Molecular Modeling of Imidazolium-Based [Tf2N−] Ionic Liquids: Microscopic Structure, Thermodynamic and Dynamic Properties, and Segmental Dynamics

The microscopic structure, thermodynamic properties, local segmental dynamics, and self-diffusion coefficients of three ionic liquids (ILs) with a common anion, namely, the bis(trifluoromethylsulfonyl) imide ([Tf2N−]), and imidazolium-based cations that differ in the alkyl tail length, namely, the 1...

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Veröffentlicht in:	The journal of physical chemistry. B 2009-05, Vol.113 (20), p.7211-7224
Hauptverfasser:	Logotheti, Georgia−Evangelia, Ramos, Javier, Economou, Ioannis G
Format:	Artikel
Sprache:	eng
Schlagworte:	B: Statistical Mechanics, Thermodynamics, Medium Effects
Online-Zugang:	Volltext
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