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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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Detalles Bibliográficos
Autores principales: Keil, Helena, Hellström, Matti, Stückl, Claudia, Herbst‐Irmer, Regine, Behler, Jörg, Stalke, Dietmar
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6916324/
https://www.ncbi.nlm.nih.gov/pubmed/31361370
http://dx.doi.org/10.1002/chem.201902303