A. Darinsky et al., COMPUTER-SIMULATIONS OF MOLECULAR-MOTION IN LIQUID-CRYSTALS BY THE METHOD OF BROWNIAN DYNAMICS, Makromolekulare Chemie. Theory and simulations, 2(4), 1993, pp. 523-530
Computer simulations of the molecular motion of polymer chains in the
presence of a strong nematic field were carried out by the method of B
rownian dynamics. Two models were studied: the first model (linear liq
uid crystal) is a freely jointed chain with rigid bonds, the second mo
del (comb-like liquid crystal) is a chain with fixed bond angles and r
igid side groups. The influence of ordering on chain conformations, or
ientational and translational mobility and spectra of relaxation times
was investigated.