DFT study of atmospheric characteristics of CF 3 SO 2 F: the fungibility of the insulation gas of SF 6
Abstract
, with an atmospheric lifetime of 52.02 years and a GWP of 4320. The reactive models, developed using density functional theory (DFT) and Car-Parrinello molecular dynamics (CPMD), not only enable the determination of the dissociation pathway in the atmosphere, but also provide detailed insights into the interactions with ·OH based on the overall dynamic behaviour.
Fields of Study & Subjects
High voltage insulation and dielectric phenomena
Atmospheric chemistry and aerosols
Power Transformer Diagnostics and Insulation
Publication details
- Journal / source
- RSC Advances
- Publisher
- Royal Society of Chemistry (RSC)
- Volume
- 16
- Issue
- 8
- Pages
- 7410–7420
- Publication date
- 1 January 2026
- Language
- EN