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A quantum chemical molecular dynamics repository of solvated ions

The importance of ion-solvent interactions in predicting specific ion effects in contexts ranging from viral activity through to electrolyte viscosity cannot be underestimated. Moreover, investigations of specific ion effects in nonaqueous systems, highly relevant to battery technologies, biochemica...

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Detalles Bibliográficos
Autores principales:	Gregory, Kasimir P., Elliott, Gareth R., Wanless, Erica J., Webber, Grant B., Page, Alister J.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Nature Publishing Group UK 2022
Materias:	Data Descriptor
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9304403/ https://www.ncbi.nlm.nih.gov/pubmed/35864118 http://dx.doi.org/10.1038/s41597-022-01527-8

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