A Fundamental Investigation of Gas/Solid Heat and Mass Transfer in Structured Catalysts Based on Periodic Open Cellular Structures (POCS)

Ind Eng Chem Res. 2021 Jul 28;60(29):10522-10538. doi: 10.1021/acs.iecr.1c00215. Epub 2021 Jun 15.

Abstract

In this work, we investigate the gas-solid heat and mass transfer in catalytically activated periodic open cellular structures, which are considered a promising solution for intensification of catalytic processes limited by external transport, aiming at the derivation of suitable correlations. Computational fluid dynamics is employed to investigate the Tetrakaidekahedral and Diamond lattice structures. The influence of the morphological features and flow conditions on the external transport properties is assessed. The strut diameter is an adequate characteristic length for the formulation of heat and mass transfer correlations; accordingly, a power-law dependence of the Sherwood number to the Reynolds number between 0.33 and 0.67 was found according to the flow regimes in the range 1-128 of the Reynolds number. An additional -1.5-order dependence on the porosity is found. The formulated correlations are in good agreement with the simulation results and allow for the accurate evaluation of the external transfer coefficients for POCS.