Cation-Anion and Cation-Cation Interactions in Mixtures of Hydroxy-functionalized and Aprotic Ionic Liquids

Cation-Anion and Cation-Cation Interactions in Mixtures of Hydroxy-functionalized and Aprotic Ionic Liquids

A combination of molecular dynamics simulations, quantum chemical calculations, and vibrational spectroscopy is employed to study ionic interactions in 1-(2-hydroxyethyl)-3-methylimidazolium bis(trifluoromethanesulfonyl)imide [C2OHmim]NTf2, 1-methyl-3-propylimidazolium bis(trifluoromethanesulfonyl)i...

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Bibliographic Details
Main Authors: Karina Shimizu, Adilson Alves de Freitas, Christopher M. Burba
Format: Article
Language:English
Published: Elsevier 2022-06-01
Series:Journal of Ionic Liquids
Subjects:
Ionic Liquid
Vibrational Spectroscopy
Molecular Dynamics
Hydrogen Bonding
Online Access:http://www.sciencedirect.com/science/article/pii/S2772422022000064

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http://www.sciencedirect.com/science/article/pii/S2772422022000064

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