The key aim of this Thesis is the development and implementation of a set of simulation techniques for LCs capable of tackling mesoscopic phenomena. In this, we concentrate only on mesh-free particle numerical techniques. Two broad approaches are used, namely bottom-up and top-down.While adopting the bottom-up approach, we employ the DPD method as a foundation for devising a novel LC simulation technique. In this, we associate a traceless symmetric order tensor, Q, with each DPD particle. We then further extend the DPD forces to directly incorporate the Q tensor description so as to recover a more complete representation of LC behaviour. The devised model is verified against a number of qualitative examples and applied to the simulation of ...
We present Monte Carlo computer simulations of model nematic droplets that mimic polymer dispersed l...
Molecular simulation of macromolecular liquid crystal (LC) systems has so far been limited by a numb...
simulation, elastic constants, rotational viscosity, helical twisting powers, atomistic simulation, ...
We present a generalisation of the Modified Smooth Particle Hydrodynamics simulation technique capab...
We use a novel mesh-free simulation approach to study the post aligned bistable nematic (PABN) cell....
A review is presented of molecular and mesoscopic computer simulations of liquid crystalline systems...
Molecular simulations performed on modern computers provide a powerful tool for the investigation of...
This thesis describes an investigation of interactions between colloidal particles immersed in a liq...
This paper describes a robust and efficient numerical scheme for solving the system of six coupled p...
The properties of liquid crystals can be modelled using an order parameter which describes the varia...
We have performed a Monte Carlo simulation of a sub-micrometric twisted nematic cell with nearly 106...
Monte Carlo simulations of electroptical devices based on a nematic Lebwohl-Lasher liquid crystal mo...
Nematic liquid crystals are fluids whose anisometric molecules show long range orientational order b...
This thesis presents all-atom molecular dynamics simulations and the development of coarse-grained m...
Liquid crystals (LCs) refer to a class of materials which have anisotropic properties. They are used...
We present Monte Carlo computer simulations of model nematic droplets that mimic polymer dispersed l...
Molecular simulation of macromolecular liquid crystal (LC) systems has so far been limited by a numb...
simulation, elastic constants, rotational viscosity, helical twisting powers, atomistic simulation, ...
We present a generalisation of the Modified Smooth Particle Hydrodynamics simulation technique capab...
We use a novel mesh-free simulation approach to study the post aligned bistable nematic (PABN) cell....
A review is presented of molecular and mesoscopic computer simulations of liquid crystalline systems...
Molecular simulations performed on modern computers provide a powerful tool for the investigation of...
This thesis describes an investigation of interactions between colloidal particles immersed in a liq...
This paper describes a robust and efficient numerical scheme for solving the system of six coupled p...
The properties of liquid crystals can be modelled using an order parameter which describes the varia...
We have performed a Monte Carlo simulation of a sub-micrometric twisted nematic cell with nearly 106...
Monte Carlo simulations of electroptical devices based on a nematic Lebwohl-Lasher liquid crystal mo...
Nematic liquid crystals are fluids whose anisometric molecules show long range orientational order b...
This thesis presents all-atom molecular dynamics simulations and the development of coarse-grained m...
Liquid crystals (LCs) refer to a class of materials which have anisotropic properties. They are used...
We present Monte Carlo computer simulations of model nematic droplets that mimic polymer dispersed l...
Molecular simulation of macromolecular liquid crystal (LC) systems has so far been limited by a numb...
simulation, elastic constants, rotational viscosity, helical twisting powers, atomistic simulation, ...