Molecular Crystals and Liquid Crystals, Vol.525, 204-211, 2010
Computer Simulation of the Pentagonal Columnar Phase of Liquid Crystalline Bolaamphiphiles
We use dissipative particle dynamics (DPD) simulations to explore the nature of triblock liquid crystalline bolaamphiphiles. We show that the simulations can reproduce the relationships, previously established experimentally, between the molecular dimensions and the phase behaviour. In contrast to other recent simulation studies of bolaamphiphiles, we observe a columnar phase with a pentagonal cross section.
Keywords:Bolaamphiphiles;columnar liquid crystals;computer simulation;dissipative particle dynamics;pentagonal tiling