Laboratory studies of organic peroxy radical chemistry: an overview with emphasis on recent issues of atmospheric significance
JJ Orlando, GS Tyndall - Chemical Society Reviews, 2012 - pubs.rsc.org
Organic peroxy radicals (often abbreviated RO2) play a central role in the chemistry of the
Earth's lower atmosphere. Formed in the atmospheric oxidation of essentially every organic …
Earth's lower atmosphere. Formed in the atmospheric oxidation of essentially every organic …
Kinetics of elementary reactions in low-temperature autoignition chemistry
Advanced low-temperature combustion concepts that rely on compression ignition have
placed new technological demands on the modeling of low-temperature oxidation in general …
placed new technological demands on the modeling of low-temperature oxidation in general …
Theoretical studies of atmospheric reaction mechanisms in the troposphere
L Vereecken, JS Francisco - Chemical Society Reviews, 2012 - pubs.rsc.org
The chemistry of the atmosphere encompasses a vast number of reactions acting on a
plethora of intermediates. These reactions, occurring sequentially and in parallel, give rise to …
plethora of intermediates. These reactions, occurring sequentially and in parallel, give rise to …
HO x radical regeneration in the oxidation of isoprene
J Peeters, TL Nguyen, L Vereecken - Physical Chemistry Chemical …, 2009 - pubs.rsc.org
We propose, and quantify from first principles, two novel HOx-regenerating unimolecular
reactions in isoprene oxidation, which are estimated to yield in pristine tropical forest …
reactions in isoprene oxidation, which are estimated to yield in pristine tropical forest …
Hydroxyl radical recycling in isoprene oxidation driven by hydrogen bonding and hydrogen tunneling: The upgraded LIM1 mechanism
J Peeters, JF Müller, T Stavrakou… - The Journal of Physical …, 2014 - ACS Publications
The Leuven isoprene mechanism, proposed earlier to aid in rationalizing the unexpectedly
high hydroxyl radical (OH) concentrations in isoprene-rich, low-nitric-oxide (NO) regions …
high hydroxyl radical (OH) concentrations in isoprene-rich, low-nitric-oxide (NO) regions …
Isoprene photooxidation: new insights into the production of acids and organic nitrates
F Paulot, JD Crounse, HG Kjaergaard… - Atmospheric …, 2009 - acp.copernicus.org
We describe a nearly explicit chemical mechanism for isoprene photooxidation guided by
chamber studies that include time-resolved observation of an extensive suite of volatile …
chamber studies that include time-resolved observation of an extensive suite of volatile …
Importance of secondary sources in the atmospheric budgets of formic and acetic acids
We present a detailed budget of formic and acetic acids, two of the most abundant trace
gases in the atmosphere. Our bottom-up estimate of the global source of formic and acetic …
gases in the atmosphere. Our bottom-up estimate of the global source of formic and acetic …
Combustion chemistry of alkenes and alkadienes
Alkenes formed, during the refining of crude oil, by cracking the heavier fractions are present
in transportation fuels in significant amounts, up to as much as 15–20% in gasoline …
in transportation fuels in significant amounts, up to as much as 15–20% in gasoline …
Quantitative Kinetics of HO2 Reactions with Aldehydes in the Atmosphere: High-Order Dynamic Correlation, Anharmonicity, and Falloff Effects Are All Important
B Long, Y Xia, DG Truhlar - Journal of the American Chemical …, 2022 - ACS Publications
Kinetics provides the fundamental parameters for elucidating sources and sinks of key
atmospheric species and for atmospheric modeling more generally. Obtaining quantitative …
atmospheric species and for atmospheric modeling more generally. Obtaining quantitative …
[HTML][HTML] H migration in peroxy radicals under atmospheric conditions
L Vereecken, B Nozière - Atmospheric chemistry and physics, 2020 - acp.copernicus.org
A large data set of rate coefficients for H migration in peroxy radicals is presented and
supplemented with literature data to derive a structure–activity relationship (SAR) for the title …
supplemented with literature data to derive a structure–activity relationship (SAR) for the title …