publication venue for

• Effects of Naphthyl Connectivity on the Photophysics of Compact Organic Charge-Transfer Photoredox Catalysts. 2019
• Symmetry-Projected Jastrow Mean-Field Wave Function in Variational Monte Carlo 2019
• Nonadiabatic Eigenfunctions Can Have Amplitude, Signed Conical Nodes, or Signed Higher Order Nodes at a Conical Intersection with Circular Symmetry (vol 121, pg 7401, 2017) 2019
• Heterogeneous Interactions between Gas-Phase Pyruvic Acid and Hydroxylated Silica Surfaces: A Combined Experimental and Theoretical Study 2019
• Reactivity of Electronically Excited SO2 with Alkanes 2018
• Interactions of Molecular Titanium Oxides TiOx (x=1-3) with Carbon Dioxide in Cluster Anions 2018
• Thermal Decompositions of the Lignin Model Compounds: Salicylaldehyde and Catechol 2018
• Double Hydrogen-Atom Exchange Reactions of HX (X = F, CI, Br, I) with HO2 2018
• Photoelectron Spectroscopy of the Aminomethoxide Anion, H2C(NH2)O- 2018
• Atmospheric Hydroxyl Radical Source: Reaction of Triplet SO2 and Water 2018
• Infrared Photodissociation Spectra of [Sn(CO2)(n)](-) Cluster Ions 2018
• Identification and Quantitation of Aerosol Products of the Reaction of beta-Pinene with NO3 Radicals and Implications for Gas- and Particle-Phase Reaction Mechanisms 2018
• Titanium Insertion into CO Bonds in Anionic Ti-CO2 Complexes 2018
• Excited States of Methylene, Polyenes, and Ozone from Heat-Bath Configuration Interaction 2018
• Immersion and Contact Efflorescence Induced by Mineral Dust Particles 2018
• Immersion and Contact Efflorescence Induced by Mineral Dust Particles. 2018
• Tribute to Veronica Vaida 2018
• p-Carborane Conjugation in Radical Anions of Cage-Cage and Cage-Phenyl Compounds 2018
• Solvent-Controlled Branching of Localized versus Delocalized Singlet Exciton States and Equilibration with Charge Transfer in a Structurally Well-Defined Tetracene Dimer 2017
• Active Thermochemical Tables: The Adiabatic Ionization Energy of Hydrogen Peroxide 2017
• Comment on "Reactivity of Ketyl and Acetyl Radicals from Direct Solar Actinic Photolysis of Aqueous Pyruvic Acid" 2017
• Singlet Fission and Excimer Formation in Disordered Solids of Alkyl-Substituted 1,3-Diphenylisobenzofurans 2017
• Atmospheric Simulation Chamber Studies of the Gas-Phase Photolysis of Pyruvic Acid 2017
• pH Dependence of the Aqueous Photochemistry of alpha-Keto Acids 2017
• Interaction of CO2 with Atomic Manganese in the Presence of an Excess Negative Charge Probed by Infrared Spectroscopy of [Mn(CO2)(n)](-) Clusters 2017
• Nonadiabatic Eigenfunctions Can Have Amplitude, Signed Conical Nodes, or Signed Higher Order Nodes at a Conical Intersection with Circular Symmetry 2017
• Can COSMOTherm Predict a Salting in Effect? 2017
• Linear Response Theory for Water Transport Through Dry Nanopores 2017
• Tabletop Femtosecond VUV Photoionization and PEPICO Detection of Microreactor Pyrolysis Products 2017
• Hygroscopicity of Organic Compounds as a Function of Carbon Chain Length and Carboxyl, Hydroperoxy, and Carbonyl Functional Groups 2017
• IR Spectra of n-Bu4M (M = Si, Ge, Sn, Pb), n-BuAuPPh3-d(15), and "n-Bu" on a Gold Surface 2017
• Thermal Decomposition of Potential Ester Biofuels. Part I: Methyl Acetate and Methyl Butanoate 2017
• Kinetics of the Reactions of NO3 Radical with Methacrylate Esters 2017
• Mechanistic Description of Photochemical Oligomer Formation from Aqueous Pyruvic Acid 2017
• Structural Motifs of [Fe(CO2)(n)](-) Clusters (n=3-7) 2017
• Multiphase Photochemistry of Pyruvic Acid under Atmospheric Conditions 2017
• Uncovering Highly-Excited State Mixing in Acetone Using Ultrafast VUV Pulses and Coincidence Imaging Techniques 2017
• Photodissociation Dynamics of the i-Methylvinoxy Radical at 308, 248, and 225 nm Using Fast Beam Photofragment Translational Spectroscopy 2017
• Chemical Equilibria and Kinetics in Aqueous Solutions of Zymonic Acid 2016
• Gas-Phase Photolysis of Pyruvic Acid: The Effect of Pressure on Reaction Rates and Products 2016
• Correction to "Modeling the Radical Chemistry in an Oxidation Flow Reactor: Radical Formation and Recycling, Sensitivities, and the OH Exposure Estimation Equation". 2016
