About the Consideration of the Inactive Materials and the Meshing Procedures in Computational Models of Lithium Ion Battery Electrodes

Abstract Lithium‐ion batteries (LIBs) constitute a crucial technology in the ongoing energy transition. Still, the composite porous electrodes in LIBs remain complex systems which still need optimization to meet the requirements from the applications, e. g., high energy density for the automotive se...

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Main Authors: Dr. Mehdi Chouchane, Prof. Dr. Alejandro A. Franco
Format: Article
Language:English
Published: Wiley-VCH 2022-11-01
Series:ChemElectroChem
Subjects:
Online Access:https://doi.org/10.1002/celc.202200692
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author Dr. Mehdi Chouchane
Prof. Dr. Alejandro A. Franco
author_facet Dr. Mehdi Chouchane
Prof. Dr. Alejandro A. Franco
author_sort Dr. Mehdi Chouchane
collection DOAJ
description Abstract Lithium‐ion batteries (LIBs) constitute a crucial technology in the ongoing energy transition. Still, the composite porous electrodes in LIBs remain complex systems which still need optimization to meet the requirements from the applications, e. g., high energy density for the automotive sector. To achieve well‐designed LIB electrodes, computational continuum modeling with three‐dimensional (3D) resolution constitutes a powerful tool to gain insights on the working principles of these electrodes. However, due to the complexity of the material properties and geometrical features within the electrodes, until mid‐2010’s such type of models had to make numerous assumptions, especially regarding the carbon additive and binder (all together standing for the so called inactive phase), that was not explicitly resolved in 3D. Recently, the battery modeling field has undergone tremendous progress which allowed the emergence of a new generation of models, more accurate and realistic than ever before. This review presents the latest developments through the prism of the consideration of the inactive phase in these models, and also provides recommendations on how to design modeling studies in order to minimize numerical errors originated by the meshing procedures of the materials and electrode volumes, a crucial step when a continuum model is set.
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spelling doaj.art-3d243f240e6944008bf2f99d8c0d4df92023-07-21T06:16:09ZengWiley-VCHChemElectroChem2196-02162022-11-01921n/an/a10.1002/celc.202200692About the Consideration of the Inactive Materials and the Meshing Procedures in Computational Models of Lithium Ion Battery ElectrodesDr. Mehdi Chouchane0Prof. Dr. Alejandro A. Franco1Laboratoire de Réactivité et Chimie des Solides (LRCS) UMR CNRS 7314 Université de Picardie Jules Verne, Hub de l'Energie 15 rue Baudelocque 80039 Amiens Cedex FranceLaboratoire de Réactivité et Chimie des Solides (LRCS) UMR CNRS 7314 Université de Picardie Jules Verne, Hub de l'Energie 15 rue Baudelocque 80039 Amiens Cedex FranceAbstract Lithium‐ion batteries (LIBs) constitute a crucial technology in the ongoing energy transition. Still, the composite porous electrodes in LIBs remain complex systems which still need optimization to meet the requirements from the applications, e. g., high energy density for the automotive sector. To achieve well‐designed LIB electrodes, computational continuum modeling with three‐dimensional (3D) resolution constitutes a powerful tool to gain insights on the working principles of these electrodes. However, due to the complexity of the material properties and geometrical features within the electrodes, until mid‐2010’s such type of models had to make numerous assumptions, especially regarding the carbon additive and binder (all together standing for the so called inactive phase), that was not explicitly resolved in 3D. Recently, the battery modeling field has undergone tremendous progress which allowed the emergence of a new generation of models, more accurate and realistic than ever before. This review presents the latest developments through the prism of the consideration of the inactive phase in these models, and also provides recommendations on how to design modeling studies in order to minimize numerical errors originated by the meshing procedures of the materials and electrode volumes, a crucial step when a continuum model is set.https://doi.org/10.1002/celc.202200692carbon binder domaincomputational methodlithium ion batterymeshmodelling
spellingShingle Dr. Mehdi Chouchane
Prof. Dr. Alejandro A. Franco
About the Consideration of the Inactive Materials and the Meshing Procedures in Computational Models of Lithium Ion Battery Electrodes
ChemElectroChem
carbon binder domain
computational method
lithium ion battery
mesh
modelling
title About the Consideration of the Inactive Materials and the Meshing Procedures in Computational Models of Lithium Ion Battery Electrodes
title_full About the Consideration of the Inactive Materials and the Meshing Procedures in Computational Models of Lithium Ion Battery Electrodes
title_fullStr About the Consideration of the Inactive Materials and the Meshing Procedures in Computational Models of Lithium Ion Battery Electrodes
title_full_unstemmed About the Consideration of the Inactive Materials and the Meshing Procedures in Computational Models of Lithium Ion Battery Electrodes
title_short About the Consideration of the Inactive Materials and the Meshing Procedures in Computational Models of Lithium Ion Battery Electrodes
title_sort about the consideration of the inactive materials and the meshing procedures in computational models of lithium ion battery electrodes
topic carbon binder domain
computational method
lithium ion battery
mesh
modelling
url https://doi.org/10.1002/celc.202200692
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