Magnetic properties of C-60 calculated by continuous transformation of the origin of the current density
Articolo
Data di Pubblicazione:
1997
Citazione:
Magnetic properties of C-60 calculated by continuous transformation of the origin of the current density / Zanasi, Roberto; Lazzeretti, Paolo; Fowler, P. W.. - In: CHEMICAL PHYSICS LETTERS. - ISSN 0009-2614. - STAMPA. - 278:(1997), pp. 251-255. [10.1016/S0009-2614(97)00983-2]
Abstract:
The strongly diamagnetic character of an isolated molecule of C-60, predicted by several theoretical treatments, is confirmed by a gauge-origin-independent calculation, performed within the CTOCD method at the Hartree-Fock level of approximation and using a large properties-oriented basis set.
Tipologia CRIS:
Articolo su rivista
Keywords:
fullerene; magnetic properties; continuous transformation of the origin of the current density
Elenco autori:
Zanasi, Roberto; Lazzeretti, Paolo; Fowler, P. W.
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