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Exploring the Catalytic Properties of Unsupported and TiO(2)-Supported Cu(5) Clusters: CO(2) Decomposition to CO and CO(2) Photoactivation

[Image: see text] In this work, we explore the decomposition of CO(2) on unsupported and TiO(2)-supported Cu(5) clusters via computational modeling, using both finite cluster and periodic slab structures of the rutile TiO(2)(110) surface. While the energy needed for C=O bond breaking is already sign...

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Detalles Bibliográficos
Autores principales:	López-Caballero, Patricia, Hauser, Andreas W., Pilar de Lara-Castells, María
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2019
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6777821/ https://www.ncbi.nlm.nih.gov/pubmed/31598186 http://dx.doi.org/10.1021/acs.jpcc.9b06620

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