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Jahn‐Teller Effects in a Vanadate‐Stabilized Manganese‐Oxo Cubane Water Oxidation Catalyst
Heuristic rules that allow identifying the preferred mixed‐valence isomers and Jahn‐Teller axis arrangements in the water oxidation catalyst [(Mn(4)O(4))(V(4)O(13))(OAc)(3)]( n−) and its activated form [(Mn(4)O(4))(V(4)O(13))(OAc)(2)(H(2)O)(OH)]( n−) are derived. These rules are based on computing a...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
John Wiley and Sons Inc.
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9298120/ https://www.ncbi.nlm.nih.gov/pubmed/34643965 http://dx.doi.org/10.1002/chem.202102539 |