• Reaction Kinetics of HBr with HO2: A New Channel for Isotope Scrambling Reactions 2016
• Hydration of a Binding Site With Restricted Solvent Access: Solvatochromic Shift of the Electronic Spectrum of a Ruthenium Polypyridine Complex, One Molecule at a Time 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 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. 2016
• Solution-Phase Singlet Fission in a Structurally Well-Defined Norbornyl-Bridged Tetracene Dimer 2016
• Electronic Spectra of the Tetraphenylcyclobutadienecyclopentadienylnickel(II) Cation and Radical 2016
• Excitation Localization/Delocalization Isomerism in a Strongly Coupled Covalent Dimer of 1,3-Diphenylisobenzofuran 2016
• Kinetics of Acid-Catalyzed Dehydration of Cyclic Hemiacetals in Organic Aerosol Particles in Equilibrium with Nitric Acid Vapor 2016
• Modeling the Radical Chemistry in an Oxidation Flow Reactor: Radical Formation and Recycling, Sensitivities, and the OH Exposure Estimation Equation (vol 119, pg 4418, 2015) 2016
• Ligand Influence on the Electronic Spectra of Dicationic Ruthenium-Bipyridine-Terpyridine Complexes 2016
• Pyrolysis of the Simplest Carbohydrate, Glycolaldehyde (CHO-CH2OH), and Glyoxal in a Heated Microreactor 2016
• Photoelectron Spectroscopy of cis-Nitrous Acid Anion (cis-HONO-) 2016
• Observational Constraints on the Oxidation of NOx in the Upper Troposphere 2016
• Persistent Water-Nitric Acid Condensate with Saturation Water Vapor Pressure Greater than That of Hexagonal Ice 2016
• Experimental and Theoretical Studies of the Reactivity and Thermochemistry of Dicyanamide: N(CN)(2)(-) 2016
• Isomerization and Fragmentation of Cyclohexanone in a Heated Micro-Reactor 2015
• Absorption Spectrum of a Ru(II)-Aquo Complex in Vacuo: Resolving Individual Charge-Transfer Transitions 2015
• Sum over Histories Representation for Kinetic Sensitivity Analysis: How Chemical Pathways Change When Reaction Rate Coefficients Are Varied 2015
• Sum over Histories Representation for Kinetic Sensitivity Analysis: How Chemical Pathways Change When Reaction Rate Coefficients Are Varied. 2015
• On the HCN - HNC Energy Difference 2015
• Products and Mechanism of the Reaction of 1-Pentadecene with NO3 Radicals and the Effect of a -ONO2 Group on Alkoxy Radical Decomposition 2015
• Isoprene NO3 Oxidation Products from the RO2 + HO2 Pathway 2015
• Pyrolysis Pathways of the Furanic Ether 2-Methoxyfuran 2015
• Intramolecular Hydrogen Bonding in Methyl Lactate 2015
• Pyrolysis of Cyclopentadienone: Mechanistic Insights from a Direct Measurement of Product Branching Ratios 2015
• A Tribute to Mario Molina 2015
• Chemical Compositions of Black Carbon Particle Cores and Coatings via Soot Particle Aerosol Mass Spectrometry with Photoionization and Electron Ionization 2015
• Computational Study of the Effect of Glyoxal-Sulfate Clustering on the Henry's Law Coefficient of Glyoxal 2015
• Measurements of the Absorption Cross Section of (CHOCHO)-C-13-C-13 at Visible Wavelengths and Application to DOAS Retrievals 2015
• Modeling the Radical Chemistry in an Oxidation Flow Reactor: Radical Formation and Recycling, Sensitivities, and the OH Exposure Estimation Equation 2015
• Recent Trends in Global Emissions of Hydrochlorofluorocarbons and Hydrofluorocarbons: Reflecting on the 2007 Adjustments to the Montreal Protocol 2015
• Secondary Organic Aerosol Composition from C-12 Alkanes 2015
• Energy Pooling Upconversion in Organic Molecular Systems 2015
• Pulse Propagation Effects in Optical 2D Fourier-Transform Spectroscopy: Theory 2015
• Changes to the Chemical Composition of Soot from Heterogeneous Oxidation Reactions 2015
• Simplified Cartesian Basis Model for Intrapolyad Emission Intensities in the Bent-to-Linear Electronic Transition of Acetylene 2015
• Structures of [CoO(CO2)(n)](-) and [NiO(CO2)(n)](-) Clusters Studied by Infrared Spectroscopy 2015
• Exploring Non-Condon Effects in a Covalent Tetracene Dimer: How Important Are Vibrations in Determining the Electronic Coupling for Singlet Fission? 2015
• Gas-Phase Acidities of Nitrated Azoles as Determined by the Extended Kinetic Method and Computations 2015
