Articles | Volume 26, issue 20
https://doi.org/10.5194/acp-26-14655-2026
https://doi.org/10.5194/acp-26-14655-2026
Research article
 | 
16 Oct 2026
Research article |  | 16 Oct 2026

Linking molecular composition of organic aerosols to reactive oxygen species formation using an MCR-VK framework

Fobang Liu, Yun Zhang, Siyao Yue, Helmi-Marja K. Keskinen, Tuukka Petäjä, Markku Kulmala, Pingqing Fu, Thorsten Hoffmann, Kai Wang, and Haijie Tong

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Cited articles

Al-Naiema, I. M., Offenberg, J. H., Madler, C. J., Lewandowski, M., Kettler, J., Fang, T., and Stone, E. A.: Secondary organic aerosols from aromatic hydrocarbons and their contribution to fine particulate matter in Atlanta, Georgia, Atmos. Environ., 223, 117227, https://doi.org/10.1016/j.atmosenv.2019.117227, 2020. 
Bates, J. T., Fang, T., Verma, V., Zeng, L., Weber, R. J., Tolbert, P. E., Abrams, J. Y., Sarnat, S. E., Klein, M., and Mulholland, J. A.: Review of acellular assays of ambient particulate matter oxidative potential: methods and relationships with composition, sources, and health effects, Environ. Sci. Technol., 53, 4003–4019, 2019. 
Burnett, R., Chen, H., Szyszkowicz, M., Fann, N., Hubbell, B., Pope III, C. A., Apte, J. S., Brauer, M., Cohen, A., and Weichenthal, S.: Global estimates of mortality associated with long-term exposure to outdoor fine particulate matter, P. Natl. Acad. Sci. USA, 115, 9592–9597, 2018. 
Campbell, S. J., Utinger, B., Barth, A., Leni, Z., Zhang, Z.-H., Resch, J., Li, K., Steimer, S. S., Banach, C., and Gfeller, B.: Short-lived reactive components substantially contribute to particulate matter oxidative potential, Science Advances, 11, eadp8100, https://doi.org/10.1126/sciadv.adp8100, 2025. 
Chan, A. W. H., Kautzman, K. E., Chhabra, P. S., Surratt, J. D., Chan, M. N., Crounse, J. D., Kürten, A., Wennberg, P. O., Flagan, R. C., and Seinfeld, J. H.: Secondary organic aerosol formation from photooxidation of naphthalene and alkylnaphthalenes: implications for oxidation of intermediate volatility organic compounds (IVOCs), Atmos. Chem. Phys., 9, 3049–3060, https://doi.org/10.5194/acp-9-3049-2009, 2009. 
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Short summary
Reactive oxygen species (ROS) produced by airborne particles are linked to adverse health effects, but the organic compounds responsible remain unclear. We developed a new molecular framework to classify complex organic compounds using advanced mass spectrometry. The framework shows that particles rich in oxidized organic compounds produce more ROS per unit mass, while polluted urban air produces more total ROS mainly because of higher particle concentrations.
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