Electron delocalization in trinuclear mixed-valence clusters

Possible trapped valence states in trimeric mixed-valence clusters are considered. The adiabatic potential in the space of a doubly-degenerate e vibration is calculated. Conditions under which minima with different electron distributions exist are determined. The coexistence of localized and delocal...

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Bibliographic Details
Published in:Chemical physics letters 1982-01, Vol.89 (5), p.381-384
Main Authors: Borshch, S.A., Kotov, I.N., Bersuker, I.B.
Format: Article
Language:English
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Summary:Possible trapped valence states in trimeric mixed-valence clusters are considered. The adiabatic potential in the space of a doubly-degenerate e vibration is calculated. Conditions under which minima with different electron distributions exist are determined. The coexistence of localized and delocalized distributions is possible.
ISSN:0009-2614
1873-4448
DOI:10.1016/0009-2614(82)80005-5