Publication Type |
Journal Article |
Title |
Neat ionic liquids versus ionic liquid mixtures: a combination of experimental data and molecular simulation |
Authors |
Andreia S. L. Gouveia Carlos E. S. Bernardes Elena I. Lozinskaya Alexander S. Shaplov José Nuno Canongia Lopes Isabel Marrucho |
Groups |
MET |
Journal |
PHYSICAL CHEMISTRY CHEMICAL PHYSICS |
Year |
2019 |
Month |
November |
Volume |
21 |
Number |
42 |
Pages |
23305-23309 |
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, [C(2)mim][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. |
DOI |
http://dx.doi.org/10.1039/c9cp03021b |
ISBN |
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Publisher |
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Book Title |
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ISSN |
1463-9076 |
EISSN |
1463-9084 |
Conference Name |
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Bibtex ID |
ISI:000495070100003 |
Observations |
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