# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2016--Nichol-A-Ackland-G-J--Li # implementation = 2016--Nichol-A--Li--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 Li Li 0.02 5.831078910e+03 0.04 2.622257328e+03 0.06 1.570805453e+03 0.08 1.070318440e+03 0.10 7.627956711e+02 0.12 5.825806948e+02 0.14 4.601442533e+02 0.16 3.723377891e+02 0.18 3.042338968e+02 0.20 2.527725524e+02 0.22 2.139899104e+02 0.24 1.828271796e+02 0.26 1.572791831e+02 0.28 1.354539126e+02 0.30 1.184326938e+02 0.32 1.040166313e+02 0.34 9.186103737e+01 0.36 8.089175467e+01 0.38 7.204970244e+01 0.40 6.438665087e+01 0.42 5.776806138e+01 0.44 5.173477899e+01 0.46 4.661980008e+01 0.48 4.218057726e+01 0.50 3.826312734e+01 0.52 3.472221895e+01 0.54 3.154558406e+01 0.56 2.881550613e+01 0.58 2.636360367e+01 0.60 2.416211986e+01 0.62 2.210332206e+01 0.64 2.034031201e+01 0.66 1.873941176e+01 0.68 1.729769336e+01 0.70 1.593092510e+01 0.72 1.474095914e+01 0.74 1.365934045e+01 0.76 1.267623818e+01 0.78 1.175140460e+01 0.80 1.091609979e+01 0.82 1.016461340e+01 0.84 9.474095207e+00 0.86 8.833144646e+00 0.88 8.230902640e+00 0.90 7.695973353e+00 0.92 7.200010456e+00 0.94 6.742628886e+00 0.96 6.302671431e+00 0.98 5.912418366e+00 1.00 5.549322912e+00 1.02 5.212993825e+00 1.04 4.888021535e+00 1.06 4.593180516e+00 1.08 4.319559386e+00 1.10 4.064407690e+00 1.12 3.821529691e+00 1.14 3.594352126e+00 1.16 3.386633460e+00 1.18 3.191893800e+00 1.20 3.009052731e+00 1.22 2.833371867e+00 1.24 2.674592970e+00 1.26 2.525241020e+00 1.28 2.385743256e+00 1.30 2.250395980e+00 1.32 2.127752346e+00 1.34 2.012612112e+00 1.36 1.904898980e+00 1.38 1.801136384e+00 1.40 1.705177045e+00 1.42 1.615959318e+00 1.44 1.532115517e+00 1.46 1.452434154e+00 1.48 1.376677853e+00 1.50 1.307188292e+00 1.52 1.241585296e+00 1.54 1.179829351e+00 1.56 1.119941849e+00 1.58 1.065392429e+00 1.60 1.013805112e+00 1.62 9.653355916e-01 1.64 9.182036549e-01 1.66 8.749031514e-01 1.68 8.341314736e-01 1.70 7.957123835e-01 1.72 7.587219660e-01 1.74 7.239400277e-01 1.76 6.915646950e-01 1.78 6.609150844e-01 1.80 6.317654366e-01 1.82 6.036539711e-01 1.84 5.778030244e-01 1.86 5.532397107e-01 1.88 5.300261168e-01 1.90 5.073342985e-01 1.92 4.865148010e-01 1.94 4.667369235e-01 1.96 4.480421245e-01 1.98 4.298190151e-01 2.00 4.128560415e-01 2.02 3.968603841e-01 2.04 3.816844602e-01 2.06 3.670678591e-01 2.08 3.531079587e-01 2.10 3.401199098e-01 2.12 3.277419804e-01 2.14 3.159504370e-01 2.16 3.044292585e-01 2.18 2.938221446e-01 2.20 2.836885094e-01 2.22 2.740736949e-01 2.24 2.646086102e-01 2.26 2.558668730e-01 2.28 2.475410270e-01 2.30 2.396287984e-01 2.32 2.319010833e-01 2.34 -5.276613935e-03 2.36 -2.235459360e-01 2.38 -3.442054040e-01 2.40 -4.172138265e-01 2.42 -4.875879977e-01 2.44 -5.539063635e-01 2.46 -6.120113918e-01 2.48 -6.641335668e-01 2.50 -7.116680756e-01 2.52 -7.548737679e-01 2.54 -7.945338560e-01 2.56 -8.309759681e-01 2.58 -8.646939443e-01 2.60 -8.956935412e-01 2.62 -9.242858813e-01 2.64 -9.506655486e-01 2.66 -9.750822229e-01 2.68 -9.975913422e-01 2.70 -1.018240420e+00 2.72 -1.037216692e+00 2.74 -1.054622788e+00 2.76 -1.070615160e+00 2.78 -1.085066507e+00 2.80 -1.098173289e+00 2.82 -1.109973692e+00 2.84 -1.120644968e+00 2.86 -1.130018275e+00 2.88 -1.138253392e+00 2.90 -1.145379675e+00 2.92 -1.151527798e+00 2.94 -1.156604526e+00 2.96 -1.160668180e+00 2.98 -1.163775458e+00 3.00 -1.165990744e+00 3.02 -1.167426429e+00 3.04 -1.168102922e+00 3.06 -1.168102843e+00 3.08 -1.167432211e+00 3.10 -1.166173710e+00 3.12 -1.164182609e+00 3.14 -1.161559352e+00 3.16 -1.158295946e+00 3.18 -1.154479451e+00 3.20 -1.149982660e+00 3.22 -1.144870686e+00 3.24 -1.139147742e+00 3.26 -1.132864756e+00 3.28 -1.125970535e+00 3.30 -1.118456131e+00 3.32 -1.110353792e+00 3.34 -1.101675750e+00 3.36 -1.092447181e+00 3.38 -1.082608605e+00 3.40 -1.072230457e+00 3.42 -1.061322313e+00 3.44 -1.049950628e+00 3.46 -1.038040232e+00 3.48 -1.025658048e+00 3.50 -1.012810297e+00 3.52 -9.995522803e-01 3.54 -9.858402639e-01 3.56 -9.717115362e-01 3.58 -9.571900104e-01 3.60 -9.423054364e-01 3.62 -9.270523279e-01 3.64 -9.114277310e-01 3.66 -8.954709813e-01 3.68 -8.792031441e-01 3.70 -8.626617703e-01 3.72 -8.458004820e-01 3.74 -8.286407329e-01 3.76 -8.111728369e-01 3.78 -7.934002838e-01 3.80 -7.752922394e-01 3.82 -7.568090612e-01 3.84 -7.374308218e-01 3.86 -7.173278727e-01 3.88 -6.968615855e-01 3.90 -6.763744080e-01 3.92 -6.561761878e-01 3.94 -6.365562771e-01 3.96 -6.182873928e-01 3.98 -6.004046316e-01 4.00 -5.813473025e-01 4.02 -5.598603020e-01 4.04 -5.349853598e-01 4.06 -5.061215486e-01 4.08 -4.729946578e-01 4.10 -4.354903095e-01 4.12 -3.943498158e-01 4.14 -3.515305836e-01 4.16 -3.086873122e-01 4.18 -2.671674836e-01 4.20 -2.280298100e-01 4.22 -1.920860190e-01 4.24 -1.597744079e-01 4.26 -1.311542465e-01 4.28 -1.061522752e-01 4.30 -8.460949072e-02 4.32 -6.628797850e-02 4.34 -5.090705797e-02 4.36 -3.818253806e-02 4.38 -2.783209009e-02 4.40 -1.958504844e-02 4.42 -1.317903025e-02 4.44 -8.364440524e-03 4.46 -4.901995125e-03 4.48 -2.561582541e-03 4.50 -1.119264017e-03 4.52 -3.557330859e-04 4.54 -5.442807333e-05 4.56 -1.207771684e-07 4.58 0.000000000e+00 4.60 0.000000000e+00 4.62 0.000000000e+00 4.64 0.000000000e+00 4.66 0.000000000e+00 4.68 0.000000000e+00 4.70 0.000000000e+00 4.72 0.000000000e+00 4.74 0.000000000e+00 4.76 0.000000000e+00 4.78 0.000000000e+00 4.80 0.000000000e+00 4.82 0.000000000e+00 4.84 0.000000000e+00 4.86 0.000000000e+00 4.88 0.000000000e+00 4.90 0.000000000e+00 4.92 0.000000000e+00 4.94 0.000000000e+00 4.96 0.000000000e+00 4.98 0.000000000e+00 5.00 0.000000000e+00 5.02 0.000000000e+00 5.04 0.000000000e+00 5.06 0.000000000e+00 5.08 0.000000000e+00 5.10 0.000000000e+00 5.12 0.000000000e+00 5.14 0.000000000e+00 5.16 0.000000000e+00 5.18 0.000000000e+00 5.20 0.000000000e+00 5.22 0.000000000e+00 5.24 0.000000000e+00 5.26 0.000000000e+00 5.28 0.000000000e+00 5.30 0.000000000e+00 5.32 0.000000000e+00 5.34 0.000000000e+00 5.36 0.000000000e+00 5.38 0.000000000e+00 5.40 0.000000000e+00 5.42 0.000000000e+00 5.44 0.000000000e+00 5.46 0.000000000e+00 5.48 0.000000000e+00 5.50 0.000000000e+00 5.52 0.000000000e+00 5.54 0.000000000e+00 5.56 0.000000000e+00 5.58 0.000000000e+00 5.60 0.000000000e+00 5.62 0.000000000e+00 5.64 0.000000000e+00 5.66 0.000000000e+00 5.68 0.000000000e+00 5.70 0.000000000e+00 5.72 0.000000000e+00 5.74 0.000000000e+00 5.76 0.000000000e+00 5.78 0.000000000e+00 5.80 0.000000000e+00 5.82 0.000000000e+00 5.84 0.000000000e+00 5.86 0.000000000e+00 5.88 0.000000000e+00 5.90 0.000000000e+00 5.92 0.000000000e+00 5.94 0.000000000e+00 5.96 0.000000000e+00 5.98 0.000000000e+00 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