Antiferromagnetically Coupled [Fe8S9] Cluster Catalyzed Acetylene Reduction in a Nitrogenase-like Enzyme DCCPCh: Insights from QM/MM Calculations

Publication date: Available online 20 April 2021Source: Journal of CatalysisAuthor(s): Rong-Zhen Liao, Jing-Xuan Zhang, Zhenyang Lin, Per E.M. Siegbahn

Source: Journal of Catalysis - April 20, 2021 Category: Chemistry Source Type: research