Localization and bandwidth of the 3d-orbitals in magnetic Ni and Co clusters

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Abstract

Photoelectron spectra of negatively charged Nin-, Cun-, and Con- clusters are presented. The spectra of the Nin- clusters contain information about the degree of localization of the 3d valence orbitals, which is strongly related to the magnetic properties. In the clusters with less than 7 atoms, the 3d orbitals seem to be almost totally localized. For CO13- we find indications of a narrowing of the 3d-derived valence "bandwidth" corresponding to a presumed high symmetry and a high degree of degeneracy of the 3d electronic states.

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Morenzin, J., Kietzmann, H., Bechthold, P. S., Ganteför, G., & Eberhardt, W. (2000). Localization and bandwidth of the 3d-orbitals in magnetic Ni and Co clusters. In Pure and Applied Chemistry (Vol. 72, pp. 2149–2157). Walter de Gruyter GmbH. https://doi.org/10.1351/pac200072112149

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