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A new formulation of three-body dynamical correlation energy for explicit potential functions

✍ Scribed by A.J.C. Varandas

Publisher: Elsevier Science
Year: 1992
Tongue: English
Weight: 561 KB
Volume: 194
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(92)86060-u

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✦ Synopsis

A new formulation of the three-body dynamical correlation energy is presented which allows a correct description of the anisotropic long-range forces for all atom-diatom dissociation channels of a triatomic system, including the known dependence on the diatomic intramolecular coordinate. Illustrative results are reported for H3.

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