Crystal twins: self-supervised learning for crystalline material property prediction

Abstract Machine learning (ML) models have been widely successful in the prediction of material properties. However, large labeled datasets required for training accurate ML models are elusive and computationally expensive to generate. Recent advances in Self-Supervised Learning (SSL) frameworks cap...

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Bibliographic Details
Main Authors: Rishikesh Magar, Yuyang Wang, Amir Barati Farimani
Format: Article
Language:English
Published: Nature Portfolio 2022-11-01
Series:npj Computational Materials
Online Access:https://doi.org/10.1038/s41524-022-00921-5