2023

Autoxidation Mechanism and Kinetics of Methacrolein in the Atmosphere

Formation of Highly Oxidized Organic Compounds and Secondary Organic Aerosol from alpha-Thujene Ozonolysis

2022

Chemistry of Secondary Organic Aerosol Formation from Reactions of Monoterpenes with OH Radicals in the Presence of NO(x)

DFT Study of the Formation of Atmospheric Aerosol Precursors from the Interaction between Sulfuric Acid and Benzenedicarboxylic Acid Molecules

A Theoretical Perspective on the Actinic Photochemistry of 2-Hydroperoxypropanal

Cost-Effective Implementation of Multiconformer Transition State Theory for Alkoxy Radical Unimolecular Reactions

Gas-Phase Ozone Reaction Kinetics of C(5)-C(8) Unsaturated Alcohols of Biogenic Interest

OH Radical and Chlorine Atom Kinetics of Substituted Aromatic Compounds: 4-chlorobenzotrifluoride (p-ClC(6)H(4)CF(3))

Kinetic and Mechanistic Investigations of OH-Initiated Atmospheric Degradation of Methyl Butyl Ketone

2021

Anthropogenic Volatile Organic Compound (AVOC) Autoxidation as a Source of Highly Oxygenated Organic Molecules (HOM)

Gas- and Particle-Phase Products and Their Mechanisms of Formation from the Reaction of Delta-3-Carene with NO(3) Radicals

Nonadiabatic Kinetics in the Intermediate Coupling Regime: Comparing Molecular Dynamics to an Energy-Grained Master Equation

Simplified Protocol for the Calculation of Multiconformer Transition State Theory Rate Constants Applied to Tropospheric OH-Initiated Oxidation Reactions

Gas-to-Particle Partitioning of Cyclohexene- and alpha-Pinene-Derived Highly Oxygenated Dimers Evaluated Using COSMOtherm

"Gas-Phase Chlorine Radical Oxidation of Alkanes: Effects of Structural Branching, NO(x), and Relative Humidity Observed during Environmental Chamber Experiments"

Comprehensive Analysis of Products and the Development of a Quantitative Mechanism for the OH Radical-Initiated Oxidation of 1-Alkenes in the Presence of NO(x)

2020

Unraveling Conformer-Specific Sources of Hydroxyl Radical Production from an Isoprene-Derived Criegee Intermediate by Deuteration

Experimental Evidence of Dioxole Unimolecular Decay Pathway for Isoprene-Derived Criegee Intermediates

Double Bonds Are Key to Fast Unimolecular Reactivity in First-Generation Monoterpene Hydroxy Peroxy Radicals

Microwave Spectrum and Internal Rotations of Heptan-2-one: A Pheromone in the Gas Phase

Spatial Separation of the Conformers of Methyl Vinyl Ketone

2019

Using Ionic Liquids To Study the Migration of Semivolatile Organic Vapors in Smog Chamber Experiments

2018

Effects of Gas-Particle Partitioning on Refractive Index and Chemical Composition of m-Xylene Secondary Organic Aerosol

The Reactivity of Toluene-Derived Secondary Organic Material with Ammonia and the Influence of Water Vapor

"Isoprene-Derived Organosulfates: Vibrational Mode Analysis by Raman Spectroscopy, Acidity-Dependent Spectral Modes, and Observation in Individual Atmospheric Particles"

Computational Investigation of RO(2) + HO(2) and RO(2) + RO(2) Reactions of Monoterpene Derived First-Generation Peroxy Radicals Leading to Radical Recycling

2017

Computational and Experimental Investigation of the Detection of HO(2) Radical and the Products of Its Reaction with Cyclohexene Ozonolysis Derived RO(2) Radicals by an Iodide-Based Chemical Ionization Mass Spectrometer

"Methoxysulfinyl Radical CH(3)OSO: Gas-Phase Generation, Photochemistry, and Oxidation"

"Conformational Landscape and Torsion-Rotation-Vibration Effects in the Two Conformers of Methyl Vinyl Ketone, a Major Oxidation Product of Isoprene"

Quantum Chemical Investigation on Photochemical Reactions of Nonanoic Acids at Air-Water Interface

Reactive Uptake of Dimethylamine by Ammonium Sulfate and Ammonium Sulfate-Sucrose Mixed Particles

Feasibility of Photosensitized Reactions with Secondary Organic Aerosol Particles in the Presence of Volatile Organic Compounds

"Aqueous Photochemistry of Secondary Organic Aerosol of alpha-Pinene and alpha-Humulene Oxidized with Ozone, Hydroxyl Radical, and Nitrate Radical"

Side-by-Side Comparison of Hydroperoxide and Corresponding Alcohol as Hydrogen-Bond Donors

2016

Effect of the Keto Group on Yields and Composition of Organic Aerosol Formed from OH Radical-Initiated Reactions of Ketones in the Presence of NOx

Can Highly Oxidized Organics Contribute to Atmospheric New Particle Formation?

