  Diffusion invariably involves motion within a medium. An universal behavior
observed is that self diffusivity exhibits a maximum as a function of the size
of the diffusant when the diffusant is confined to a medium, as a result of
what is known as the Levitation Effect. Such a maximum in self diffusivity has
been seen in widely differing medium : microporous solids, dense liquids and
close-packed solids, ions in polar solvents, etc. The effect arises because the
forces exerted on the diffusant by the medium in which it is confined is a
minimum for the size of the diffusant for which self diffusivity is a maximum.
We report here simulations on a diatomic species confined to the cages of
zeolite Y. Several different simulations in which the two atoms of the model
diatomic species interact with equal strength(example, $O_2$, the symmetric
case) and with unequal interaction strengths (example, $CO$, asymmetric case)
are modeled here. Further, the bond length of the diatomic species is varied.
Our results for the symmetric case shows that self diffusivity is maximum for a
large enough bond length which fits snugly into the 12-ring window of zeolite
Y. For weakly asymmetric case, a weak maximum is seen as a function of the bond
length of the diatomic species. However, for strongly asymmetric case, no
maximum in self diffusivity is seen for all the bond lengths studied. This
demonstrates close relation between symmetry and the diffusivity maximum and
provides a direct evidence for the need of force cancellation to observe the
Levitation Effect.
