화학공학소재연구정보센터
International Journal of Hydrogen Energy, Vol.42, No.17, 12681-12695, 2017
Kinetic interplay between hydrogen and carbon monoxide in syngas-fueled catalytic micro-combustors
The combined oxidation of hydrogen and carbon monoxide over platinum in micro combustors at catalytic surface temperatures below 600 K was studied numerically, using a two-dimensional computational fluid dynamics (CFD) model with detailed heterogeneous and homogeneous reaction mechanisms and multicomponent transport. Simulations were performed at different surface temperatures and feed compositions to study the kinetic interplay between hydrogen and carbon monoxide. A sensitivity analysis of the heterogeneous reaction mechanism was performed to identify the rate-controlling steps. Finally, possible mechanisms for the observed behavior were discussed. It was shown that there is significant kinetic interplay between hydrogen and carbon monoxide. Carbon monoxide significantly inhibits the catalytic oxidation of hydrogen. In contrast, the presence of hydrogen was found to promote the catalytic oxidation of carbon monoxide, with the largest effect shown for the small addition of hydrogen, then this effect progressively decreases with the further increase of hydrogen concentration. Accordingly, the apparent reaction order with respect to hydrogen changes from positive to negative, then to zero. The promoting effect of hydrogen can be attributed to the carboxyl pathway, which is crucial to describe the process. (C) 2017 Hydrogen Energy Publications LLC. Published by Elsevier Ltd. All rights reserved.