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On the Stability of Endohedral Rare Gas Fullerenes

Dennis P. Clougherty

chem-pharXiv:chem-ph/9605004

Abstract

The stability of Ne@C60 and He@C60 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 sixty π electrons together with those of the central atom are treated in the Thomas-Fermi approximation. Simple electrostatic reasoning elucidates the nature of the radial stability of the complex. A method to include non-spherical corrections is outlined. Possible bonding topologies of the central atom and the C60 cage are discussed, as well as the relevance of these topologies to incipient central atom distortions.

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