The microstructure of porous electrodes of solid oxide cells (SOCs) significantly impacts their electrochemical performance. Therefore, various attempts have been made to analyze their complex porous microstructure in three dimensions. The obtained microstructures have been quantitatively evaluated using structural metrics, such as volume fraction, surface area density, and tortuosity factor of the constituent phases, as well as double- and triple-phase boundaries. These structural characteristics are useful to correlate the electrode performance with their microstructure, thereby determining optimal electrode design. However, these intuitive metrics often fails to explain the electrode performance. In fact, structural changes during long term operation of SOCs are subtle so that the performance degradation of the electrodes cannot be fully detected by these intuitive characteristics. Therefore, it is necessary to find a way to extract hidden structural metrics that characterize the electrode microstructure and to clarify their correlation with electrode performance.One of the promising candidates for such structural metrics is topological information. Topology is a structural property that is invariant to successive deformation operations, such as connected structures and the number of holes in the structures. Topology-based structural analysis has many applications in material science, where macroscopic properties of materials are correlated with topological information about their internal structures (e.g., crystal structures). For example, Wang et al. [1] performed a topological analysis on the crystal structure of double-phase steel to characterize its structure and to predict its macroscopic properties, such as stress-strain curves. Application of topological data analysis is also found in the analysis of SOFC electrodes; Pawlowski et al. [2] attempted to capture the structural changes in SOFC anodes during long-term operation from a topological perspective.In addition, topological analysis is regarded as a tool for dimensional reduction of complex structural information. Therefore, the information extracted from the topological analysis can be used to evaluate conventional metrics of porous microstructures, such as surface area and triple-phase boundary. If these metrics can be accurately evaluated from a limited number of information from the topological analysis, the numerical cost is expected to be significantly reduced.Therefore, this study investigates the applicability of the topological analysis to the electrode microstructure analysis. Fig. 1 shows the schematic diagram of the structural analysis in this study. First, persistent homology analysis [3] is employed to extract the topological information of the electrodes, where the birth and death of topological features are detected during the filtration process within the structure datasets to produce the persistent diagram (PD). The persistent diagram is then discretized and concatenated to obtain the persistent image (PI). Subsequently, principal component analysis (PCA) is conducted to further reduce the dimensionality of the structural information extracted in the persistent image. The obtained values of the principal components are correlated with the conventional structural metrics of the porous electrodes, such as volume fraction, surface area density, and triple-phase boundary density.Moreover, neural networks (NNs) consisting of fully-connected layers are constructed to quantify the structural metrics from the principal components. The constructed neural networks are trained using the real electrode microstructure datasets obtained using the focused ion beam and scanning electron microstructure [4]. To validate the developed neural networks, they are compared with the convolutional neural network (CNN), which directly quantifies the microstructural metrics from the three-dimensional structures, in terms of quantification accuracy, the number of training datasets, and required training time.The values obtained from the topological analysis followed by the principal component analysis are found to contain essential structural information in the porous electrodes. This is implied by the fact that the principal component values obtained from the real structure datasets are significantly different from those from the artificial sphere-packing structures, even though the conventional structural metrics, i.e., volume fraction and surface density, are identical between the real and artificial structures. In addition, the principal component values have sensitivity to the conventional statistical metrics, because the structures with different solid compositions form clusters in different locations in a principal component space. These suggest that the topological information will be useful not only to detect subtle structural changes in the porous electrodes undetectable in conventional structural metrics, but also to reduce the dimensionality of the complex porous electrodes without losing the information quality.Since the information extracted using the persistent homology and principal component analysis possess essential information about the electrode structures, conventional microstructural metrics are accurately quantified by the constructed neural network. It should be emphasized that the number of parameters in the neural network that need to be adjusted during the training process is significantly reduced compared with the convolutional neural network. As a result, the number of required datasets for the training of the network is significantly reduced. These clearly indicate the effectiveness of the dimensional reduction in the quantification of the electrode microstructures.
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