Rheologica Acta, Vol.38, No.6, 548-561, 1999
Lattice modelling of nematodynamics
The microstructures of textured nematics under shear are investigated by means of a director lattice model incorporating linear shear response as well as elastic interactions between neighbouring directors. The model can be understood as a lattice implementation of the so-called nematodynamics equation for a constant uniaxial order parameter. The dimensionless number governing the model is found to be a mesoscale Ericksen number, which scales with the square of the lattice cell size. It is shown that the predicted microstructure depends strongly on the scale of that number. In particular, disclination loops are found to grow for a range of mesoscale Ericksen numbers, while below or above that they disappear. We apply the model to investigate the director profiles of tumbling nematics. If the orientations are restricted to lying in the vorticity plane, we reproduce the director wind-up layers and distortion saturation predicted theoretically. In the full three-dimensional case an initially poly-domain director field evolves to a vorticity-aligned state up to a critical Ericksen number, above which inplane orientations with distortion saturation are found. The simulations hence reproduce the transition from log-rolling to flow aligning with increasing shear rate observed experimentally.
Keywords:LIQUID-CRYSTALLINE POLYMERS;RODLIKE POLYMERS;SHEAR-FLOW;ORIENTATION;DYNAMICS;MICROSTRUCTURE;SIMULATION;PREDICTION;RHEOLOGY;BEHAVIOR