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Computational mechanistic studies of ruthenium catalysed methanol dehydrogenation

Homogeneous ruthenium catalysed methanol dehydrogenation could become a key reaction for hydrogen production in liquid fuel cells. In order to improve existing catalytic systems, mechanistic insight is paramount in directing future studies. Herein, we describe what computational mechanistic research...

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Detalles Bibliográficos
Autores principales:	de Zwart, Felix J., Sinha, Vivek, Trincado, Monica, Grützmacher, Hansjörg, de Bruin, Bas
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2022
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8862544/ https://www.ncbi.nlm.nih.gov/pubmed/35079760 http://dx.doi.org/10.1039/d1dt04168a

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