“…102 Meanwhile, the reaction mechanisms can be analyzed with DFT calculations by mimicking the reactant adsorption and comparing the energy barriers for different reaction pathways. 103 Very recently, Zhang et al 88 employed DFT analysis to explore the O 2 activation performances with Cu 1 /N 2 -SACs and Cu 1 /N 3 -SACs individually (Fig. 6).…”
The advances of catalysts now enter an era of atomic-level precise control. Single-atom catalysts (SACs), characterized by outstanding catalytic activity and selectivity, afford attractive opportunities to revolutionize traditional nanomedicine.
“…102 Meanwhile, the reaction mechanisms can be analyzed with DFT calculations by mimicking the reactant adsorption and comparing the energy barriers for different reaction pathways. 103 Very recently, Zhang et al 88 employed DFT analysis to explore the O 2 activation performances with Cu 1 /N 2 -SACs and Cu 1 /N 3 -SACs individually (Fig. 6).…”
The advances of catalysts now enter an era of atomic-level precise control. Single-atom catalysts (SACs), characterized by outstanding catalytic activity and selectivity, afford attractive opportunities to revolutionize traditional nanomedicine.
scite is a Brooklyn-based organization that helps researchers better discover and understand research articles through Smart Citations–citations that display the context of the citation and describe whether the article provides supporting or contrasting evidence. scite is used by students and researchers from around the world and is funded in part by the National Science Foundation and the National Institute on Drug Abuse of the National Institutes of Health.