Pre-onlines

Decoding donor/acceptor hierarchy in DAD triads via fragment-centric machine learning

Machine learning and shap-based prediction of multifactor thermal-oxidative aging behavior in glass fiber reinforced polyamide6

A hybrid deep learning model for robust and data-efficient lithium-ion battery remaining useful life prediction

Machine learning-driven morphology identification and classification of high-throughput functional oxide films

Machine learning-assisted design of carbon nanotube-based single-atom catalysts for hydrogen evolution reaction

Knowledge-enabled data-driven smart design ultra-strong ductile near-α titanium alloys under extreme conditions

Machine learning-assisted high-entropy alloy discovery: a perspective

Application of deep learning for predicting carbon segregation in large-diameter continuously cast steel billets

Accelerated discovery of potential heat-resistant Al₈Cu₄X phases via high-throughput first-principles calculations

Cluster-model-embedded first-principles study of thermodynamic stability and elastic properties in (Zr, Ti)C_x carbides

ABC₂-type short-wave infrared photodetector materials discovered via high-throughput screening and machine learning

Machine learning-enabled design and lifetime prediction of solid oxide fuel cells 

Computational strategies for high strength and thermal conductivity casting Mg/Al alloys design