M3+ lanthanide cation solvation by acetonitrile: The role of cation size, counterions, and polarization effects investigated by molecular dynamics and quantum mechanical simulations

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By jhenin 28 / Mar / 2017
TitleM3+ lanthanide cation solvation by acetonitrile: The role of cation size, counterions, and polarization effects investigated by molecular dynamics and quantum mechanical simulations
Publication TypeJournal Article
Year of Publication2000
AuthorsBaaden M, Berny F, Madic C, Wipff G
JournalJ. Phys. Chem. A
Volume104
Pagination7659–7671
Date Publishedaug
Citation Key2000|1481