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.
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.
Magnetic properties of C-60 calculated by continuous transformation of the origin of the current density
LAZZERETTI, Paolo;
1997
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.
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