Generative deep learning for predicting ultrahigh lattice thermal conductivity materials

Abstract Developing materials with ultrahigh thermal conductivity is crucial for thermal management and energy conversion. The recent development of generative models and machine learning (ML) holds great promise for predicting new functional materials. However, these data-driven methods are not tai...

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Bibliographic Details
Main Authors: Liben Guo, Yuanbin Liu, Zekun Chen, Hongao Yang, Davide Donadio, Bingyang Cao
Format: Article
Language:English
Published: Nature Portfolio 2025-04-01
Series:npj Computational Materials
Online Access:https://doi.org/10.1038/s41524-025-01592-8
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