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. 2005 Sep 26;102(40):14175–14180. doi: 10.1073/pnas.0506183102

Table 1. Parameters for the 3-12 Lennard-Jones surface potential.

Parameter H C F S Co Hg
A 2.26 3.43 2.68 4.22 1.86 3.05
B 2.46 2.98 2.69 3.18 2.33 2.59

Values of A are in Å(kcal/mol)1/3, values of B are in Å(kcal/mol)1/12, values of r are in Å, and those of V are in kcal/mol. The interaction between each atom and a gold surface is V = –(A/r)3 + (B/r)12.