Machine learning for chemical reactions
M Meuwly - Chemical Reviews, 2021 - ACS Publications
Machine learning (ML) techniques applied to chemical reactions have a long history. The
present contribution discusses applications ranging from small molecule reaction dynamics …
present contribution discusses applications ranging from small molecule reaction dynamics …
The acidity of atmospheric particles and clouds
Acidity, defined as pH, is a central component of aqueous chemistry. In the atmosphere, the
acidity of condensed phases (aerosol particles, cloud water, and fog droplets) governs the …
acidity of condensed phases (aerosol particles, cloud water, and fog droplets) governs the …
Global estimates of inorganic nitrogen deposition across four decades
D Ackerman, DB Millet, X Chen - Global Biogeochemical …, 2019 - Wiley Online Library
Atmospheric deposition of inorganic nitrogen is critical to the function of ecosystems and
elemental cycles. During the industrial period, humans have doubled the amount of …
elemental cycles. During the industrial period, humans have doubled the amount of …
[HTML][HTML] A review of indoor gaseous organic compounds and human chemical exposure: insights from real-time measurements
Gaseous organic compounds, mainly volatile organic compounds (VOCs), have become a
wide concern in various indoor environments where we spend the majority of our daily time …
wide concern in various indoor environments where we spend the majority of our daily time …
Ubiquitous atmospheric production of organic acids mediated by cloud droplets
Atmospheric acidity is increasingly determined by carbon dioxide and organic acids,–.
Among the latter, formic acid facilitates the nucleation of cloud droplets and contributes to …
Among the latter, formic acid facilitates the nucleation of cloud droplets and contributes to …
[HTML][HTML] A new model mechanism for atmospheric oxidation of isoprene: global effects on oxidants, nitrogen oxides, organic products, and secondary organic aerosol
Atmospheric oxidation of isoprene, the most abundantly emitted non-methane hydrocarbon,
affects the abundances of ozone (O 3), the hydroxyl radical (OH), nitrogen oxide radicals …
affects the abundances of ozone (O 3), the hydroxyl radical (OH), nitrogen oxide radicals …
Criegee intermediates and their impacts on the troposphere
Criegee intermediates (CIs), carbonyl oxides formed in ozonolysis of alkenes, play key roles
in the troposphere. The decomposition of CIs can be a significant source of OH to the …
in the troposphere. The decomposition of CIs can be a significant source of OH to the …
Description of the NASA GEOS composition forecast modeling system GEOS‐CF v1. 0
Abstract The Goddard Earth Observing System composition forecast (GEOS‐CF) system is a
high‐resolution (0.25°) global constituent prediction system from NASA's Global Modeling …
high‐resolution (0.25°) global constituent prediction system from NASA's Global Modeling …
Unimolecular decay strongly limits the atmospheric impact of Criegee intermediates
Stabilized Criegee intermediates (SCI) are reactive oxygenated species formed in the
ozonolysis of hydrocarbons. Their chemistry could influence the oxidative capacity of the …
ozonolysis of hydrocarbons. Their chemistry could influence the oxidative capacity of the …
Sources, seasonality, and trends of southeast US aerosol: an integrated analysis of surface, aircraft, and satellite observations with the GEOS-Chem chemical …
We use an ensemble of surface (EPA CSN, IMPROVE, SEARCH, AERONET), aircraft (SEAC
4 RS), and satellite (MODIS, MISR) observations over the southeast US during the summer …
4 RS), and satellite (MODIS, MISR) observations over the southeast US during the summer …