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Trends in C–O and N–O bond scission on rutile oxides described using oxygen vacancy formation energies
Reactivity trends on transition metals can generally be understood through the d-band model, but no analogous theory exists for transition metal oxides. This limits the generality of analyses in oxide-based catalysis and surface chemistry and has motivated the appearance of numerous descriptors. Her...
Autores principales: | Su, Hai-Yan, Ma, Xiufang, Sun, Keju, Sun, Chenghua, Xu, Yongjun, Calle-Vallejo, Federico |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8152721/ https://www.ncbi.nlm.nih.gov/pubmed/34122877 http://dx.doi.org/10.1039/d0sc00534g |
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