% IMPORTANT: The following is UTF-8 encoded. This means that in the presence
% of non-ASCII characters, it will not work with BibTeX 0.99 or older.
% Instead, you should use an up-to-date BibTeX implementation like “bibtex8” or
% “biber”.
@ARTICLE{Pang:1016824,
author = {Pang, Jacky Y. S. and Berg, Florian and Novelli, Anna and
Bohn, Birger and Färber, Michelle and Carlsson, Philip T.
M. and Dubus, René and Gkatzelis, Georgios and Rohrer,
Franz and Wedel, Sergej and Wahner, Andreas and Fuchs,
Hendrik},
title = {{A}tmospheric photooxidation and ozonolysis of sabinene:
reaction rate coefficients, product yields, and chemical
budget of radicals},
journal = {Atmospheric chemistry and physics},
volume = {23},
number = {19},
issn = {1680-7316},
address = {Katlenburg-Lindau},
publisher = {EGU},
reportid = {FZJ-2023-03808},
pages = {12631 - 12649},
year = {2023},
abstract = {The oxidation of sabinene by the hydroxyl radical (OH) and
ozone (O3) was investigated under atmospherically relevant
conditions in the atmospheric simulation chamber SAPHIR
(Simulation of Atmospheric Photochemistry In a Large
Reaction Chamber) at Forschungszentrum Jülich, Germany. The
rate coefficients of the reactions of sabinene with OH and
with O3 were determined. The temperature dependence between
284 to 340 K of the rate coefficient of the reaction of
sabinene with OH, kSAB+OH, was measured for the first time
using an OH reactivity instrument, resulting in an Arrhenius
expression of
(1.67 ± 0.16) × 10−11 × exp((575 ± 30)/T) cm3 s−1.
The values agree with those determined in chamber
experiments in this work and reported in the literature for
∼ 298 K within the uncertainties of measurements. The
ozonolysis reaction rate coefficient of sabinene (kSAB+O3)
determined in chamber experiments at a temperature of
(278 ± 2) K is
(3.4 ± 0.8) × 10−17 cm3 s−1, which is
$58 \%$ lower than the value reported in the literature
for room temperature. The measurement of products from the
oxidation of sabinene by OH resulted in an acetone yield of
$(21 ± 15) \%,$ a formaldehyde yield of
$(46 ± 25) \%,$ and a sabinaketone yield of
$(18 ± 16) \%.$ All yields determined in the chamber
experiments agree well with values from previous laboratory
studies within their uncertainties. In addition, the
formaldehyde yield determined in this study is consistent
with that predicted by the sabinene OH-oxidation mechanism
which was devised from quantum chemical calculations by Wang
and Wang (2018), whereas the acetone yield is about
$15 \%$ higher than that predicted by the mechanism. In
the ozonolysis experiments, the analysis of product
measurements results in an acetone yield of
$(5 ± 2) \%,$ a formaldehyde yield of
$(48 ± 15) \%,$ a sabinaketone yield of
$(31 ± 15) \%,$ and an OH radical yield of
$(26 ± 29) \%.$ The OH radical yield is lower than
expected from the theoretical mechanism in Wang and Wang
(2017), but the value still agrees within the uncertainty.
An analysis of the chemical budget of OH radicals was
performed for the chamber experiments. The analysis reveals
that the destruction rate of the OH radical matches the
production rate of OH, suggesting that there is no
significant missing OH source for example from isomerization
reactions of peroxy radicals for the experimental conditions
in this work.},
cin = {IEK-8},
ddc = {550},
cid = {I:(DE-Juel1)IEK-8-20101013},
pnm = {2111 - Air Quality (POF4-211)},
pid = {G:(DE-HGF)POF4-2111},
typ = {PUB:(DE-HGF)16},
UT = {WOS:001161793600001},
doi = {10.5194/acp-23-12631-2023},
url = {https://juser.fz-juelich.de/record/1016824},
}