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Performance improvement of χ3 borophene in nitrogen fixation using single–atom anchoring: A first–principles study

Xuxin Kang, Zhaoqin Chu, Xiangmei Duan

2021Applied Surface Science25 citationsDOI

Topics & Concepts

CatalysisNitrogenDensity functional theoryElectrochemistryNitrogen fixationSubstrate (aquarium)Transition metalMaterials scienceHydrogenChemistryChemical engineeringNanotechnologyComputational chemistryPhysical chemistryElectrodeOrganic chemistryOceanographyGeologyEngineeringAmmonia Synthesis and Nitrogen ReductionHydrogen Storage and MaterialsCatalytic Processes in Materials Science
Performance improvement of χ3 borophene in nitrogen fixation using single–atom anchoring: A first–principles study | Litcius