Cargando…
Proton-coupled electron transfer in the electrocatalysis of CO(2) reduction: prediction of sequential vs. concerted pathways using DFT
Herein we investigate computationally in detail the mechanism of the formation of the carboxylate adduct during the electroreduction of CO(2) in water catalysed by cobalt porphyrin complexes. Specifically, we address qualitatively the competition between the concerted and sequential pathways for the...
| Autores principales: | , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Royal Society of Chemistry
2017
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5298188/ https://www.ncbi.nlm.nih.gov/pubmed/28451193 http://dx.doi.org/10.1039/c6sc02984a |