Field calibration and PAS-SIM model evaluation of the XAD-based passive air sampler for semi-volatile organic compounds

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Language of the publication
English
Date
2023-06-09
Type
Submitted manuscript
Author(s)
  • Li, Yuening
  • Zhan, Faqiang
  • Lei, Ying
  • Shunthirasingham, Chubashini
  • Hung, Hayley
  • Wania, Frank
Publisher
American Chemical Society

Abstract

The use of passive air samplers (PAS) for semi-volatile organic compounds (SVOCs) continues to expand. To advance quantitative understanding of uptake kinetics, we calibrated the XAD-PAS, using a styrene–divinylbenzene sorbent, through a year-long side-by-side deployment with an active sampler. Twelve XAD-PASs, deployed in June 2020, were retrieved at 4-week intervals, while gas phase SVOCs were quantified in 48 consecutive week-long active samples taken from June 2020 to May 2021. Consistent with XAD’s high uptake capacity, even relatively volatile SVOCs, such as hexachlorobutadiene, displayed linear uptake throughout the entire deployment. Sampling rates (SRs) range between 0.1 and 0.6 m3 day–1 for 26 SVOCs, including brominated flame retardants, organophosphate esters, and halogenated methoxylated benzenes. SRs are compared with experimental SRs reported previously. The ability of the existing mechanistic uptake model PAS-SIM to reproduce the observed uptake and SRs was evaluated. Agreement between simulated and measured uptake curves was reasonable but varied with compound volatility and the assumed stagnant air layer boundary thickness. Even though PAS-SIM succeeds in predicting the SR range for the studied SVOCs, it fails to capture the volatility dependence of the SR by underestimating the length of the linear uptake period and by failing to consider the kinetics of sorption.

Description

This document is the unedited Author’s version of a Submitted Work that was subsequently accepted for publication in Environmental Science & Technology, copyright © 2023 American Chemical Society after peer review. To access the final edited and published work see https://doi.org/10.1021/acs.est.3c00809.

Subject

  • Nature and environment,
  • Science and technology

Rights

Pagination

24 pages, annex

Peer review

No

Open access level

Green

Identifiers

ISSN
0013-936X
1520-5851

Article

Journal title
Environmental Science & Technology
Journal volume
57
Journal issue
25
Accepted date
2023-05-24
Submitted date
2023-01-30

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Air

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