# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2012--Kim-Y-M-Jung-I-H-Lee-B-J--Li # implementation = 2012--Kim-Y-M--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 1.619477233e+01 0.04 1.556783543e+01 0.06 1.496501829e+01 0.08 1.438495845e+01 0.10 1.382641690e+01 0.12 1.328826430e+01 0.14 1.276946871e+01 0.16 1.226908478e+01 0.18 1.178624427e+01 0.20 1.132014753e+01 0.22 1.087005615e+01 0.24 1.043528632e+01 0.26 1.001520308e+01 0.28 9.609215170e+00 0.30 9.216770513e+00 0.32 8.837352245e+00 0.34 8.470475173e+00 0.36 8.115682667e+00 0.38 7.772543916e+00 0.40 7.440651498e+00 0.42 7.119619231e+00 0.44 6.809080276e+00 0.46 6.508685459e+00 0.48 6.218101778e+00 0.50 5.937011089e+00 0.52 5.665108936e+00 0.54 5.402103506e+00 0.56 5.147714713e+00 0.58 4.901673366e+00 0.60 4.663720442e+00 0.62 4.433606425e+00 0.64 4.211090722e+00 0.66 3.995941129e+00 0.68 3.787933365e+00 0.70 3.586850635e+00 0.72 3.392483252e+00 0.74 3.204628276e+00 0.76 3.023089204e+00 0.78 2.847675672e+00 0.80 2.678203190e+00 0.82 2.514492896e+00 0.84 2.356371332e+00 0.86 2.203670233e+00 0.88 2.056226332e+00 0.90 1.913881180e+00 0.92 1.776480976e+00 0.94 1.643876408e+00 0.96 1.515922508e+00 0.98 1.392478502e+00 1.00 1.273407684e+00 1.02 1.158577288e+00 1.04 1.047858365e+00 1.06 9.411256678e-01 1.08 8.382575447e-01 1.10 7.391358300e-01 1.12 6.436457443e-01 1.14 5.516757971e-01 1.16 4.631176929e-01 1.18 3.778662403e-01 1.20 2.958192653e-01 1.22 2.168775259e-01 1.24 1.409446308e-01 1.26 6.792696020e-02 1.28 -2.266411421e-03 1.30 -6.972378960e-02 1.32 -1.345309323e-01 1.34 -1.967711203e-01 1.36 -2.565252254e-01 1.38 -3.138717766e-01 1.40 -3.688870253e-01 1.42 -4.216450072e-01 1.44 -4.722176040e-01 1.46 -5.206746026e-01 1.48 -5.670837529e-01 1.50 -6.115108241e-01 1.52 -6.540196594e-01 1.54 -6.946722295e-01 1.56 -7.335286842e-01 1.58 -7.706474032e-01 1.60 -8.060850451e-01 1.62 -8.398965952e-01 1.64 -8.721354126e-01 1.66 -9.028532749e-01 1.68 -9.321004227e-01 1.70 -9.599256026e-01 1.72 -9.863761092e-01 1.74 -1.011497826e+00 1.76 -1.035335263e+00 1.78 -1.057931599e+00 1.80 -1.079328717e+00 1.82 -1.099567239e+00 1.84 -1.118686567e+00 1.86 -1.136724911e+00 1.88 -1.153719327e+00 1.90 -1.169705748e+00 1.92 -1.184719018e+00 1.94 -1.198792921e+00 1.96 -1.211960212e+00 1.98 -1.224252644e+00 2.00 -1.235701001e+00 2.02 -1.246335124e+00 2.04 -1.256183935e+00 2.06 -1.265275468e+00 2.08 -1.273636890e+00 2.10 -1.281294530e+00 2.12 -1.288273900e+00 2.14 -1.294599719e+00 2.16 -1.300295937e+00 2.18 -1.305385754e+00 2.20 -1.309891643e+00 2.22 -1.313835373e+00 2.24 -1.317238024e+00 2.26 -1.320120008e+00 2.28 -1.322501089e+00 2.30 -1.324400399e+00 2.32 -1.325836456e+00 2.34 -1.326827182e+00 2.36 -1.327389915e+00 2.38 -1.327541430e+00 2.40 -1.327297950e+00 2.42 -1.326675162e+00 2.44 -1.325688232e+00 2.46 -1.324351821e+00 2.48 -1.322680092e+00 2.50 -1.320686733e+00 2.52 -1.318384963e+00 2.54 -1.315787549e+00 2.56 -1.312906822e+00 2.58 -1.309754682e+00 2.60 -1.306342624e+00 2.62 -1.302681740e+00 2.64 -1.298782739e+00 2.66 -1.294655962e+00 2.68 -1.290311391e+00 2.70 -1.285758666e+00 2.72 -1.281007099e+00 2.74 -1.276065688e+00 2.76 -1.270943128e+00 2.78 -1.265647828e+00 2.80 -1.260187922e+00 2.82 -1.254571282e+00 2.84 -1.248805533e+00 2.86 -1.242898060e+00 2.88 -1.236856025e+00 2.90 -1.230686372e+00 2.92 -1.224395842e+00 2.94 -1.217990981e+00 2.96 -1.211478146e+00 2.98 -1.204863515e+00 3.00 -1.198153097e+00 3.02 -1.191352731e+00 3.04 -1.184468098e+00 3.06 -1.177504724e+00 3.08 -1.170467984e+00 3.10 -1.163363102e+00 3.12 -1.156195162e+00 3.14 -1.148969102e+00 3.16 -1.141689721e+00 3.18 -1.134361679e+00 3.20 -1.126989497e+00 3.22 -1.119577560e+00 3.24 -1.112130116e+00 3.26 -1.104651278e+00 3.28 -1.097145021e+00 3.30 -1.089615189e+00 3.32 -1.082065487e+00 3.34 -1.074499488e+00 3.36 -1.066920631e+00 3.38 -1.059332220e+00 3.40 -1.051737431e+00 3.42 -1.044139303e+00 3.44 -1.036540750e+00 3.46 -1.028944554e+00 3.48 -1.021353372e+00 3.50 -1.013769736e+00 3.52 -1.004200808e+00 3.54 -9.668012813e-01 3.56 -8.295804936e-01 3.58 -4.788557596e-01 3.60 0.000000000e+00 3.62 0.000000000e+00 3.64 0.000000000e+00 3.66 0.000000000e+00 3.68 0.000000000e+00 3.70 0.000000000e+00 3.72 0.000000000e+00 3.74 0.000000000e+00 3.76 0.000000000e+00 3.78 0.000000000e+00 3.80 0.000000000e+00 3.82 0.000000000e+00 3.84 0.000000000e+00 3.86 0.000000000e+00 3.88 0.000000000e+00 3.90 0.000000000e+00 3.92 0.000000000e+00 3.94 0.000000000e+00 3.96 0.000000000e+00 3.98 0.000000000e+00 4.00 0.000000000e+00 4.02 0.000000000e+00 4.04 0.000000000e+00 4.06 0.000000000e+00 4.08 0.000000000e+00 4.10 0.000000000e+00 4.12 0.000000000e+00 4.14 0.000000000e+00 4.16 0.000000000e+00 4.18 0.000000000e+00 4.20 0.000000000e+00 4.22 0.000000000e+00 4.24 0.000000000e+00 4.26 0.000000000e+00 4.28 0.000000000e+00 4.30 0.000000000e+00 4.32 0.000000000e+00 4.34 0.000000000e+00 4.36 0.000000000e+00 4.38 0.000000000e+00 4.40 0.000000000e+00 4.42 0.000000000e+00 4.44 0.000000000e+00 4.46 0.000000000e+00 4.48 0.000000000e+00 4.50 0.000000000e+00 4.52 0.000000000e+00 4.54 0.000000000e+00 4.56 0.000000000e+00 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