S. Butler et P. Harrowell, THE SHEAR-INDUCED DISORDERING TRANSITION IN A COLLOIDAL CRYSTAL - NONEQUILIBRIUM BROWNIAN DYNAMIC SIMULATIONS, The Journal of chemical physics, 103(11), 1995, pp. 4653-4671
The shear induced disordering transition as observed in a dilute suspe
nsion of charged colloidal particles is modeled using nonequilibrium B
rownian dynamics simulations. We report both real space and reciprocal
space representations of the structure and dynamics of the sequence o
f steady states found as the shear rate is increased. While reproducin
g the observed steady-state structures at low shear rates, the simulat
ed system was found to follow a different path to disorder with increa
sing shear. We find that the disordering process involves the accumula
tion of interstitial-vacancy defects in the shearing crystal as the sh
ear rate increases. The disordering transition is also shown to exhibi
t an anisotropic dependence on system size. These two observations are
combined in a new picture of the shear induced disordering transition
. In this model a nonequilibrium defect density, generated by the coup
ling of long-wavelength fluctuations with the shear flow, eventually r
esults in a collective disordering similar to the process of defect-in
duced amorphization in atomic solids. (C) 1995 American Institute of P
hysics.