Solid oxide fuel cell reactor analysis and optimisation through a novel multi-scale modelling strategy

The simulation of a solid oxide fuel cell (SOFC) that incorporates a detailed user-developed model was performed within the commercial flowsheet simulator Aspen Plus. It allows modification of the SOFC's governing equations, as well as the configuration of the cell's fuel-air flow pattern at the flowsheet level. Initially, the dynamic behaviour of single compartment of a cell was examined with a 0D model, which became the building block for more complex SOFC configurations. Secondly, a sensitivity analysis was performed at the channel (1D) scale for different flow patterns. Thirdly, the effect of fuel and air flow rates on the predominant distributed variables of a cell was tested on a 2D assembly. Finally, an optimisation study was carried out on the 2D cell, leading to a robust, optimal air distribution profile that minimises the internal temperature gradient. This work forms the foundation of future stack and system scale studies

Planar solid oxide fuel cell modeling and optimization targeting the stack's temperature gradient minimization

Minimization of undesirable temperature gradients in all dimensions of a planar solid oxide fuel cell (SOFC) is central to the thermal management and commercialization of this electrochemical reactor. This article explores the effective operating variables on the temperature gradient in a multilayer SOFC stack and presents a trade-off optimization. Three promising approaches are numerically tested via a model-based sensitivity analysis. The numerically efficient thermo-chemical model that had already been developed by the authors for the cell scale investigations (Tang et al. Chem. Eng. J. 2016, 290, 252-262) is integrated and extended in this work to allow further thermal studies at commercial scales. Initially, the most common approach for the minimization of stack's thermal inhomogeneity, i.e., usage of the excess air, is critically assessed. Subsequently, the adjustment of inlet gas temperatures is introduced as a complementary methodology to reduce the efficiency loss due to application of excess air. As another practical approach, regulation of the oxygen fraction in the cathode coolant stream is examined from both technical and economic viewpoints. Finally, a multiobjective optimization calculation is conducted to find an operating condition in which stack's efficiency and temperature gradient are maximum and minimum, respectively

Planar SOFC system modelling and simulation including a 3D stack module

A solid oxide fuel cell (SOFC) system consists of a fuel cell stack with its auxiliary components. Modelling an entire SOFC system can be simplified by employing standard process flowsheeting software. However, no in-built SOFC module exists within any of the commercial flowsheet simulators. In Amiri et al. (Comput. Chem. Eng., 2015, 78:10-23), a rigorous SOFC module was developed to fill this gap. That work outlined a multi-scale approach to SOFC modelling and presented analyses at compartment, channel and cell scales. The current work extends the approach to stack and system scales. Two case studies were conducted on a simulated multilayer, planar SOFC stack with its balance of plant (BoP) components. Firstly, the effect of flow maldistribution in the stack manifold on the SOFC's internal variables was examined. Secondly, the interaction between the stack and the BoP was investigated through the effect of recycling depleted fuel. The results showed that anode gas recycling could be used for managing the gradients within the stack, while also improving fuel utilisation and water management

Multi-scale Modelling and Optimization Study on the Thermal Management of SOFC

Solid Oxide Fuel Cell (SOFC) is considered as a promising technology to resolve the current energy and environmental problems. However, thermal management is one of the critical barriers for its practical application. The computational approach can play a crucial role in exploring the solutions for those challenges. This thesis employs the multi-scale modelling and optimization approach to study the thermal behaviour of the SOFC and propose effective strategies of thermal management for the SOFC

Conceptual energy and water recovery system for self-sustained nano membrane toilet

With about 2.4 billion people worldwide without access to improved sanitation facilities, there is a strong incentive for development of novel sanitation systems to improve the quality of life and reduce mortality. The Nano Membrane Toilet is expected to provide a unique household-scale system that would produce electricity and recover water from human excrement and urine. This study was undertaken to evaluate the performance of the conceptual energy and water recovery system for the Nano Membrane Toilet designed for a household of ten people and to assess its self-sustainability. A process model of the entire system, including the thermochemical conversion island, a Stirling engine and a water recovery system was developed in Aspen Plus®. The energy and water recovery system for the Nano Membrane Toilet was characterised with the specific net power output of 23.1 Wh/kgsettledsolids and water recovery rate of 13.4 dm3/day in the nominal operating mode. Additionally, if no supernatant was processed, the specific net power output was increased to 69.2 Wh/kgsettledsolids. Such household-scale system would deliver the net power output (1.9–5.8 W). This was found to be enough to charge mobile phones or power clock radios, or provide light for the household using low-voltage LED bulbs

