Abstract
We present a theoretical study of the electronic properties of some Cn aggregates : C3, C20, C24, C28, C60 ; C3 is linear, the others are polyhedrons. Our calculation includes all the valence electrons. A one-electron description is first developed, then we include intraatomic correlations by using a second order perturbative treatment introduced by J. Friedel for sp v hybridized systems.
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More From: Zeitschrift für Physik D Atoms, Molecules and Clusters
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