title: Mode-coupling theoretical study on the roles of heterogeneous structure in rheology of ionic liquids.
abstract: Theoretical calculations of the rheological properties of coarse-grained model ionic liquids were performed using mode-coupling theory. The nonpolar part of the cation was systematically increased in order to clarify the effects of the heterogeneous structure on shear viscosity. The shear viscosity showed a minimum as the function of the size of the nonpolar part, as had been reported in literatures. The minimum was ascribed to the interplay between the increase in the shear relaxation time and the decrease in the high-frequency shear modulus with increasing the size of the nonpolar part of the cation. The ionic liquids with symmetric charge distribution of cations were less viscous than those with asymmetric cations, which is also in harmony with experiments. The theoretical analysis demonstrated that there are two mechanisms for the higher viscosity of the asymmetric model. The first one is the direct coupling between the domain dynamics and the shear stress. The second one is that the microscopic dynamics within the polar domain is retarded due to the nonlinear coupling with the heterogeneous structure.
authors.affiliation: Department of Molecular Design and Engineering, Graduate School of Engineering, Furo-cho B2-3 (611), Chikusa, Nagoya, Aichi 464-8603, Japan.
authors.forename: Tsuyoshi
authors.initials: T
authors.lastname: Yamaguchi