Gr. Haynes et al., A THEORY FOR THE ACTIVATED BARRIER CROSSING RATE-CONSTANT IN SYSTEMS INFLUENCED BY SPACE AND TIME-DEPENDENT FRICTION, The Journal of chemical physics, 101(9), 1994, pp. 7811-7822
A general theory is presented for the thermally activated rate constan
t in systems influenced by spatially dependent and. time correlated fr
iction. The theory is valid at all damping strengths and goes uniforml
y from the energy diffusion limit to the spatial diffusion limit. Resu
lts of the theory for a model system with an exponentially time correl
ated and spatially dependent friction kernel are compared with results
from a numerically exact solution of the equivalent generalized Lange
vin equation. Predictions of the theory are found to be in excellent a
greement with the numerical simulation results. The phenomenon of memo
ry suppression of the rate is observed for long time scale frictions a
nd its modification due to the spatial dependence of the friction is d
iscussed. The effects of spatially dependent friction can be understoo
d through a quantity called the ''average spatial modification'' of th
e coupling between the reaction coordinate and the environment.