Intermolecular potential for c60 molecule: Difference between revisions
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Eloy.ramos (talk | contribs) (Created page with "The '''Approximate non-conformal potential''' ('''ANC''') for the C60 fullerene is given by (Eq 6 in <ref>[http://dx.doi.org/10.1016/j.chemphys.2017.05.014 Jesús Eloy Ramos "...") |
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Revision as of 00:26, 3 January 2018
The Approximate non-conformal potential (ANC) for the C60 fullerene is given by (Eq 6 in [1]):
where
- = 1.0281 nm
- = 0.09574 is the hard-core diameter in units of
- = 3297.28 K is the well depth
- = 0.4120 is a softness parameter