Determining the Role of Acidity, Fate and Formation of IEPOX-Derived SOA in CMAQ

• Main Authors: Petros Vasilakos, Yongtao Hu, Armistead Russell, Athanasios Nenes
• Format: Article
• Language: English
• Published: MDPI AG 2021-05-01
• Series: Atmosphere
• Subjects: IEPOX; SOA; Henry’s Law; aerosol pH; acidity; emissions reductions
• Online Access: https://www.mdpi.com/2073-4433/12/6/707

Formation of aerosol from biogenic hydrocarbons relies heavily on anthropogenic emissions since they control the availability of species such as sulfate and nitrate, and through them, aerosol acidity (pH). To elucidate the role that acidity and emissions play in regulating Secondary Organic Aerosol (SOA), we utilize the 2013 Southern Oxidant and Aerosol Study (SOAS) dataset to enhance the extensive mechanism of isoprene epoxydiol (IEPOX)-mediated SOA formation implemented in the Community Multiscale Air Quality (CMAQ) model (Pye et al., 2013), which was then used to investigate the impact of potential future emission controls on IEPOX OA. We found that the Henry’s law coefficient for IEPOX was the most impactful parameter that controls aqueous isoprene OA products, and a value of 1.9 × 10⁷ M atm⁻¹provides the best agreement with measurements. Non-volatile cations (NVCs) were found in higher-than-expected quantities in CMAQ and exerted a significant influence on IEPOX OA by reducing its production by as much as 30% when present. Consistent with previous literature, a strong correlation of isoprene OA with sulfate, and little correlation with acidity or liquid water content, was found. Future reductions in SO₂ emissions are found to not affect this correlation and generally act to increase the sensitivity of IEPOX OA to sulfate, even in extreme cases.