SYMMETRY, NEAR-SYMMETRY AND ENERGETICS

Authors
Citation
Dj. Wales, SYMMETRY, NEAR-SYMMETRY AND ENERGETICS, Chemical physics letters, 285(5-6), 1998, pp. 330-336
Citations number
28
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
ISSN journal
00092614
Volume
285
Issue
5-6
Year of publication
1998
Pages
330 - 336
Database
ISI
SICI code
0009-2614(1998)285:5-6<330:SNAE>2.0.ZU;2-0
Abstract
Is there a connection between symmetry and energetics? Surveys of over 300000 local minima from nine different model systems reveal some cor relation between the degree of symmetry and the mean energy. However, both theory and calculation suggest that the variance may be more impo rtant. Systems with higher symmetry, defined in terms of the spectrum of contributions to the total energy, are more likely to exhibit parti cularly low and high energy minima. This change in viewpoint may be su fficient to account for the widespread appearance of high symmetry. (C ) 1998 Elsevier Science B.V.