期刊
CHEMICAL COMMUNICATIONS
卷 -, 期 29, 页码 3339-3351出版社
ROYAL SOC CHEMISTRY
DOI: 10.1039/b805384g
关键词
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Room temperature ionic liquids (IL) composed of organic cations and inorganic anions are already being utilized for wide-ranging applications in chemistry. Complementary to experiments, computational modelling has provided reliable details into the nature of their interactions. The intra- and intermolecular structures, dynamic and transport behaviour and morphologies of these novel liquids have also been explored using simulations. The current status of molecular modelling studies is presented along with the prognosis for future work in this area.
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