Multi-scale Modeling of Structure, Dynamic and Thermodynamic Properties of Imidazolium-based Ionic Liquids: Ab initio DFT Calculations, Molecular Simulation and Equation of State Predictions

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Title
Multi-scale Modeling of Structure, Dynamic and Thermodynamic Properties of Imidazolium-based Ionic Liquids: Ab initio DFT Calculations, Molecular Simulation and Equation of State Predictions
Authors
Keywords
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Journal
Oil & Gas Science and Technology-Revue d IFP Energies nouvelles
Volume 63, Issue 3, Pages 283-293
Publisher
EDP Sciences
Online
2008-05-20
DOI
10.2516/ogst:2008007

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