Upscaling Mixing-Controlled Reactions in Unsaturated Porous Media.

We study mixing-controlled chemical reactions in unsaturated porous media from a pore-scale perspective. The spatial heterogeneity induced by the presence of two immiscible phases, here water and air, in the pore space generates complex flow patterns that dominate reactive mixing across scales. To assess the impact of different macroscopic saturation states (the fraction of pore volume occupied by water) on mixing-controlled chemical reactions, we consider a fast irreversible reaction between two initially segregated dissolved species that mix as one solution displaces the other in the heterogeneous flow field of the water phase.

Pore-Scale Mixing and the Evolution of Hydrodynamic Dispersion in Porous Media.

We study the interplay of pore-scale mixing and network-scale advection through heterogeneous porous media, and its role for the evolution and asymptotic behavior of hydrodynamic dispersion. In a Lagrangian framework, we identify three fundamental mechanisms of pore-scale mixing that determine large scale particle motion, namely, the smoothing of intrapore velocity contrasts, the increase of the tortuosity of particle paths, and the setting of a maximum time for particle transitions. Based on these mechanisms, we derive a theory that predicts anomalous and normal hydrodynamic dispersion in terms of the characteristic pore length, Eulerian velocity distribution, and Péclet number.