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New Insights into the Catalytic Activity of Cobalt Orthophosphate Co(3)(PO(4))(2) from Charge Density Analysis

An extensive characterization of Co(3)(PO(4))(2) was performed by topological analysis according to Bader‘s Quantum Theory of Atoms in Molecules from the experimentally and theoretically determined electron density. This study sheds light on the reactivity of cobalt orthophosphate as a solid‐state h...

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Detalhes bibliográficos
Publicado no:Chemistry
Main Authors: Keil, Helena, Hellström, Matti, Stückl, Claudia, Herbst‐Irmer, Regine, Behler, Jörg, Stalke, Dietmar
Formato: Artigo
Idioma:Inglês
Publicado em: John Wiley and Sons Inc. 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6916324/
https://ncbi.nlm.nih.gov/pubmed/31361370
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/chem.201902303
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