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cond-mat.soft2017
Revisiting Imidazolium Based Ionic Liquids: Effect of the Conformation Bias of the [NTf] Anion Studied By Molecular Dynamics Simulations
Benjamin Golub, Jan Neumann, Lisa-Marie Odebrecht +2
We study ionic liquids composed 1-alkyl-3-methylimidazolium cations and bis(trifluoromethyl-sulfonyl)imide anions ([CMIm][NTf]) with varying chain-length …
physics.chem-ph2017★ 26 cited
Hydrogen Bonding in Protic Ionic Liquids: Structural Correlations, Vibrational Spectroscopy, and Rotational Dynamics of Liquid Ethylammonium Nitrate
Tobias Zentel, Viviane Overbeck, Dirk Michalik +2
The properties of the hydrogen bonds in ethylammonium nitrate are analyzed by using molecular dynamics simulations and infrared as well as nuclear magnetic resonance experiments. E…