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The reaction between CFCl 2 CH 2 O 2  radicals and ClO was studied using the B3LYP and CCSD(T) methods associated with the 6-311++G(d,p) and cc-pVTZ basis sets, and subsequently RRKM-TST theory was used to predict the thermal rate constants and product distributions.

Theoretical investigation of the reaction mechanisms and kinetics of CFCl2CH2O2 and ClO in the atmosphere

Theoretical investigation of the reaction mechanisms and kinetics of CFCl₂CH₂O₂ and ClO in the atmosphere