Neat ionic liquids: Versus ionic liquid mixtures: A combination of experimental data and molecular simulation

Andreia S.L. Gouveia, Carlos E.S. Bernardes, Elena I. Lozinskaya, Alexander S. Shaplov, José N. Canongia Lopes, Isabel M. Marrucho

Research output: Contribution to journalArticle

1 Citation (Scopus)

Abstract

Simple mixtures of ionic liquids (IL-IL mixtures) can become a promising approach for the substitution of task-specific ILs. Such a concept was explored in this article by comparison of the thermophysical properties of neat 1-ethyl-3-methylimidazolium 2,2,2-trifluoromethylsulfonyl-N-cyanoamide, [C2mim][TFSAM], and equimolar mixtures of two structurally similar ILs having more common ions. Molecular dynamics (MD) simulations were additionally used to further highlight structural aspects of these systems at a molecular level.

Original languageEnglish
Pages (from-to)23305-23309
Number of pages5
JournalPhysical Chemistry Chemical Physics
Volume21
Issue number42
DOIs
Publication statusPublished - 1 Jan 2019

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