The formation of biaxial nematic phases in binary mixtures of
thermotropic liquid-crystals composed of uniaxial molecules
thermotropic liquid-crystals composed of uniaxial molecules
Author(s)
Skutnik, Robert A
Lehmann, Louis
Puschel-Schlotthauer, Sergej
Jackson, George
Schoen, Martin
Type
Journal Article
Abstract
Monte Carlo simulations in the isothermal-isobaric ensemble are used to investigate the formation of an ordered, biaxial nematic phase in a binary mixture of thermotropic liquid crystals. The orientational dependence of the interaction between molecules of each pure component is the same as in the well-known Maier-Saupe model; each pure component of the mixture is therefore capable of forming a uniaxial nematic phase. For the interaction between molecules of different components, we use the same Maier-Saupe model but change the sign of the coupling constant. As a consequence a T-shaped arrangement of these molecules is energetically favoured. The formation of the biaxial phase occurs in two steps. At higher temperatures T, one of the components forms a uniaxial nematic phase whereas the other is in a quasi two-dimensional restricted isotropic liquid state. We develop a simple theoretical model to understand the high degree of (ostensible) nematic order in the latter. At lower T, the second component becomes nematic and then the entire mixture of the two compounds has biaxial symmetry. The biaxial nematic phase does not demix into domains rich in molecules of one or the other species.
Date Issued
2019-04-08
Date Acceptance
2019-02-06
Citation
Molecular Physics, 2019, 117 (20), pp.2830-2845
ISSN
0026-8976
Publisher
Taylor & Francis
Start Page
2830
End Page
2845
Journal / Book Title
Molecular Physics
Volume
117
Issue
20
Copyright Statement
© 2019 The Author(s). Published by Informa UK Limited, trading as Taylor & Francis Group
This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/4.0/), which permits unrestricted use,
distribution, and reproduction in any medium, provided the original work is properly cited.
This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/4.0/), which permits unrestricted use,
distribution, and reproduction in any medium, provided the original work is properly cited.
Sponsor
Engineering & Physical Science Research Council (EPSRC)
Engineering & Physical Science Research Council (EPSRC)
Grant Number
EP/E016340/1
EP/J014958/1
Subjects
Science & Technology
Physical Sciences
Chemistry, Physical
Physics, Atomic, Molecular & Chemical
Chemistry
Physics
Liquid crystal
binary mixture
nematic phase
biaxiality
Monte Carlo simulation
MONTE-CARLO
TRANSITIONS
BEHAVIOR
DIAGRAM
RODLIKE
SYSTEMS
0202 Atomic, Molecular, Nuclear, Particle and Plasma Physics
0306 Physical Chemistry (incl. Structural)
0307 Theoretical and Computational Chemistry
Chemical Physics
Publication Status
Published
Date Publish Online
2019-04-08