The self-diffusion coefficient of water in ferrierite at an average density of 6.6 molecules per unit cell and at 298K was deduced from a molecular dynamics simulation and the Einstein relation. The estimated value of the self-diffusion coefficient was 0.5 x 10-5cm2/s, and agreed with experimental results.

Determination of the Self-Diffusion Coefficient of Water in Ferrierite by Molecular Dynamics. Leherte, L., Lie, G.C., Swamy, K.N., Clementi, E., Derouane, E.G., André, J.M.: Chemical Physics Letters, 1988, 145[3], 237-41