Hydrogen Bonding and Infrared Spectra of Ethyl-3-methylimidazolium Bis(trifluoromethylsulfonyl)imide/Water Mixtures: A View from Molecular Dynamics Simulations
Piotr Wróbel, Piotr Kubisiak, Andrzej Eilmes
Abstract
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Topics & Concepts
Ionic liquidHydrogen bondImideMoleculeMolecular dynamicsChemistryInfrared spectroscopyInfraredPhysical chemistryAb initio quantum chemistry methodsAb initioComputational chemistryIonic bondingIonOrganic chemistryCatalysisPhysicsOpticsIonic liquids properties and applicationsElectrochemical Analysis and ApplicationsThermodynamic properties of mixtures