Theoretical Insights into Specific Ion Effects and Strong‐Weak Acid‐Base Rules for Ions in Solution: Deriving the Law of Matching Solvent Affinities from First Principles

We present a detailed study of specific ion effects, volcano plots and the law of matching solvent affinities by means of a conceptual density functional theory (DFT) approach. Our results highlight that specific ion effects and the corresponding implications on the solvation energy are mainly due t...

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Detalles Bibliográficos
Autores principales: Miranda‐Quintana, Ramón Alain, Smiatek, Jens
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2020
Materias:
Articles
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7756232/
https://www.ncbi.nlm.nih.gov/pubmed/32975891
http://dx.doi.org/10.1002/cphc.202000644

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7756232/
https://www.ncbi.nlm.nih.gov/pubmed/32975891
http://dx.doi.org/10.1002/cphc.202000644

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