Screening of transition metal dual-atom catalysts for hydrogen evolution reaction based on high-throughput calculation and searching surrogate prediction model using simple features
Jiu-Ning Wang, Wei Xu, Jun He, Hao Ma, Wanglai Cen, Yu Shen
Topics & Concepts
Dual (grammatical number)CatalysisThroughputAtom (system on chip)Transition metalSimple (philosophy)Hydrogen atomMaterials scienceChemistryComputational chemistryComputer scienceParallel computingOrganic chemistryEpistemologyArtWirelessLiteraturePhilosophyTelecommunicationsAlkylElectrocatalysts for Energy ConversionMachine Learning in Materials ScienceCatalysis and Hydrodesulfurization Studies