Dimethylamine Addition to Formaldehyde Catalyzed by a Single Water Molecule: A Facile Route for Atmospheric Carbinolamine Formation and Potential Promoter of Aerosol Growth

Investigating the Heterogeneous Interaction of VOCs with Natural Atmospheric Particles: Adsorption of Limonene and Toluene on Saharan Mineral Dusts

Heterogeneous Reactions of Limonene on Mineral Dust: Impacts of Adsorbed Water and Nitric Acid

"Experimental Basicities of Phosphazene, Guanidinophosphazene, and Proton Sponge Superbases in the Gas Phase and Solution"

OH-Radical Oxidation of Surface-Active cis-Pinonic Acid at the Air-Water Interface

Rapid Hydrogen Shift Scrambling in Hydroperoxy-Substituted Organic Peroxy Radicals

"Experimental Study of the Formation of Organosulfates from alpha-Pinene Oxidation. Part I: Product Identification, Formation Mechanisms and Effect of Relative Humidity"

Molecular Isomer Identification of Titan's Tholins Organic Aerosols by Photoelectron/Photoion Coincidence Spectroscopy Coupled to VUV Synchrotron Radiation

Uptake of Semivolatile Secondary Organic Aerosol Formed from alpha-Pinene into Nonvolatile Polyethylene Glycol Probe Particles

"Kinetics, Mechanism, and Secondary Organic Aerosol Yield of Aqueous Phase Photo-oxidation of alpha-Pinene Oxidation Products"

2015

Volatility of atmospherically relevant alkylaminium carboxylate salts

Products and Mechanism of the Reaction of 1-Pentadecene with NO3 Radicals and the Effect of a -ONO2 Group on Alkoxy Radical Decomposition

Computational Study of the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Itself and Sulfuric Acid

Chemical compositions of black carbon particle cores and coatings via soot particle aerosol mass spectrometry with photoionization and electron ionization

Computational Study of Hydrogen Shifts and Ring-Opening Mechanisms in alpha-Pinene Ozonolysis Products

"Low-Pressure Photolysis of 2,3-Pentanedione in Air: Quantum Yields and Reaction Mechanism"

"Kinetic study of the gas-phase reactions of chlorine atoms with 2-chlorophenol, 2-nitrophenol, and four methyl-2-nitrophenol isomers"

Modeling the Charging of Highly Oxidized Cyclohexene Ozonolysis Products Using Nitrate-Based Chemical Ionization

2014

Quantum yields for photochemical production of NO2 from organic nitrates at tropospherically relevant wavelengths

Hydroxyalkoxy radicals: importance of intramolecular hydrogen bonding on chain branching reactions in the combustion and atmospheric decomposition of hydrocarbons

2013

Temperature-dependent Henry's law constants of atmospheric organics of biogenic origin

"Influence of humidity, temperature, and radicals on the formation and thermal properties of secondary organic aerosol (SOA) from ozonolysis of beta-pinene"

Photochemical aging of light-absorbing secondary organic aerosol material

OH radical-initiated chemistry of isoprene in aqueous media. Atmospheric implications

Radical product yields from the ozonolysis of short chain alkenes under atmospheric boundary layer conditions

Critical assessment of liquid density estimation methods for multifunctional organic compounds and their use in atmospheric science

Molecular modeling of the green leaf volatile methyl salicylate on atmospheric air/water interfaces

Kinetics and mechanism of the tropospheric oxidation of vinyl acetate initiated by OH radical: a theoretical study

Vibrational sum frequency generation spectroscopy of secondary organic material produced by condensational growth from alpha-pinene ozonolysis

2012

Theoretical investigation of interaction of dicarboxylic acids with common aerosol nucleation precursors

Influence of combustion conditions on hydrophilic properties and microstructure of flame soot

Protonation and oligomerization of gaseous isoprene on mildly acidic surfaces: implications for atmospheric chemistry

Secondary organic aerosol formation from low-NO(x) photooxidation of dodecane: evolution of multigeneration gas-phase chemistry and aerosol composition

2011

Interactions of volatile organic compounds with syndiotactic polystyrene crystalline nanocavities

2010

Detailed characterization of 2-heptanone conversion by dielectric barrier discharge in N(2) and N(2)/O(2) mixtures

Coefficients of evaporation and gas phase diffusion of low-volatility organic solvents in nitrogen from interferometric study of evaporating droplets

"Formation yields of glyoxal and methylglyoxal from the gas-phase OH radical-initiated reactions of toluene, xylenes, and trimethylbenzenes as a function of NO2 concentration"

2008

Organosulfate formation in biogenic secondary organic aerosol

Organic carbonates: experiment and ab initio calculations for prediction of thermochemical properties

Formation of volatile organic compounds in the heterogeneous oxidation of condensed-phase organic films by gas-phase OH

Contribution of carbonyl photochemistry to aging of atmospheric secondary organic aerosol

2007

Photochemistry of the indoor air pollutant acetone on Degussa P25 TiO2 studied by chemical ionization mass spectrometry

2006

Permeability of acetic acid through organic films at the air-aqueous interface

2005

Formation of hydroxyl radical from the photolysis of frozen hydrogen peroxide

NOx formation in the plasma treatment of halomethanes

Roles of hydrophobicity and volatility of organic substrates on sonolytic kinetics in aqueous solutions

Products and mechanism of secondary organic aerosol formation from reactions of linear alkenes with NO3 radicals