Solvent effects of 1-ethyl-3-methylimidazolium acetate: solvation and dynamic behavior of polar and apolar solutes-Reference-Cited by-同舟云学术

Solvent effects of 1-ethyl-3-methylimidazolium acetate: solvation and dynamic behavior of polar and apolar solutes

Published:2015 Issue:13 Volume:17 Page:8480-8490
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Lesch Volker¹²³⁴,Heuer Andreas¹²³⁴,Holm Christian⁵⁶⁷⁴,Smiatek Jens⁵⁶⁷⁴

Affiliation:

1. Institute of Physical Chemistry

2. University of Muenster

3. Muenster

4. Germany

5. Institute for Computational Physics

6. University of Stuttgart

7. Stuttgart

Abstract

We study the solvation properties of the ionic liquid 1-ethyl-3-methylimidazolium acetate ([eMIM]⁺[ACE]⁻) and the resulting dynamic behavior for differently charged model solutes at room temperature via atomistic molecular dynamics (MD) simulations of 500 ns length.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2015/CP/C4CP05312E

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