ON THE STABILITY OF ENDOHEDRAL RARE-GAS FULLERENES

Authors
Citation
Dp. Clougherty, ON THE STABILITY OF ENDOHEDRAL RARE-GAS FULLERENES, Canadian journal of chemistry, 74(6), 1996, pp. 965-968
Citations number
8
Categorie Soggetti
Chemistry
ISSN journal
00084042
Volume
74
Issue
6
Year of publication
1996
Pages
965 - 968
Database
ISI
SICI code
0008-4042(1996)74:6<965:OTSOER>2.0.ZU;2-Z
Abstract
The stability of He@C-60 and Ne@C-60 is discussed in the context of a spherical model where the carbon atoms are smeared out into a uniform shell. The electronic properties of the 60 pi-electrons together with those of the central atom are treated in the Thomas-Fermi approximatio n. Simple electrostatic reasoning elucidates the nature of the radial stability of the complex. A method to include nonspherical corrections is outlined. Possible bonding topologies of the central atom and the C-60 cage are discussed, as well as the relevance of these topologies to incipient central atom distortions.