title: Ab initio molecular dynamics simulations of a binary system of ionic liquids.
abstract: This work presents first insights into the structural properties of a binary mixture of ionic liquids from the perspective of ab initio molecular dynamics simulations. Simulations were carried out for a one-to-one mixture of 1-ethyl-3-methyl-imidazolium thiocyanate and 1-ethyl-3-methyl-imidazolium chloride and compared to pure 1-ethyl-3-methyl-imidazolium thiocyanate.
authors.affiliation: Wilhelm-Ostwald-Institut für Physikalische und Theoretische Chemie, Universität Leipzig, Linnéstr. 2, D-04103 Leipzig, Germany.
authors.forename: Marc
authors.initials: M
authors.lastname: Brüssel
authors.forename: Martin
authors.initials: M
authors.lastname: Brehm
authors.forename: Thomas
authors.initials: T
authors.lastname: Voigt
authors.forename: Barbara
authors.initials: B
authors.lastname: Kirchner