-05 6.02 -8.076216035e-05 6.04 -7.104899084e-05 6.06 -6.253575885e-05 6.08 -5.507041739e-05 6.10 -4.852064291e-05 6.12 -4.277122313e-05 6.14 -3.772179671e-05 6.16 -3.328489675e-05 6.18 -2.938425692e-05 6.20 -2.595334450e-05 6.22 -2.293408931e-05 6.24 -2.027578205e-05 6.26 -1.793411911e-05 6.28 -1.587037401e-05 6.30 -1.405067835e-05 6.32 -1.244539752e-05 6.34 -1.102858848e-05 6.36 -9.777528532e-06 6.38 -8.672305700e-06 6.40 -7.695463663e-06 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