The properties of sealing materials are important for the performance and reliability of solid oxide fuel cells (SOFCs). Even if the properties of a sealing material can be studied separately, it remains difficult to quantify the effect of an imperfect seal on the repeat-element behavior. In this study, simulation is used to investigate the effects of an imperfect seal behavior on the performance and reliability of SOFCs. Diffusion through the sealing material and inherent local combustion of fuel are added to the computational fluid dynamics (CFD) repeat-element model, which also allows us to compute the flow field, the electrochemical reactions, and the energy equations. The results are in good agreement with experiments. The zones of parasitic combustion and local overheating are well reproduced. Furthermore, the model predicts a risk of reoxidation under polarization that is well observed. The model also shows the necessity to take into account the diffusion transport for the development of compressive seal materials, hence verifying the hypotheses made by other groups. The modeling approach presented here, which includes the imperfections of components, allows us to reproduce experiments with good accuracy and gives a better understanding of degradation processes. With its reasonable computational cost, it is a powerful tool for a design of SOFC based on reliability.
A proof-of-concept prototype of a heterogeneous catalytic reactor has been developed for continuous production of hydrogen via formic acid (FA) dehydrogenation. A laboratory-type polymer electrolyte fuel cell (PEFC) fed with the resulting reformate gas stream (H 2 + CO 2 ) was applied to convert chemical energy to electricity. To implement an efficient coupling of the reactor and PEFC, research efforts in interrelated areas were undertaken: (1) solid catalyst development and testing for H 2 production; (2) computer modeling of heat and mass transfer to optimize the reactor design; (3) study of compatibility of the reformate gas fuel (H 2 + CO 2 ) with a PEFC; and (4) elimination of carbon monoxide impurities via preferential oxidation (PROX). During the catalyst development, immobilization of the ruthenium(II)−meta-trisulfonated triphenylphosphine, Ru-mTPPTS, catalyst on different supports was performed, and this complex, supported on phosphinated polystyrene beads, demonstrated the best results. A validated mathematical model of the catalytic reactor with coupled heat transfer, fluid flow, and chemical reactions was proposed for catalyst bed and reactor design. Measured reactor operating data and characteristics were used to refine modeling parameters. In turn, catalyst bed and reactor geometry were optimized during an iterative adaptation of the reactor and model parameters. PEFC operating conditions and fuel gas treatment/purification were optimized to provide the best PEFC efficiency and lifetime. The low CO concentration (below 5 ppm) in the reformate was ensured by a preferential oxidation (PROX) stage. Stable performance of a 100 W PEFC coupled with the developed reactor prototype was successfully demonstrated.
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