Electronic and geometric features controlling the reactivity of Mg-vanadate and V2O5 surfaces toward the initial C–H activation of C1–C3 alkanes – A DFT+U study

• DOI: 10.1016/j.jcat.2024.115800
• Publication Date: 2024-10-18T17:51:29Z
• Authors: Hansel Montalvo-C...; Álvaro Loaiza-Orduz; Randall J. Meyer; Craig Plaisance; David Hibbitts
• Keywords: Vanadate; Reactivity