{"title":"Machine learning and physics-informed modeling of cluster coalescence and breakage in gas–solid flows","authors":"Zhikang Zhou, Shanwei Hu, Xinhua Liu","doi":"10.1002/aic.70599","DOIUrl":null,"url":null,"abstract":"<p>Particle clusters and their dynamic evolution significantly affect the hydrodynamics and performance of fluidization reactors. Population balance models provide a theoretical framework for describing such dynamic behaviors, whereas quantitative descriptions of breakage and coalescence kernels remain unavailable. In this study, we developed a Lagrangian tracking framework combined with comprehensive criteria for both coalescence and breakage, by which the dynamic evolutions of clusters during their growth, coalescence, and breakage were tracked and analyzed from CFD-DEM simulations. Accordingly, deep neural networks were used to quantify, for the first time, the coalescence and breakage kernels with key influencing factors determined by Random Forest-assisted analysis. To further enhance model accuracy and generalization, a physics-informed neural network (PINN) incorporating both volume conservation and priori knowledge on daughter size distribution was developed for breakage modeling. Results demonstrate that PINN outperforms conventional DNNs owing to its consideration of physical constraint and the ability to suppress data noise.</p>","PeriodicalId":120,"journal":{"name":"AIChE Journal","volume":"72 11","pages":""},"PeriodicalIF":4.4000,"publicationDate":"2026-10-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"AIChE Journal","FirstCategoryId":"5","ListUrlMain":"https://onlinelibrary.wiley.com/doi/10.1002/aic.70599","RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"2026/8/17 0:00:00","PubModel":"Epub","JCR":"Q2","JCRName":"ENGINEERING, CHEMICAL","Score":null,"Total":0}
引用次数: 0
Abstract
Particle clusters and their dynamic evolution significantly affect the hydrodynamics and performance of fluidization reactors. Population balance models provide a theoretical framework for describing such dynamic behaviors, whereas quantitative descriptions of breakage and coalescence kernels remain unavailable. In this study, we developed a Lagrangian tracking framework combined with comprehensive criteria for both coalescence and breakage, by which the dynamic evolutions of clusters during their growth, coalescence, and breakage were tracked and analyzed from CFD-DEM simulations. Accordingly, deep neural networks were used to quantify, for the first time, the coalescence and breakage kernels with key influencing factors determined by Random Forest-assisted analysis. To further enhance model accuracy and generalization, a physics-informed neural network (PINN) incorporating both volume conservation and priori knowledge on daughter size distribution was developed for breakage modeling. Results demonstrate that PINN outperforms conventional DNNs owing to its consideration of physical constraint and the ability to suppress data noise.
期刊介绍:
The AIChE Journal is the premier research monthly in chemical engineering and related fields. This peer-reviewed and broad-based journal reports on the most important and latest technological advances in core areas of chemical engineering as well as in other relevant engineering disciplines. To keep abreast with the progressive outlook of the profession, the Journal has been expanding the scope of its editorial contents to include such fast developing areas as biotechnology, electrochemical engineering, and environmental engineering.
The AIChE Journal is indeed the global communications vehicle for the world-renowned researchers to exchange top-notch research findings with one another. Subscribing to the AIChE Journal is like having immediate access to nine topical journals in the field.
Articles are categorized according to the following topical areas:
Biomolecular Engineering, Bioengineering, Biochemicals, Biofuels, and Food
Inorganic Materials: Synthesis and Processing
Particle Technology and Fluidization
Process Systems Engineering
Reaction Engineering, Kinetics and Catalysis
Separations: Materials, Devices and Processes
Soft Materials: Synthesis, Processing and Products
Thermodynamics and Molecular-Scale Phenomena
Transport Phenomena and Fluid Mechanics.