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Investigating the innate selectivity issues of methane to methanol: consideration of an aqueous environment
The higher reactivity of the methanol product over the methane reactant for the direct oxidation of methane to methanol is explored. C–H activation, C–O coupling, and C–OH coupling are investigated as key steps in the selective oxidation of methane using DFT. These elementary steps are initially con...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
The Royal Society of Chemistry
2021
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8179483/ https://www.ncbi.nlm.nih.gov/pubmed/34163709 http://dx.doi.org/10.1039/d0sc05402j |