scholarly journals Enhanced Gas Absorption in the Ionic Liquid 1-n-Hexyl-3-methylimidazolium Bis(trifluoromethylsulfonyl)amide ([hmim][Tf2N]) Confined in Silica Slit Pores: A Molecular Simulation Study

Langmuir ◽  
2013 ◽  
Vol 29 (18) ◽  
pp. 5563-5572 ◽  
Author(s):  
Wei Shi ◽  
David R. Luebke
Keyword(s):  
Ionic Liquid ◽  
Molecular Simulation ◽  
Simulation Study ◽  
Gas Absorption ◽  
Slit Pores

scholarly journals A systematic molecular simulation study of ionic liquid surfaces using intrinsic analysis methods

2012 ◽  
Vol 14 (15) ◽  
pp. 5200 ◽  
Author(s):  
György Hantal ◽  
Iuliia Voroshylova ◽  
M. Natália D. S. Cordeiro ◽  
Miguel Jorge
Keyword(s):  
Ionic Liquid ◽  
Molecular Simulation ◽  
Simulation Study ◽  
Analysis Methods ◽  
Liquid Surfaces

How the spontaneous insertion of amphiphilic imidazolium-based cations changes biological membranes: a molecular simulation study

2015 ◽  
Vol 17 (43) ◽  
pp. 29171-29183 ◽  
Author(s):  
Geraldine S. Lim ◽  
Stephan Jaenicke ◽  
Marco Klähn
Keyword(s):  
Ionic Liquid ◽  
Cell Membrane ◽  
Molecular Simulation ◽  
Simulation Study ◽  
Bacterial Cell ◽  
Biological Membranes ◽  
Bacterial Cell Membrane

The insertion of 1-octyl-3-methylimidazolium cations (OMIM+) from a diluted aqueous ionic liquid (IL) solution into a model of a bacterial cell membrane is investigated.

Molecular simulation study of triangle-well fluids confined in slit pores

2014 ◽  
Vol 112 (15) ◽  
pp. 1969-1978 ◽  
Author(s):  
Angan Sengupta ◽  
Pratik Behera ◽  
Jhumpa Adhikari
Keyword(s):  
Molecular Simulation ◽  
Simulation Study ◽  
Slit Pores
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