Simulation of Solid Oxide Fuel Cell Anode in Aspen HYSYS—A Study on the Effect of Reforming Activity on Distributed Performance Profiles, Carbon Formation, and Anode Oxidation Risk

A distributed variable model for solid oxide fuel cell (SOFC), with internal fuel reforming on the anode, has been developed in Aspen HYSYS. The proposed model accounts for the complex and interactive mechanisms involved in the SOFC operation through a mathematically viable and numerically fast modeling framework. The internal fuel reforming reaction calculations have been carried out in a plug flow reactor (PFR) module integrated with a spreadsheet module to interactively calculate the electrochemical process details. By interlinking the two modules within Aspen HYSYS flowsheeting environment, the highly nonlinear SOFC distributed profiles have been readily captured using empirical correlations and without the necessity of using an external coding platform, such as MATLAB or FORTRAN. Distributed variables including temperature, current density, and concentration profiles along the cell length, have been discussed for various reforming activity rates. Moreover, parametric estimation of anode oxidation risk and carbon formation potential against fuel reformation intensity have been demonstrated that contributes to the SOFC lifetime evaluation. Incrementally progressive catalyst activity has been proposed as a technically viable approach for attaining smooth profiles within the SOFC anode. The proposed modeling platform paves the way for SOFC system flowsheeting and optimization, particularly where the study of systems with stack distributed variables is of interest

A bottom-up appraisal of the technically installable capacity of biogas-based solid oxide fuel cells for self power generation in wastewater treatment plants

This paper proposes a bottom-up method to estimate the technical capacity of solid oxide fuel cells to be installed in wastewater treatment plants and valorise the biogas obtained from the sludge through an efficient conversion into electricity and heat. The methodology uses stochastic optimisation on 200 biogas profile scenarios generated from industrial data and envisages a Pareto approach for an a posteriori assessment of the optimal number of generation unit for the most representative plant configuration sizes. The method ensures that the dominant role of biogas fluctuation is included in the market potential and guarantees that the utilization factor of the modules remains higher than 70% to justify the investment costs. Results show that the market potential for solid oxide fuel cells across Europe would lead up to 1,300 MW of installed electric capacity in the niche market of wastewater treatment and could initiate a capital and fixed costs reduction which could make the technology comparable with alternative combined heat and power solutions

Challenges and progress on the modelling of entropy generation in porous media: a review

Depending upon the ultimate design, the use of porous media in thermal and chemical systems can provide significant operational advantages, including helping to maintain a uniform temperature distribution, increasing the heat transfer rate, controlling reaction rates, and improving heat flux absorption. For this reason, numerous experimental and numerical investigations have been performed on thermal and chemical systems that utilize various types of porous materials. Recently, previous thermal analyses of porous materials embedded in channels or cavities have been re-evaluated using a local thermal non-equilibrium (LTNE) modelling technique. Consequently, the second law analyses of these systems using the LTNE method have been a point of focus in a number of more recent investigations. This has resulted in a series of investigations in various porous systems, and comparisons of the results obtained from traditional local thermal equilibrium (LTE) and the more recent LTNE modelling approach. Moreover, the rapid development and deployment of micro-manufacturing techniques have resulted in an increase in manufacturing flexibility that has made the use of these materials much easier for many micro-thermal and chemical system applications, including emerging energy-related fields such as micro-reactors, micro-combustors, solar thermal collectors and many others. The result is a renewed interest in the thermal performance and the exergetic analysis of these porous thermochemical systems. This current investigation reviews the recent developments of the second law investigations and analyses in thermal and chemical problems in porous media. The effects of various parameters on the entropy generation in these systems are discussed, with particular attention given to the influence of local thermodynamic equilibrium and non-equilibrium upon the second law performance of these systems. This discussion is then followed by a review of the mathematical methods that have been used for simulations. Finally, conclusions and recommendations regarding the unexplored systems and the areas in the greatest need of further investigations are summarized