Computational screening and catalytic origin of transition metal supported on g-t-C3N4 as single-atom catalysts for nitrogen reduction reaction
Peng‐Fei Hou, Yuhong Huang, Fei Ma, Gangqiang Zhu, Jian‐Min Zhang, Xiumei Wei, Peiyuan Du, Jing Liu
Topics & Concepts
CatalysisChemistryTransition metalNitrogenRedoxElectrochemistryCombinatorial chemistryMetalSelectivityNitrogen atomChemical stabilityAtom (system on chip)Rational designNanotechnologyInorganic chemistryMaterials sciencePhysical chemistryOrganic chemistryElectrodeEmbedded systemComputer scienceGroup (periodic table)Ammonia Synthesis and Nitrogen ReductionAdvanced Photocatalysis TechniquesMXene and MAX Phase Materials