Duct reactors boundary conditions

Reactor performance is established by calculating the molar density of reactant A from a steady-state mass balance that accounts for axial convection and transverse diffusion. Chemical reaction only occurs on the well-defined catalytic surface which bounds fluid flow in the regular polygon channel. Hence, depletion of reactant A due to chemical reaction appears in the boundary conditions, but not in the mass balance which applies volumetrically throughout the homogeneous flow channel. The mass transfer equation for duct reactors is written in vector form ... 

Unlike porous pellets, it is mathematically feasible to account for chemical reaction on the well-defined catalytic surfaces that bound the flow regime in regular polygon duct reactors. A qualitative description of the boundary conditions is based on a steady-state mass balance over a differential surface element. Since convective transport vanishes on the stationary catalytic surface, the following contributions from diffusion and chemical reaction are equated, with units of moI/(areatime) ... 

This comparison focuses on the comer regions in square ducts that are nonexistent in tubes. In both configurations, the momentum boundary layer thickness is substantial (i.e., Effective/2) for fully developed laminar flow. The no-slip boundary condition for viscous flow near the walls increases the mass transfer boundary layer thickness and reduces the flux of reactants toward the catalytic surface relative to plug flow. This effect is significant in the comer regions of the channel with square cross section. Since the entire active surface in heterogeneous tubular reactors is equally accessible to reactants, one predicts larger conversion in tubes via equation (23-71) ... 

There are many chemically reacting flow situations in which a reactive stream flows interior to a channel or duct. Two such examples are illustrated in Figs. 1.4 and 1.6, which consider flow in a catalytic-combustion monolith [28,156,168,259,322] and in the channels of a solid-oxide fuel cell. Other examples include the catalytic converters in automobiles. Certainly there are many industrial chemical processes that involve reactive flow tubular reactors. Innovative new short-contact-time processes use flow in catalytic monoliths to convert raw hydrocarbons to higher-value chemical feedstocks [37,99,100,173,184,436, 447]. Certain types of chemical-vapor-deposition reactors use a channel to direct flow over a wafer where a thin film is grown or deposited [219]. Flow reactors used in the laboratory to study gas-phase chemical kinetics usually strive to achieve plug-flow conditions and to minimize wall-chemistry effects. Nevertheless, boundary-layer simulations can be used to verify the flow condition or to account for non-ideal behavior [147]. 

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