Graphyne as a promising substrate for the noble-metal single-atom catalysts

Dongwei Ma, Tingxian Li, Qinggao Wang, +4

Carbon

Materials ScienceGraphene NanomeshesEngineeringCarbon-based MaterialPromising Substrate +4

3d transition metal embedded C2N monolayers as promising single-atom catalysts: A first-principles study

Dongwei Ma, Qinggao Wang, Xun-Wang Yan, +6

Carbon

Materials ScienceCatalytic MaterialEngineeringNanotechnologySurface Science +8

Repairing sulfur vacancies in the MoS₂ monolayer by using CO, NO and NO₂ molecules

Dongwei Ma, Qinggao Wang, Tingxian Li, +5

Journal of Materials Chemistry C

Oxide HeterostructuresMaterials ScienceTransition Metal ChalcogenidesS VacancyEngineering +12

The Effect of Environment on the Reaction of Water on the Ceria(111) Surface: A DFT+U Study

Zongxian Yang, Qinggao Wang, Shuyi Wei, +2

The Journal of Physical Chemistry C

EngineeringComputational ChemistryChemistryEnvironmental ChemistryChemical Engineering +17

CO catalytic oxidation on Al-doped graphene-like ZnO monolayer sheets: a first-principles study

Dongwei Ma, Qinggao Wang, Tingxian Li, +4

Journal of Materials Chemistry C

Materials ScienceChemical EngineeringCatalytic MaterialEngineeringCarbon-based Material +11

Interaction of Single-Atom Platinum–Oxygen Vacancy Defects for the Boosted Photosplitting Water H₂ Evolution and CO₂ Photoreduction: Experimental and Theoretical Study

Sheng-Nan Cai, Liming Wang, Shiliang Heng, +6

The Journal of Physical Chemistry C

EngineeringInorganic PhotochemistryNanocatalysisPhoto-electrochemical CellChemistry +16

Explaining stability of transition metal carbides – and why TcC does not exist

Qinggao Wang, Konstantin E. German, Artem R. Oganov, +4

RSC Advances

Materials EngineeringMaterials ScienceEngineeringPhysicsCondensed Matter Physics +6

Prediction of a new ground state of superhard compound B6O at ambient conditions

Huafeng Dong, Artem R. Oganov, Qinggao Wang, +7

Scientific Reports

The synergistic effects of the Cu–CeO2(111) catalysts on the adsorption and dissociation of water molecules

Zongxian Yang, Qinggao Wang, Shuyi Wei

Physical Chemistry Chemical Physics

Boron oxides under pressure: Prediction of the hardest oxides

Huafeng Dong, Artem R. Oganov, Qinggao Wang, +5

Physical review. B./Physical review. B

Materials ScienceMaterials EngineeringBoron Atoms ChangesEngineeringPhysics +11