Unraveling the synergistic mechanisms of dual-atom catalysts on BeN substrates for enhanced hydrogen evolution reaction: A machine learning-assisted first-principles study
Wentao Liang, Abuduwayiti Aierken, Xiaofeng Rong, Degui Wang, Wei Deng, Wenjun Xiao, Gang Wang, Mingqiang Liu, Changsong Gao, Yan Wu, Zhen Wang, Liang Zhang, Jinshun Bi, Xuefei Liu, Xuefei Liu
Topics & Concepts
CatalysisDual (grammatical number)Atom (system on chip)ChemistryHydrogen atomHydrogenReaction mechanismNanotechnologyCombinatorial chemistryMaterials scienceChemical engineeringComputer scienceOrganic chemistryEngineeringParallel computingPhilosophyLinguisticsAlkylElectrocatalysts for Energy ConversionMachine Learning in Materials ScienceFuel Cells and Related Materials