Inderdigitation, double twist, and topological defects in a system of hard lollipops

Abstract

ABSTRACT Using hard particle Monte Carlo simulations, we studied a three-dimensional system consisting of identical, lollipop-like particles. Each lollipop was built of five identical, tangent balls placed along a line and one larger ball at one side of the particle and modelled the RM734 molecule, for which ferroelectric and splay nematics were recently discovered in the experiment. Although our model did not recreate these phases, we observed inherently polar type A and C interdigitated smectics. Moreover, an intriguing, isotropic phase consisting of double-twisted clusters joined by planar defects was formed for a moderate packing fraction and ball diameter ratio.