Mathematical modelling and simulation of the thermo-catalytic decomposition of methane for economically improved hydrogen production

The demand for low-emission hydrogen is set to grow as the world transitions to a future hydrogen economy. Unlike current methods of hydrogen production, which largely derive from fossil fuels with unabated emissions, the thermo-catalytic methane decomposition (TCMD) process is a promising intermediate solution that generates no direct carbon dioxide emissions and can bridge the transition to green hydrogen whilst utilising existing gas infrastructure. This process is yet to see widespread adoption, however, due to the high catalyst turnover costs resulting from the inevitable deactivation of the catalyst, which plays a decisive role in the feasibility of the process. In this study, a feasible TCMD process was identified and a simplified mathematical model was developed, which provides a dynamic estimation for the hydrogen production rate and catalyst turnover costs over various process conditions. The work consisted of a parametric study as well as an investigation into the different process modes. Based on the numerous simulation results it was possible to find the optimal process parameters that maximise the hydrogen production rate and minimise the catalyst turnover costs, therefore increasing the economic potential of the process and hence its commercial viability. (c) 2021 Hydrogen Energy Publications LLC. Published by Elsevier Ltd. All rights reserved.