R. Azuma et H. Takayama, Diffusion of single long polymers in fixed and low density matrix of obstacles confined to two dimensions, J CHEM PHYS, 111(18), 1999, pp. 8666-8671
Diffusion properties of a self-avoiding polymer embedded in regularly distr
ibuted obstacles with spacing a = 20 and confined in two dimensions is stud
ied numerically using the extended bond fluctuation method which we have de
veloped recently. We have observed for the first time to our knowledge, tha
t the mean square displacement of a center monomer phi(M/2) (t) exhibits fo
ur dynamical regimes, i.e., phi(M/2) (t) similar to t(nu m) with nu(m) simi
lar to 0.6, 3/8, 3/4, and 1 from the shortest to longest time regimes. The
exponents in the second and third regimes are well described by segmental d
iffusion in the "self-avoiding tube.'' In the fourth (free diffusion) regim
e, we have numerically confirmed the relation between the reptation time ta
u(d) and the number of segments M, tau(d)proportional to M-3. (C) 1999 Amer
ican Institute of Physics. [S0021-9606(99)51442-6].