Lee, M., Zimmermann-Steffens, S. G., Arey, J. S., Fenner, K., & von Gunten, U. (2015). Development of prediction models for the reactivity of organic compounds with ozone in aqueous solution by quantum chemical calculations: the role of delocalized and localized molecular orbitals. Environmental Science and Technology, 49(16), 9925-9935. https://doi.org/10.1021/acs.est.5b00902