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Atomistic simulation of the thermodynamic and transport properties of ionic liquids

Article Abstract:

The thermodynamic and transport properties of ionic liquids (ILs) are examined with the help of atomistic simulations. Results suggest high accuracy in obtaining density and compressibility of ILs.

Author: Maginn, Edward J.

Publisher: American Chemical Society
Publication Name: Accounts of Chemical Research
Subject: Science and technology
ISSN: 0001-4842
Year: 2007

Observations, Chemical thermodynamics

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Simulations of ionic liquids, solutions, and surfaces

Article Abstract:

The effects of modifying features of the force field and their effects on the properties of the liquid are discussed.

Author: Popolo, Mario G. Del, Lynden-Bell, Ruth M., Kohanoff, Jorge, Youngs, Tristan G.A., Hanke, Christof G., Harper, Jason B., Pinilla, Carlos C.

Publisher: American Chemical Society
Publication Name: Accounts of Chemical Research
Subject: Science and technology
ISSN: 0001-4842
Year: 2007

Analysis, Surface chemistry

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Subjects list: Research, Ionic solutions, Chemical properties

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