Three-dimensional discrete element simulation of electrode structural evolution in lithium-ion batteries during drying and calendering

The drying and calendering processes are critical in the manufacture of electrodes for lithium-ion batteries, and have a profound effect on their mechanical and electrochemical properties. In this study, we developed a three-dimensional representative volume element (RVE) model of electrodes, which...

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Main Authors: Yuhang Lyu, Shaohai Dong, Li Ting Gao, Zhan-Sheng Guo
Format: Article
Language:English
Published: Elsevier 2025-04-01
Series:International Journal of Electrical Power & Energy Systems
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Online Access:http://www.sciencedirect.com/science/article/pii/S0142061525000729
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author Yuhang Lyu
Shaohai Dong
Li Ting Gao
Zhan-Sheng Guo
author_facet Yuhang Lyu
Shaohai Dong
Li Ting Gao
Zhan-Sheng Guo
author_sort Yuhang Lyu
collection DOAJ
description The drying and calendering processes are critical in the manufacture of electrodes for lithium-ion batteries, and have a profound effect on their mechanical and electrochemical properties. In this study, we developed a three-dimensional representative volume element (RVE) model of electrodes, which includes the active material, carbon binder domain, solvent, and particle contacts. Utilizing the discrete element method (DEM), we continuously simulated the structural evolution of the RVE during the drying and calendering processes. Our simulations revealed a three-stage drying scheme consistent with experimental observations, demonstrating the accuracy of our DEM-based approach. Furthermore, we found that the calendering process significantly enhances the mechanical integrity and electronic conductivity of the electrodes, with peak stresses occurring in the thickness direction. This research underscores the potential of DEM in elucidating electrode heterogeneity during manufacturing processes and highlights the innovative use of this method in the field of battery science.
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institution Kabale University
issn 0142-0615
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publishDate 2025-04-01
publisher Elsevier
record_format Article
series International Journal of Electrical Power & Energy Systems
spelling doaj-art-952b8ce7bd5d4de5a0ac517c3a24c6e42025-02-10T04:33:28ZengElsevierInternational Journal of Electrical Power & Energy Systems0142-06152025-04-01165110521Three-dimensional discrete element simulation of electrode structural evolution in lithium-ion batteries during drying and calenderingYuhang Lyu0Shaohai Dong1Li Ting Gao2Zhan-Sheng Guo3Shanghai Institute of Applied Mathematics and Mechanics, School of Mechanics and Engineering Science, Shanghai Key Laboratory of Mechanics in Energy Engineering, Shanghai University, Shanghai 200072, ChinaShanghai Institute of Applied Mathematics and Mechanics, School of Mechanics and Engineering Science, Shanghai Key Laboratory of Mechanics in Energy Engineering, Shanghai University, Shanghai 200072, ChinaShanghai Institute of Applied Mathematics and Mechanics, School of Mechanics and Engineering Science, Shanghai Key Laboratory of Mechanics in Energy Engineering, Shanghai University, Shanghai 200072, ChinaCorresponding author.; Shanghai Institute of Applied Mathematics and Mechanics, School of Mechanics and Engineering Science, Shanghai Key Laboratory of Mechanics in Energy Engineering, Shanghai University, Shanghai 200072, ChinaThe drying and calendering processes are critical in the manufacture of electrodes for lithium-ion batteries, and have a profound effect on their mechanical and electrochemical properties. In this study, we developed a three-dimensional representative volume element (RVE) model of electrodes, which includes the active material, carbon binder domain, solvent, and particle contacts. Utilizing the discrete element method (DEM), we continuously simulated the structural evolution of the RVE during the drying and calendering processes. Our simulations revealed a three-stage drying scheme consistent with experimental observations, demonstrating the accuracy of our DEM-based approach. Furthermore, we found that the calendering process significantly enhances the mechanical integrity and electronic conductivity of the electrodes, with peak stresses occurring in the thickness direction. This research underscores the potential of DEM in elucidating electrode heterogeneity during manufacturing processes and highlights the innovative use of this method in the field of battery science.http://www.sciencedirect.com/science/article/pii/S0142061525000729Discrete element methodElectrode slurryDryingCalenderingStructural evolutionRepresentative volume element
spellingShingle Yuhang Lyu
Shaohai Dong
Li Ting Gao
Zhan-Sheng Guo
Three-dimensional discrete element simulation of electrode structural evolution in lithium-ion batteries during drying and calendering
International Journal of Electrical Power & Energy Systems
Discrete element method
Electrode slurry
Drying
Calendering
Structural evolution
Representative volume element
title Three-dimensional discrete element simulation of electrode structural evolution in lithium-ion batteries during drying and calendering
title_full Three-dimensional discrete element simulation of electrode structural evolution in lithium-ion batteries during drying and calendering
title_fullStr Three-dimensional discrete element simulation of electrode structural evolution in lithium-ion batteries during drying and calendering
title_full_unstemmed Three-dimensional discrete element simulation of electrode structural evolution in lithium-ion batteries during drying and calendering
title_short Three-dimensional discrete element simulation of electrode structural evolution in lithium-ion batteries during drying and calendering
title_sort three dimensional discrete element simulation of electrode structural evolution in lithium ion batteries during drying and calendering
topic Discrete element method
Electrode slurry
Drying
Calendering
Structural evolution
Representative volume element
url http://www.sciencedirect.com/science/article/pii/S0142061525000729
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