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Cu(4) Cluster Doped Monolayer MoS(2) for CO Oxidation
The catalytic oxidation of CO molecule on a thermodynamically stable Cu(4) cluster doped MoS(2) monolayer is investigated by density functional theory (DFT) where the reaction proceeds in a new formation order of COOOCO* (O(2)* + 2CO* → COOOCO*), OCO* (COOOCO* → CO(2) + OCO*), and CO(2) (OCO* → CO(2...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4459236/ https://www.ncbi.nlm.nih.gov/pubmed/26052674 http://dx.doi.org/10.1038/srep11230 |