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A unified descriptor framework for hydrogen storage capacity and equilibrium pressure in interstitial hydrides
Seong-Hoon Jang, Di Zhang, Xue Jia +9
Hydrogen is a promising energy carrier, yet its practical deployment is limited by the lack of storage materials that simultaneously achieve high storage capacity () and practic…
Digital Hydrogen Platform (DigHyd): A Rigorously Curated Database for Hydrogen Storage Materials Empowered by AI-Assisted Literature Mining
Seong-Hoon Jang, Di Zhang, Xue Jia +8
Solid-state hydrogen storage materials are promising candidates for safe and compact hydrogen storage; however, data-driven discovery in this field remains limited by the availabil…
A Materials Map Integrating Experimental and Computational Data via Graph-Based Machine Learning for Enhanced Materials Discovery
Yusuke Hashimoto, Xue Jia, Hao Li +1
Materials informatics (MI), emerging from the integration of materials science and data science, is expected to significantly accelerate material development and discovery. The dat…
Universal Catalyst Design Framework for Electrochemical Hydrogen Peroxide Synthesis Facilitated by Local Atomic Environment Descriptors
Zhijian Liu, Yan Liu, Bingqian Zhang +10
Developing a universal and precise design framework is crucial to search high-performance catalysts, but it remains a giant challenge due to the diverse structures and sites across…