Cargando...

Computational study of the cerium(III) ion in aqueous environment

This work comprises the first quantum chemical simulation study of the Ce(3+) ion in aqueous environment. The structural and dynamical properties have been investigated by means of the quantum mechanical charge field (QMCF) molecular dynamics (MD) approach and the results, where applicable, have bee...

Descrición completa

Gardado en:
Detalles Bibliográficos
Main Authors: Lutz, Oliver M.D., Hofer, Thomas S., Randolf, Bernhard R., Rode, Bernd M.
Formato: Artigo
Idioma:Inglês
Publicado: North Holland 2012
Assuntos:
Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC3617731/
https://ncbi.nlm.nih.gov/pubmed/23564963
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.cplett.2012.05.023
Tags: Engadir etiqueta
Sen Etiquetas, Sexa o primeiro en etiquetar este rexistro!