Polarizable molecular dynamics simulations on the conductivity of pure 1-methylimidazolium acetate systems-Reference-Cited by-同舟云学术

Polarizable molecular dynamics simulations on the conductivity of pure 1-methylimidazolium acetate systems

Published:2022 Issue:25 Volume:24 Page:15245-15254
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Joerg Florian¹²^ORCID,Schröder Christian¹^ORCID

Affiliation:

1. University of Vienna, Faculty of Chemistry, Department of Computational Biological Chemistry, Währingerstr. 17, A-1090 Vienna, Austria

2. University of Vienna, Vienna Doctoral School in Chemistry (DoSChem), Währingerstr. 42, A-1090 Vienna, Austria

Abstract

Our polarizable molecular dynamics simulations characterize the protic ionic liquid 1-methylimidazolium acetate which is in equilibrium with its neutral species 1-methylimidazole and acetic acid.

Funder

Austrian Academy of Sciences

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2022/CP/D2CP01501C

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