A Theoretical Investigation of the Reaction Mechanism and Kinetics of Hexafluoropropylene (HFP) With Ozone in the Presence of Water
A detailed theoretical investigation was conducted to elucidate the reaction mechanism and kinetics of hexafluoropropylene (HFP, CF 3 CF = CF 2 ) with ozone (O 3 ), with and without the catalytic influence of water. Quantum chemical calculations were conducted using the M06‐2X/6–311+G(d,p) theoretical framewo...