A NEW MECHANISM FOR FERROMAGNETISM IN C-60-TDAE

Citation
B. Srinivasan et S. Ramasesha, A NEW MECHANISM FOR FERROMAGNETISM IN C-60-TDAE, Fullerene science and technology, 3(6), 1995, pp. 747-754
Citations number
13
Categorie Soggetti
Chemistry Physical","Physics, Atomic, Molecular & Chemical","Material Science
ISSN journal
1064122X
Volume
3
Issue
6
Year of publication
1995
Pages
747 - 754
Database
ISI
SICI code
1064-122X(1995)3:6<747:ANMFFI>2.0.ZU;2-A
Abstract
Based on the topology of C-60 and the resulting non-disjoint nature of the lowest unoccupied molecular orbitals, Ne propose a new model for ferromagnetic exchange in C-60-TDAE. Within the Hubbard model, we find that the ferromagnetic exchange integral is stabilized to first order in the inter-ball transfer integral, while the antiferromagnetic coup ling is stabilized only to second order. This difference is adequate t o counter the larger phase space available for stabilizing the antifer romagnetic state. Thus, the ground state is found to be ferromagnetic for reasonable inter-ball transfer integrals.