Modeling of H2 Permeation through Electroless Pore-Plated Composite Pd Membranes Using Computational Fluid Dynamics

This work focused on the computational fluid dynamics (CFD) modeling of H-2/N-2 separation in a membrane permeator module containing a supported dense Pd-based membrane that was prepared using electroless pore-plating (ELP-PP). An easy-to-implement model was developed based on a source-sink pair formulation of the species transport and continuity equations. The model also included the Darcy-Forcheimer formulation for modeling the porous stainless steel (PSS) membrane support and Sieverts' law for computing the H-2 permeation flow through the dense palladium film. Two different reactor configurations were studied, which involved varying the hydrogen flow permeation direction (in-out or out-in). A wide range of experimental data was simulated by considering the impact of the operating conditions on the H-2 separation, such as the feed pressure and the H-2 concentration in the inlet stream. Simulations of the membrane permeator device showed an excellent agreement between the predicted and experimental data (measured as permeate and retentate flows and H-2 separation). Molar fraction profiles inside the permeator device for both configurations showed that concentration polarization near the membrane surface was not a limit for the hydrogen permeation but could be useful information for membrane reactor design, as it showed the optimal length of the reactor.

Automated summary

This work uses computational fluid dynamics to simulate H-2/N-2 separation in a membrane permeator, studying the effects of different reactor configurations on separation efficiency and validating the simulation results with experimental data.