Modeling Novel Aqueous Particle and Cloud Chemistry Processes of Biomass Burning Phenols and Their Potential to Form Secondary Organic Aerosols

Zhang, Jie; Shrivastava, Manish; Ma, Lan; Jiang, Wenqing; Anastasio, Cort; Zhang, Qi; Zelenyuk, Alla

doi:10.1021/acs.est.3c07762

Title: Modeling Novel Aqueous Particle and Cloud Chemistry Processes of Biomass Burning Phenols and Their Potential to Form Secondary Organic Aerosols

Journal Article · Mon Feb 12 00:00:00 EST 2024 · Environmental Science and Technology

DOI:https://doi.org/10.1021/acs.est.3c07762· OSTI ID:2310374

Zhang, Jie ^[1];

^[1];

^[2];

^[2]; Zelenyuk, Alla ^[1]

Pacific Northwest National Laboratory (PNNL), Richland, WA (United States)
Univ. of California, Davis, CA (United States)

Phenols emitted from biomass burning contribute significantly to secondary organic aerosol (SOA) formation through the partitioning of semi-volatile products formed from gas-phase chemistry and multiphase chemistry in aerosol liquid water and clouds. The aqueous-phase SOA (aqSOA) formed via hydroxyl radical (•OH), singlet molecular oxygen (1O2*), and triplet excited states of organic compounds (3C*), which oxidize dissolved phenols in the aqueous phase, might play a significant role in the evolution of biomass-burning organic aerosol (BBOA). However, a quantitative and predictive understanding of aqSOA has been challenging. Here, we develop a stand-alone box model to investigate the formation of SOA from gas-phase •OH chemistry and aqSOA formed by dissolution of phenols followed by their aqueous-phase reactions with •OH, 1O2*, and 3C* in cloud droplets and aerosol liquid water. We investigate four phenolic compounds, i.e., phenol, guaiacol, syringol, and guaiacyl acetone (GA), which represent some of the key potential sources of aqSOA from biomass burning in clouds. For the same initial precursor organic gas concentrations, we predict that the aqSOA formation potential of these phenols is higher than that of isoprene-epoxydiol (IEPOX), a well-known aqSOA precursor. Cloud droplets can dissolve a broader range of soluble phenols compared to aqueous aerosols, since the liquid water contents of aerosols are orders of magnitude smaller than cloud droplets. Our simulations suggest that highly soluble and reactive multifunctional phenols like GA would predominantly undergo cloud chemistry within cloud layers, while gas-phase chemistry is likely to be more important for less soluble phenols. But in the absence of clouds, gas-phase chemistry dominates SOA formation, while the aqueous aerosol chemistry contribution to SOA increases with relative humidity (RH), approaching 40% of the sum of gas+aqueous aerosol chemistry at 95% RH for GA. Our model developments of biomass-burning phenols and their aqueous chemistry can be readily implemented in regional and global atmospheric chemistry models to investigate the aqueous aerosol and cloud chemistry interactions of biomass-burning organic gases in the atmosphere.

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Research Organization:: Pacific Northwest National Laboratory (PNNL), Richland, WA (United States); Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States). Atmospheric Radiation Measurement (ARM) Data Center

Sponsoring Organization:: USDOE Office of Science (SC), Biological and Environmental Research (BER); National Science Foundation (NSF); USDOE Office of Science (SC), Basic Energy Sciences (BES). Scientific User Facilities (SUF)

Contributing Organization:: Brookhaven National Laboratory (BNL); Argonne National Laboratory (ANL)

Grant/Contract Number:: AC05-76RL01830; 2220307

OSTI ID:: 2310374

Alternate ID(s):: OSTI ID: 2318517; OSTI ID: 2335779

Report Number(s):: PNNL-SA-190278

Journal Information:: Environmental Science and Technology, Vol. 58, Issue 8; ISSN 0013-936X

Publisher:: American Chemical Society (ACS)Copyright Statement

Country of Publication:: United States

Language:: English

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