Redox-induced formation and cleavage of O-O sigma and pi bonds in a peroxo-bridged manganese dimer: A density functional study
The structural and electronic consequences of reduction and oxidation of a peroxo-bridged Mn2IV/IV dimer, Mn2(μ-O)2(μ-O2)(NH3) 62+, are examined using approximate density functional theory. In both cases, the initial electron-transfer step is localized on the metal centers, but subsequent structural...
| Autors principals: | , |
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| Format: | Journal article |
| Idioma: | English |
| Publicat: |
1999
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