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arXiv · 2310.01261

$μ$2mech: a Software Package Combining Microstructure Modeling and Mechanical Property Prediction

Albert Linda·Ankit Singh Negi·Vishal Panwar·Rupesh Chafle·Somnath Bhowmick·Kaushik Das·Rajdip Mukherjee
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Abstract

We have developed a graphical user interface (GUI) based package $μ$2mech to perform phase-field simulation for predicting microstructure evolution. The package can take inputs from ab initio calculations and CALPHAD (Calculation of Phase Diagrams) tools for quantitative microstructure prediction. The package also provides a seamless connection to transfer output from the mesoscale phase field method to the microscale finite element analysis for mechanical property prediction. Such a multiscale simulation package can facilitate microstructure-property correlation, one of the cornerstones in accelerated materials development within the integrated computational materials engineering (ICME) framework.

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Albert Linda, Ankit Singh Negi, Vishal Panwar, Rupesh Chafle, Somnath Bhowmick, Kaushik Das, Rajdip Mukherjee. 2023-10-05. $μ$2mech: a Software Package Combining Microstructure Modeling and Mechanical Property Prediction. https://doi.org/10.1088/1402-4896%2Fad38eb

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