Intermolecular Interactions: Difference between revisions
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m (New page: Most of the molecules cannot be modelled using spherical interactions. Different strategies have been used to represent the anisotropy of intermolecular interactions: == Site-site intermo...) |
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Within this approach a given molecule is represented by a number of | Within this approach a given molecule is represented by a number of | ||
interaction sites (which can correspond to atoms, chemical groups, etc.) | interaction sites (which can correspond to atoms, chemical groups, etc.). | ||
This site can be [[Lennard-Jones]] center, point charges, point dipoles, etc. | |||
Revision as of 13:13, 22 February 2007
Most of the molecules cannot be modelled using spherical interactions. Different strategies have been used to represent the anisotropy of intermolecular interactions:
Site-site intermolecular potentials
Within this approach a given molecule is represented by a number of interaction sites (which can correspond to atoms, chemical groups, etc.). This site can be Lennard-Jones center, point charges, point dipoles, etc.