Thermodynamic calculation-assisted design of 500 MPa high performance steel by machine learning

In order to rationally design Q500 low-alloy wind power steel with stable microstructure and properties within a large cooling rate range, this study proposed a design system that utilizes thermodynamic database, machine learning (ML), and the multi-objective genetic optimization algorithm (MOGA). Thermodynamic calculation has been used to obtain a large amount of data on phase fractions and mechanical properties for various chemical composition at different cooling rates. By comparing the predictive capabilities of different ML models, the deep neural network (DNN) and MOGA were combined to design Q500 wind power steel. Subsequently, three groups of designed chemical compositions were appropriately selected for verification. The results indicate that the yield strength of the experimental steel was over 500 MPa, and the maximum error in microstructure and mechanical property prediction was 5.0%. The prediction results demonstrated the rationality of the composition design framework. Meanwhile, the method of combining the material database and ML proposed in this study can also be applied to the design of other low-alloy steels.

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Publication Details

Journal
Journal of Materials Research and Technology
Published
2024-11-01
DOI
https://doi.org/10.1016/j.jmrt.2024.10.241
Citations
4
Primary Topic
Machine Learning in Materials Science
Type
article
Field-Weighted Citation Impact
0.47

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article

Thermodynamic calculation-assisted design of 500 MPa high performance steel by machine learning

Fan Wang, Weiyi Gong, Xitao Wang, Jinshan He
4 citations
Journal of Materials Research and Technology
Machine Learning in Materials Science
0.47
article

Thermodynamic calculation-assisted design of 500 MPa high performance steel by machine learning

Fan Wang, Weiyi Gong, Xitao Wang, Jinshan He
article en
4 citations

Abstract

In order to rationally design Q500 low-alloy wind power steel with stable microstructure and properties within a large cooling rate range, this study proposed a design system that utilizes thermodynamic database, machine learning (ML), and the multi-objective genetic optimization algorithm (MOGA). Thermodynamic calculation has been used to obtain a large amount of data on phase fractions and mechanical properties for various chemical composition at different cooling rates. By comparing the predictive capabilities of different ML models, the deep neural network (DNN) and MOGA were combined to design Q500 wind power steel. Subsequently, three groups of designed chemical compositions were appropriately selected for verification. The results indicate that the yield strength of the experimental steel was over 500 MPa, and the maximum error in microstructure and mechanical property prediction was 5.0%. The prediction results demonstrated the rationality of the composition design framework. Meanwhile, the method of combining the material database and ML proposed in this study can also be applied to the design of other low-alloy steels.

Journal of Materials Research and TechnologyVol. 33
Qilu University of Technology (CN), Key Laboratory for High Strength Lightweight Metallic Materials of Shandong Province (CN), University of Science and Technology Beijing (CN)
China Academy of Space Technology, National Key Research and Development Program of China, Fundamental Research Funds for the Central Universities
Affordable and clean energy
Openalex Percentile: Top 38%
Machine Learning in Materials Science
0.47
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