[HTML][HTML] TURBOMOLE: Modular program suite for ab initio quantum-chemical and condensed-matter simulations
TURBOMOLE is a collaborative, multi-national software development project aiming to
provide highly efficient and stable computational tools for quantum chemical simulations of …
provide highly efficient and stable computational tools for quantum chemical simulations of …
Emerging investigator series: surfactants, films, and coatings on atmospheric aerosol particles: a review
KA Wokosin, EL Schell, JA Faust - Environmental Science …, 2022 - pubs.rsc.org
Surfactants are surface-active molecules or ions that can often be found at the surface of
atmospheric aerosol particles. Some surfactants, such as biomolecules in marine aerosol …
atmospheric aerosol particles. Some surfactants, such as biomolecules in marine aerosol …
New insights into the brown carbon chromophores and formation pathways for aqueous reactions of α-dicarbonyls with amines and ammonium
Aqueous-phase reactions of α-dicarbonyls with ammonium or amines have been identified
as important sources of secondary brown carbon (BrC). However, the identities of most …
as important sources of secondary brown carbon (BrC). However, the identities of most …
Molecular characterization of nitrogen-containing compounds in humic-like substances emitted from biomass burning and coal combustion
J Song, M Li, C Zou, T Cao, X Fan, B Jiang… - Environmental …, 2021 - ACS Publications
N-containing organic compounds (NOCs) in humic-like substances (HULIS) emitted from
biomass burning (BB) and coal combustion (CC) were characterized by ultrahigh-resolution …
biomass burning (BB) and coal combustion (CC) were characterized by ultrahigh-resolution …
Investigation of primary and secondary particulate brown carbon in two Chinese cities of **'an and Hong Kong in wintertime
Brown carbon (BrC), an aerosol carbonaceous matter component, impacts atmospheric
radiation and global climate because of its absorption in the near-ultraviolet–visible region …
radiation and global climate because of its absorption in the near-ultraviolet–visible region …
Optical properties and molecular compositions of water-soluble and water-insoluble brown carbon (BrC) aerosols in northwest China
Brown carbon (BrC) contributes significantly to aerosol light absorption and thus can affect
the Earth's radiation balance and atmospheric photochemical processes. In this study, we …
the Earth's radiation balance and atmospheric photochemical processes. In this study, we …
pH-Dependent Aqueous-Phase Brown Carbon Formation: Rate Constants and Implications for Solar Absorption and Atmospheric Photochemistry
Aqueous-phase reactions of α-dicarbonyls with amines or ammonium have been identified
as important sources of secondary brown carbon (BrC). However, the kinetics of BrC …
as important sources of secondary brown carbon (BrC). However, the kinetics of BrC …
A new advance in the pollution profile, transformation process, and contribution to aerosol formation and aging of atmospheric amines
X Shen, J Chen, G Li, T An - Environmental Science: Atmospheres, 2023 - pubs.rsc.org
Amines, formed with the replacement of hydrogen atoms by NH3 molecules of volatile
organic compounds, possess distinctive properties of alkalinity, volatility, water-solubility and …
organic compounds, possess distinctive properties of alkalinity, volatility, water-solubility and …
Evidence for the formation of imidazole from carbonyls and reduced nitrogen species at the individual particle level in the ambient atmosphere
X Lian, G Zhang, Y Yang, Q Lin, Y Fu… - … & Technology Letters, 2020 - ACS Publications
While laboratory studies have demonstrated that aqueous reactions between carbonyls and
reduced nitrogen species may contribute to the production of N-heterocycle brown carbon …
reduced nitrogen species may contribute to the production of N-heterocycle brown carbon …
Photochemical cloud processing of primary wildfire emissions as a potential source of secondary organic aerosol
We investigated the gas-phase chemical composition of biomass burning (BB) emissions
and their role in aqueous secondary organic aerosol (aqSOA) formation through …
and their role in aqueous secondary organic aerosol (aqSOA) formation through …