C-60 VIBRATES AS A HOLLOW SPHERE

Citation
A. Ceulemans et al., C-60 VIBRATES AS A HOLLOW SPHERE, The Journal of chemical physics, 100(8), 1994, pp. 5491-5500
Citations number
37
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
ISSN journal
00219606
Volume
100
Issue
8
Year of publication
1994
Pages
5491 - 5500
Database
ISI
SICI code
0021-9606(1994)100:8<5491:CVAAHS>2.0.ZU;2-I
Abstract
A model for the vibrations of a cage molecule in terms of the motions of an infinitely thin spherical shell is applied to icosahedral C60. W hen appropriate values are given to the two free parameters, the model accounts for the general pattern, energy ordering, radial, and tangen tial characteristics of the vibrations, giving results comparable to t hose from a six-parameter conventional valence force field. In the mod el, the lowest frequency of any spherical-shell molecule is the ''d'' squashing deformation that describes tidal waves on a flooded planet.