Implicit Solvation Methods for Catalysis at Electrified Interfaces

[Image: see text] Implicit solvation is an effective, highly coarse-grained approach in atomic-scale simulations to account for a surrounding liquid electrolyte on the level of a continuous polarizable medium. Originating in molecular chemistry with finite solutes, implicit solvation techniques are...

Descripción completa

Detalles Bibliográficos
Autores principales: Ringe, Stefan, Hörmann, Nicolas G., Oberhofer, Harald, Reuter, Karsten
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9227731/
https://www.ncbi.nlm.nih.gov/pubmed/34928131
http://dx.doi.org/10.1021/acs.chemrev.1c00675

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9227731/
https://www.ncbi.nlm.nih.gov/pubmed/34928131
http://dx.doi.org/10.1021/acs.chemrev.1c00675

Ejemplares similares