Dynamics of defects around anisotropic particles in nematic liquid crystals under shear.

Abstract

Nematic multiparticle collision dynamics is used to simulate disclination ring defects around spherocylinders suspended in a liquid crystal. A solvent-solute interaction potential is integrated over a short-time scale by an auxiliary molecular dynamics procedure that updates the translational and angular coordinates of the spherocylinders. For suspended particles with length in the range ∼(60,160)nm and a fixed aspect ratio, this method is able to simulate static defects reported previously in the literature. It also simulates orientation fluctuations of the elongated colloids that exhibit a broad distribution and a slow relaxation rate. Finally, a nematic host driven from equilibrium by shear flow is simulated, and the consequent dynamic behavior of the colloid-defect pair is studied. Defects under shear present significant structural transformations from chairlike disclination rings to extended defects that cover most of the cylindrical surface of the colloid. This effect results from the hydrodynamic torque on the nematic field caused by the distorted flow around the spherocylinder, and it is present for small Reynolds and Ericksen numbers of order unity.