The flexibility of COMSOL means that a reaction can result in nearly any reaction rate contribution. But a reactant, with mass fraction ωi, can physically only be consumed if
ωi > 0. Correspondingly a product can only be formed when
ωi < 1. The Reaction feature in Transport of Concentrated Species Interface contains a way to regularize the rate expression and comply with these restrictions.
If the mass fraction for a reactant species ωi becomes smaller than its
Damping limit,
ωidl, the rate expression is reduced linearly. If
ωi ≤ 0 for a reactant species, the reaction rate contribution to that species is completely removed. Similarly, if the mass fraction for a product species
ωj becomes larger than
1 − ωjdl, the rate expression added is damped linearly. If
ωj ≥ 1 for a product species, the reaction rate contribution to that species is completely removed.
The default value for the Damping limit,
ωidl, is
10−6, which is appropriate for most applications, but can require adjustment when working with for example catalytic trace species.