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A useful triangular plot of triatomic potential energy surfaces

โœ Scribed by A.J.C. Varandas

Publisher
Elsevier Science
Year
1987
Tongue
English
Weight
585 KB
Volume
138
Category
Article
ISSN
0009-2614

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โœฆ Synopsis

A triangular plot of triatomlc potential energy surfaces is suggested in which the hidden coordinate -the perimeter of the molecule or the sum of squares of the three bond distances -is allowed to relax in order to give the lowest potential energy. This graphIcal representation preserves the full permutational symmetry of the problem. Examples are presented for the H, and HO2 systems.

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