Improving the efficiency of Monte Carlo simulations of ions using expanded grand canonical ensembles-Reference-Cited by-同舟云学术

Improving the efficiency of Monte Carlo simulations of ions using expanded grand canonical ensembles

Published:2019-10-14 Issue:14 Volume:151 Page:144109
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Hatch Harold W.¹^ORCID,Hall Steven W.²,Errington Jeffrey R.³^ORCID,Shen Vincent K.¹

Affiliation:

1. Chemical Informatics Research Group, Chemical Sciences Division, National Institute of Standards and Technology, Gaithersburg, Maryland 20899-8380, USA

2. Department of Chemical and Biomolecular Engineering, Clemson University, Clemson, South Carolina 29634, USA

3. Department of Chemical and Biological Engineering, University at Buffalo, Buffalo, New York 14260, USA

Funder

National Science Foundation

National Institute of Standards and Technology

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/am-pdf/10.1063/1.5123683

Reference55 articles.

1. Applications of ionic liquids in the chemical industry

2. Ionic Liquids--Solvents of the Future?

3. Using Monte Carlo Simulation to Compute Liquid–Vapor Saturation Properties of Ionic Liquids

4. Grand-canonical Monte Carlo method for Donnan equilibria

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