… comprehension of the nature of catalysis. Herein, based on the newly designed model
single-Fe-atom catalysts, we explored the exact structure of catalytic centers and provided a spin-…

… catalytic descriptor for single-atom based catalysts, we chose to study a single Fe atom …
As the single Fe atom is the active center and O 2 is the reactive molecule, the change of …

… The modeling results show that the single-atom Fe site of the FeN 4 center of Fe–N–C is
covered with an intermediate OH* from 0.28 to 1.00 V. Remarkably, such OH* becomes part of …

… active center of metalloprotease, enable the accurate identification of active centers in catalytic
… opportunities remaining for the successful combination of single Fe atoms and catalysts. …

… of Fe-SACs with a focus on anchoring single atoms (… centers, and SAC active sites are mostly
single metal atoms. Thus, SACs can be defined as a catalyst in which all the active catalytic …

… Fe single-atom catalyst (SAC). The systematic analyses demonstrate the significant role of
coordinated atoms of SA and metallic Fe … the Fe center and/or the formation of metallic Fe NPs…

… Whether the residual Zn element affects the catalytic activity and active site center of the
Fe-NC catalyst caused widespread curiosity, but has not been studied yet. Herein, we built …

… After removal of atomic O by CO, Fe atoms at the boundary resume the coordinatively …
and fully oxidized Pt-Fe catalysts, the pre-edge feature from the Pt-Fe NPs under the reaction …

… of an as-prepared catalyst enable the assignment of the catalytic centers responsible for the
… D3 center, only one Fe atom is bonded in the catalytic center, and the number of iron atoms …

… We have pursued Fe–N 2 model chemistry to explore a hypothesis … atom (previously denoted
as a light X-atom) may provide a flexible trans interaction with an Fe center to expose an Fe…