Data di Pubblicazione:
2006
Abstract:
The static structure factor of electrons in fullerene has been obtained by a properly designed x-ray diffraction experiment. Due to the intense diffuse scattering caused by the orientational disorder of the C-60 molecules in fullerene, the experiment presented several difficulties. Nonetheless, the data were accurate enough to provide an estimate of the exchange-correlation energy and to make a valuable comparison of the static structure factors of fullerene and diamond. The observed value of the exchange-correlation energy, which is larger in fullerene than in diamond, suggests a clear link between carbon polymorphism and dynamic electron correlations. The experimental data of static structure factor of fullerene, together with the derived exchange-correlation contribution to the cohesion and the pair-correlation function, offer an interesting test on the validity of the local-density treatment of the electron correlations in solids.
Tipologia CRIS:
01.01 Articolo in rivista
Keywords:
STATIC STRUCTURE FACTOR; NEUTRON-SCATTERING; COMPTON-SCATTERING; CROSS-SECTIONS; GAS
Elenco autori:
Petrillo, Caterina
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