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Jikai Liu

Publications and source records attributed to Jikai Liu.

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MIND: Microstructure INverse Design with Generative Hybrid Neural Representation

The inverse design of microstructures plays a pivotal role in optimizing metamaterials with specific, targeted physical properties. While traditional forward design methods are constrained by their inability to explore the vast combinatorial design space, inverse design offers a compelling alternative by directly generating structures that fulfill predefined performance criteria. However, achieving precise control over both geometry and material properties remains a significant challenge due to their intricate interdependence. Existing approaches, which typically rely on voxel or parametric representations, often limit design flexibility and structural diversity. In this work, we present a novel generative model that integrates latent diffusion with Holoplane, an advanced hybrid neural representation that simultaneously encodes both geometric and physical properties. This combination ensures superior alignment between geometry and properties. Our approach generalizes across multiple microstructure classes, enabling the generation of diverse, tileable microstructures with significantly improved property accuracy and enhanced control over geometric validity, surpassing the performance of existing methods. We introduce a multi-class dataset encompassing a variety of geometric morphologies, including truss, shell, tube, and plate structures, to train and validate our model. Experimental results demonstrate the model's ability to generate microstructures that meet target properties, maintain geometric validity, and integrate seamlessly into complex assemblies. Additionally, we explore the potential of our framework through the generation of new microstructures, cross-class interpolation, and the infilling of heterogeneous microstructures. The dataset and source code will be open-sourced upon publication.

cs.CV

PH-Net: Parallelepiped Microstructure Homogenization via 3D Convolutional Neural Networks

Microstructures are attracting academic and industrial interests with the rapid development of additive manufacturing. The numerical homogenization method has been well studied for analyzing mechanical behaviors of microstructures; however, it is too time-consuming to be applied to online computing or applications requiring high-frequency calling, e.g., topology optimization. Data-driven homogenization methods emerge as a more efficient choice but limit the microstructures into a cubic shape, which are infeasible to the periodic microstructures with a more general shape, e.g., parallelepiped. This paper introduces a fine-designed 3D convolutional neural network (CNN) for fast homogenization of parallel-shaped microstructures, named PH-Net. Superior to existing data-driven methods, PH-Net predicts the local displacements of microstructures under specified macroscope strains instead of direct homogeneous material, motivating us to present a label-free loss function based on minimal potential energy. For dataset construction, we introduce a shape-material transformation and voxel-material tensor to encode microstructure type,base material and boundary shape together as the input of PH-Net, such that it is CNN-friendly and enhances PH-Net on generalization in terms of microstructure type, base material, and boundary shape. PH-Net predicts homogenized properties with hundreds of acceleration compared to the numerical homogenization method and even supports online computing. Moreover, it does not require a labeled dataset and thus is much faster than current deep learning methods in training processing. Benefiting from predicting local displacement, PH-Net provides both homogeneous material properties and microscopic mechanical properties, e.g., strain and stress distribution, yield strength, etc. We design a group of physical experiments and verify the prediction accuracy of PH-Net.

cond-mat.mtrl-sci