Liu, Zhaochun
Fan, Shiyang
Tranca, Ionut
Tielens, Frederik
Article History
Received: 15 January 2025
Accepted: 2 May 2025
First Online: 26 May 2025
Change Date: 1 July 2025
Change Type: Correction
Change Details: The original online version of this article was revised to update the Supplementary Material
Declarations
:
: The authors declare that they have no known competing financial interests or personal relationships that could have appeared to influence the work reported in this paper.
: The Supporting Information is available free of charge at ….· Optimized structures as well as selected structural parameters for all the intermediates, saddle points, and products involved in the oxidation of propane by CoO+; calculated total energies, zero-point energies, and values of 〈S2〉 for all the relevant species. Detailed information on the intrinsic reaction coordinate (IRC) calculations and vibrational frequencies is also provided.