December 20, 2025
Journal Article

Confinement-controlled selective CO2 insertion into a dicopper dihydride core: A multiscale mechanistic study

Published: December 20, 2025

Citation

Fuller III J.T., E.A. Patrick, G.K. Schenter, B. Ginovska, B.L. Tran, and S. Raugei. 2025. Confinement-controlled selective CO2 insertion into a dicopper dihydride core: A multiscale mechanistic study. The Journal of Chemical Physics 163, no. 19:194506. PNNL-SA-212981. doi:10.1063/5.0287973

Research topics

Computational Chemistry
Catalysis