Single-atom catalytic N2 fixation with integrated descriptors on a novel π-π conjugated graphitic carbon nitride (g-C13N15) platform obtained by self-doping design: Prediction of ultrahigh activity and desirable selectivity
Yali Lu, Chunyao Fang, Qiang Zhang, Zongjin Hu, Yanlei Wu, Chenglong Shi, Jingcheng Xu, Yuanrui Li
Topics & Concepts
Delocalized electronSelectivityCatalysisGraphitic carbon nitrideConjugated systemMoietyCarbon nitrideFullereneMaterials scienceDopingChemistryCombinatorial chemistryNanotechnologyOrganic chemistryPhotocatalysisOptoelectronicsPolymerAmmonia Synthesis and Nitrogen ReductionAdvanced Photocatalysis TechniquesMXene and MAX Phase Materials