Exploration of optimal microstructure and mechanical properties in continuous microstructure space using a variational autoencoder

Data-driven approaches enable a deep understanding of microstructure and mechanical properties of materials and greatly promote one's capability in designing new advanced materials. Deep learning-based image processing outperforms conventional image processing techniques with unsupervised learn...

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Bibliographic Details
Main Authors: Yongju Kim, Hyung Keun Park, Jaimyun Jung, Peyman Asghari-Rad, Seungchul Lee, Jin You Kim, Hwan Gyo Jung, Hyoung Seop Kim
Format: Article
Language:English
Published: Elsevier 2021-04-01
Series:Materials & Design
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S0264127521000976
Description
Summary:Data-driven approaches enable a deep understanding of microstructure and mechanical properties of materials and greatly promote one's capability in designing new advanced materials. Deep learning-based image processing outperforms conventional image processing techniques with unsupervised learning. This study employs a variational autoencoder (VAE) to generate a continuous microstructure space based on synthetic microstructural images. The structure-property relationships are explored using a computational approach with microstructure quantification, dimensionality reduction, and finite element method (FEM) simulations. The FEM of representative volume element (RVE) with a microstructure-based constitutive model model is proposed for predicting the overall stress-strain behavior of the investigated dual-phase steels. Then, Gaussian process regression (GPR) is used to make connections between the latent space point and the ferrite grain size as inputs and mechanical properties as outputs. The GPR with VAE successfully predicts the newly generated microstructures with target mechanical properties with high accuracy. This work demonstrates that a variety of microstructures can be candidates for designing the optimal material with target properties in a continuous manner.
ISSN:0264-1275