Interfacial Structure of Toluene at an Ionic Liquid/Vapor Interface: A Molecular Dynamics Simulation Investigation

Francois Delaunay (1) , Alfredo-Santiago Rodriguez-Castillo (2) , Annabelle Couvert (2) , Abdeltif Amrane (2) , Pierre-Francois Biard (2) , Anthony Szymczyk , Patrice Malfreyt (3) , Aziz Ghoufi (1)

1 IPR - Institut de Physique de Rennes
2 ISCR - Institut des Sciences Chimiques de Rennes
3 ICCF - Institut de Chimie de Clermont-Ferrand

Mots clés: Interfacial Structure; Ionic-Liquid; Molecular Dynamics Simulations; COV

Domaines: Chimie-Physique [physics.chem-ph]

Francois Delaunay, Alfredo-Santiago Rodriguez-Castillo, Annabelle Couvert, Abdeltif Amrane, Pierre-Francois Biard, et al.. Interfacial Structure of Toluene at an Ionic Liquid/Vapor Interface: A Molecular Dynamics Simulation Investigation. Journal of Physical Chemistry C, 2015, 119 (18), pp.9966-9972. ⟨10.1021/acs.jpcc.5b02081⟩. ⟨hal-01144890⟩