1. Predicting apparent singlet oxygen quantum yields of dissolved black carbon and humic substances using spectroscopic indices
- Author
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Ziyan Du, Xiaolei Qu, Ao Kong, Jianing Fan, Heyun Fu, Yingsheng He, Shourong Zheng, Zhaoyi Xu, and Dongqiang Zhu
- Subjects
Satellite Imagery ,Environmental Engineering ,010504 meteorology & atmospheric sciences ,Health, Toxicology and Mutagenesis ,Analytical chemistry ,Quantum yield ,chemistry.chemical_element ,010501 environmental sciences ,01 natural sciences ,Oxygen ,Absorbance ,chemistry.chemical_compound ,Soot ,Spectrophotometry ,Spectral slope ,Dissolved organic carbon ,medicine ,Environmental Chemistry ,Humic Substances ,0105 earth and related environmental sciences ,medicine.diagnostic_test ,Singlet Oxygen ,Singlet oxygen ,Public Health, Environmental and Occupational Health ,dBc ,General Medicine ,General Chemistry ,Pollution ,Molecular Weight ,Spectrometry, Fluorescence ,chemistry ,Solubility ,Linear Models ,Sunlight - Abstract
Dissolved black carbon (DBC) is ubiquitous in aquatic systems, being an important subgroup of the dissolved organic matter (DOM) pool. Nevertheless, its aquatic photoactivity remains largely unknown. In this study, a range of spectroscopic indices of DBC and humic substance (HS) samples were determined using UV-Vis spectroscopy, fluorescence spectroscopy, and proton nuclear magnetic resonance. DBC can be readily differentiated from HS using spectroscopic indices. It has lower average molecular weight, but higher aromaticity and lignin content. The apparent singlet oxygen quantum yield (Φsinglet oxygen) of DBC under simulated sunlight varies from 3.46% to 6.13%, significantly higher than HS, 1.26%-3.57%, suggesting that DBC is the more photoactive component in the DOM pool. Despite drastically different formation processes and structural properties, the Φsinglet oxygen of DBC and HS can be well predicted by the same simple linear regression models using optical indices including spectral slope coefficient (S275-295) and absorbance ratio (E2/E3) which are proxies for the abundance of singlet oxygen sensitizers and for the significance of intramolecular charge transfer interactions. The regression models can be potentially used to assess the photoactivity of DOM at large scales with in situ water spectrophotometry or satellite remote sensing.
- Published
- 2017