Molecular dynamics simulations of imidazolium-based ionic liquid/water mixtures: Alkyl side chain length and anion effects

2010 ◽  
Vol 294 (1-2) ◽  
pp. 148-156 ◽  
Author(s):  
Shulu Feng ◽  
Gregory A. Voth
Keyword(s):  
Molecular Dynamics ◽  
Ionic Liquid ◽  
Molecular Dynamics Simulations ◽  
Chain Length ◽  
Liquid Water ◽  
Side Chain ◽  
Alkyl Side Chain ◽  
Side Chain Length ◽  
Dynamics Simulations

Polymerized ionic liquid diblock copolymers with long alkyl side-chain length

Polymer ◽  
2014 ◽  
Vol 55 (16) ◽  
pp. 3360-3369 ◽  
Author(s):  
Jacob R. Nykaza ◽  
Yuesheng Ye ◽  
Yossef A. Elabd
Keyword(s):  
Ionic Liquid ◽  
Chain Length ◽  
Diblock Copolymers ◽  
Side Chain ◽  
Alkyl Side Chain ◽  
Side Chain Length ◽  
Polymerized Ionic Liquid

Structural properties of geminal dicationic ionic liquid/water mixtures: a theoretical and experimental insight

2016 ◽  
Vol 18 (24) ◽  
pp. 16544-16554 ◽  
Author(s):  
Alessandra Serva ◽  
Valentina Migliorati ◽  
Andrea Lapi ◽  
Giuliana Aquilanti ◽  
Alessandro Arcovito ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Ionic Liquid ◽  
Molecular Dynamics Simulations ◽  
Structural Properties ◽  
Liquid Water ◽  
Exafs Spectroscopy ◽  
Dicationic Ionic Liquid ◽  
Dynamics Simulations

The structural properties of geminal dicationic ionic liquid/water mixtures have been investigated using EXAFS spectroscopy and molecular dynamics simulations.

Structure and Dynamics of Uranyl(VI) and Plutonyl(VI) Cations in Ionic Liquid/Water Mixtures via Molecular Dynamics Simulations

2013 ◽  
Vol 117 (37) ◽  
pp. 10852-10868 ◽  
Author(s):  
Katie A. Maerzke ◽  
George S. Goff ◽  
Wolfgang H. Runde ◽  
William F. Schneider ◽  
Edward J. Maginn
Keyword(s):  
Molecular Dynamics ◽  
Ionic Liquid ◽  
Molecular Dynamics Simulations ◽  
Liquid Water ◽  
Structure And Dynamics ◽  
Dynamics Simulations
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