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MOOSE-BatModelling

A diffuse interface methodology for modelling interfacial voids in all-solid-state batteries utilizing MOOSE.

In this project, a diffuse interface model is proposed to simulate the concurrent evolution of interfacial voids and the negative electrode during the stripping and plating processes. The model is applied to an all-solid-state sodium (Na) metal battery with homogeneous and polycrystalline solid electrolyte (SE) separators. Three cases are presented. First, the evolution of the Na negative electrode during stripping and plating with perfect electrode/SE separator interface. Second, the evolution of a single interfacial void placed at the electrode/SE separator interface during stripping and plating. Third, the coalescence of multiple interfacial voids along the electrode/SE separator interface during stripping.

The governing equations of the model are implemented using MOOSE, an open-source finite element framework. To successfully run an input file, the user needs to build a MOOSE-based application by enabling the phase field and solid mechanics modules. Once the executable (your-app-opt) of your MOOSE-based application is generated, the user can run the input files using the following command:

mpiexec -n <#ofCPU> /dir/to/your/executable/your-app-opt -i /dir/to/your/inputfile/<InputFileName>.i

This repository also contains additional custom objects (like Materials and Functions) specifically developed for this project. The header and source files of these objects are located within the include and src directories of this repository, respectively. It is necessary to compile these objects within your MOOSE-based application before executing the aforementioned command. To successfully link these objects to your application, the user needs to register the objects by modifying the source files using the following macro:

registerMooseObject(<YourAppName>, <ClassName>)

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A diffuse interface approach to modelling interfacial voids in solid state batteries using MOOSE

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