EVAPORATION: a new vapour pressure estimation methodfor organic molecules including non-additivity and intramolecular interactions
S Compernolle, K Ceulemans… - … Chemistry and Physics, 2011 - acp.copernicus.org
We present EVAPORATION (Estimation of VApour Pressure of ORganics, Accounting for
Temperature, Intramolecular, and Non-additivity effects), a method to predict (subcooled) …
Temperature, Intramolecular, and Non-additivity effects), a method to predict (subcooled) …
α-Pinene autoxidation products may not have extremely low saturation vapor pressures despite high O: C ratios
COSMO-RS (conductor-like screening model for real solvents) and three different group-
contribution methods were used to compute saturation (subcooled) liquid vapor pressures …
contribution methods were used to compute saturation (subcooled) liquid vapor pressures …
Explicit modelling of SOA formation from α-pinene photooxidation: sensitivity to vapour pressure estimation
R Valorso, B Aumont, M Camredon… - Atmospheric …, 2011 - acp.copernicus.org
The sensitivity of the formation of secondary organic aerosol (SOA) to the estimated vapour
pressures of the condensable oxidation products is explored. A highly detailed reaction …
pressures of the condensable oxidation products is explored. A highly detailed reaction …
A chemical ionization high-resolution time-of-flight mass spectrometer coupled to a micro orifice volatilization impactor (MOVI-HRToF-CIMS) for analysis of gas and …
RLN Yatavelli, F Lopez-Hilfiker, JD Wargo… - Aerosol Science and …, 2012 - Taylor & Francis
We describe a new instrument, chemical ionization (CI) high-resolution time-of-flight mass
spectrometer (ToFMS) coupled to a micro-orifice volatilization impactor (MOVI-HRToF …
spectrometer (ToFMS) coupled to a micro-orifice volatilization impactor (MOVI-HRToF …
An assessment of vapour pressure estimation methods
Laboratory measurements of vapour pressures for atmospherically relevant compounds
were collated and used to assess the accuracy of vapour pressure estimates generated by …
were collated and used to assess the accuracy of vapour pressure estimates generated by …
Modeling regional secondary organic aerosol using the Master Chemical Mechanism
J Li, M Cleveland, LD Ziemba, RJ Griffin… - Atmospheric …, 2015 - Elsevier
A modified near-explicit Master Chemical Mechanism (MCM, version 3.2) with 5727 species
and 16,930 reactions and an equilibrium partitioning module was incorporated into the …
and 16,930 reactions and an equilibrium partitioning module was incorporated into the …
SOA formation from the photooxidation of -pinene: systematic exploration of the simulation of chamber data
Chemical mechanisms play an important role in simulating the atmospheric chemistry of
volatile organic compound oxidation. Comparison of mechanism simulations with laboratory …
volatile organic compound oxidation. Comparison of mechanism simulations with laboratory …
Modeling SOA formation from the oxidation of intermediate volatility n-alkanes
B Aumont, R Valorso, C Mouchel-Vallon… - Atmospheric …, 2012 - acp.copernicus.org
The chemical mechanism leading to SOA formation and ageing is expected to be a
multigenerational process, ie a successive formation of organic compounds with higher …
multigenerational process, ie a successive formation of organic compounds with higher …
The effect of photochemical ageing and initial precursor concentration on the composition and hygroscopic properties of β-caryophyllene secondary organic aerosol
The effect of photochemical ageing and initial precursor concentration on the composition
and hygroscopic properties of secondary organic aerosol (SOA) formed during the chamber …
and hygroscopic properties of secondary organic aerosol (SOA) formed during the chamber …
A significant role for nitrate and peroxide groups on indoor secondary organic aerosol
This paper reports indoor secondary organic aerosol, SOA, composition based on the
results from an improved model for indoor air chemistry. The model uses a detailed chemical …
results from an improved model for indoor air chemistry. The model uses a detailed chemical …