163 citations · 308 across the 8 of their papers we have counts for
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cond-mat.mtrl-sci2021★ 8 cited
Discovering Superhard B-N-O Compounds by Iterative Machine Learning and Evolutionary Structure Predictions
Wei-Chih Chen, Yogesh K. Vohra, Cheng-Chien Chen
We search for new superhard B-N-O compounds with an iterative machine learning (ML) procedure, where ML models are trained using sample crystal structures from evolutionary algorit…
cond-mat.mtrl-sci2021★ 11 cited
LaN Structural and Topological Transitions Driven by Temperature and Pressure
Wei-Chih Chen, Chia-Min Lin, Joseph Maciejko +1
We study lanthanum mononitride LaN by first-principles calculations. The commonly reported rock-salt structure of symmetry for rare-earth monopnictides is found dynami…