Facile dehydrogenation of MgH2 enabled by γ-graphyne based single-atom catalyst
Shuai Dong, Hao Liu, Xinyuan Liu, Chaoqun Li, Zhengyang Gao, Bogu Liu, Weijie Yang, Ying Wu
Topics & Concepts
DehydrogenationHydrogen storageDensity functional theoryCatalysisGraphyneGrapheneAb initioChemistryMaterials scienceChemical physicsAtom (system on chip)HydrogenComputational chemistryNanotechnologyOrganic chemistryEmbedded systemComputer scienceHydrogen Storage and MaterialsAmmonia Synthesis and Nitrogen ReductionHybrid Renewable Energy Systems