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Ru-Catalyzed Steam Methane Reforming: Mechanistic Study from First Principles Calculations
[Image: see text] Elucidating the reaction mechanism of steam methane reforming (SMR) is imperative for the rational design of catalysts for efficient hydrogen production. In this paper, we provide mechanistic insights into SMR on Ru surface using first principles calculations based on dispersion-co...
Autores principales: | Arevalo, Ryan Lacdao, Aspera, Susan Meñez, Sison Escaño, Mary Clare, Nakanishi, Hiroshi, Kasai, Hideaki |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical
Society
2017
|
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6640994/ https://www.ncbi.nlm.nih.gov/pubmed/31457505 http://dx.doi.org/10.1021/acsomega.6b00462 |
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