A density functional theory based approach for predicting melting points of ionic liquids
Author:
Affiliation:
1. Department of Materials Science and Engineering
2. University of Connecticut
3. Storrs
4. USA
5. Chemical Sciences Division
6. Oak Ridge National Laboratory
7. Oak Ridge
Abstract
A DFT-based approach can capture the trends in melting points of ionic liquids upon variation of alkyl substituents in organic cations and replacing one anion by another.
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2017/CP/C6CP08403F
Reference64 articles.
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4. Electrically Induced Ferromagnetism at Room Temperature in Cobalt-Doped Titanium Dioxide
5. Atomic-Scale Characterization of Oxide Thin Films Gated by Ionic Liquid
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