• From Ordinary to Blue Emission in Peralkylated n-Oligosilanes: The Calculated Structure of Delocalized and Localized Singlet Excitons 2014
• Structural Diversity of Copper-CO2 Complexes: Infrared Spectra and Structures of [Cu(CO2)(n)](-) Clusters 2014
• Synthesis, electrochemical characterization, and photophysical studies of structurally tuned aryl-substituted terpyridyl ruthenium(II) complexes. 2014
• Photodissociation Spectroscopy of the Anionic Copper Nitrate Association Complex Cu(NO3)(3)(-) 2014
• Chemical and Physical Transformations of Aluminosilicate Clay Minerals Due to Acid Treatment and Consequences for Heterogeneous Ice Nucleation 2014
• Identification and Yields of 1,4-Hydroxynitrates Formed from the Reactions of C-8-C-16 n-Alkanes with OH Radicals in the Presence of NOx 2014
• Interaction of Nickel with Carbon Dioxide in [Ni(CO2)(n)](-) Clusters Studied by Infrared Spectroscopy 2014
• Alkyl Nitrate Formation from the Reactions of C-8-C-14 n-Alkanes with OH Radicals in the Presence of NOx: Measured Yields with Essential Corrections for Gas-Wall Partitioning 2014
• Photochemical Kinetics of Pyruvic Acid in Aqueous Solution 2014
• Doubling Down: Delving into the Details of Diacid Adsorption at Aqueous Surfaces 2014
• Infrared Spectra and Structures of Anionic Complexes of Cobalt with Carbon Dioxide Ligands 2014
• Polarized Matrix Infrared Spectra of Cyclopentadienone: Observations, Calculations, and Assignment for an Important Intermediate in Combustion and Biomass Pyrolysis 2014
• Dynamics of Small, Ultraviolet-Excited ICN- Cluster Anions 2013
• Laser-Induced Fluorescence Study of the S-1 State of Doubly-Substituted C-13 Acetylene and Harmonic Force Field Determination 2013
• H2O Vapor Transmission Rate through Polyethylene Naphtha late Polymer Using the Electrical Ca Test 2013
• High-Accuracy Estimates for the Vinylidene-Acetylene lsomerization Energy and the Ground State Rotational Constants of :C=CH2 2013
• Photodissociation Dynamics of the Thiophenoxy Radical at 248, 193, and 157 nm 2013
• Ion-Induced Reorientation and Distribution of Pentanone in the Air–Water Boundary Layer 2013
• Solvent-Mediated Reduction of Carbon Dioxide in Anionic Complexes with Silver Atoms 2013
• Direct Measurements of Rate Constants for the Reactions of CH3 Radicals with C2H6, C2H4, and C2H2 at High Temperatures 2013
• Intramolecular Interactions in 2-Aminoethanol and 3-Aminopropanol 2013
• Tunable electronic coupling and driving force in structurally well-defined tetracene dimers for molecular singlet fission: a computational exploration using density functional theory. 2013
• Experimental and computational exploration of ground and excited state properties of highly strained ruthenium terpyridine complexes. 2013
• Absolute Measurement of Femtosecond Pump-Probe Signal Strength 2013
• Pulse Propagation Effects in Optical 2D Fourier-Transform Spectroscopy: Experiment 2013
• Multitarget Global Sensitivity Analysis of n-Butanol Combustion 2013
• Spectroscopy and Photochemistry of Sodium Chromate Ester Cluster Ions 2013
• Dynamics of the 3MLCT in Ru(II) terpyridyl complexes probed by ultrafast spectroscopy: evidence of excited-state equilibration and interligand electron transfer. 2012
• Fifth Stereoactive Orbital on Silicon: Relaxation of the Lowest Singlet Excited State of Octamethyltrisilane 2012
• Depositional Ice Nucleation on Monocarboxylic Acids: Effect of the O:C Ratio 2012
• Bond Energies and Structures of Ammonia-Sulfuric Acid Positive Cluster Ions 2012
• Cavity-Enhanced Measurements of Hydrogen Peroxide Absorption Cross Sections from 353 to 410 nm 2012
• Heterogeneous Glyoxal Oxidation: A Potential Source of Secondary Organic Aerosol 2012
• Near Infrared Photochemistry of Pyruvic Acid in Aqueous Solution 2012
• Secondary Organic Aerosol Formation from Low-NOx Photooxidation of Dodecane: Evolution of Multigeneration Gas-Phase Chemistry and Aerosol Composition 2012
• Photoelectron Spectroscopy of Anilinide and Acidity of Aniline 2012
• Wavelength Dependence of the Suppressed Ionization of Molecules in Strong Laser Fields 2012
• Theoretical Determination of the Rate Coefficient for the HO2 + HO2 -> H2O2+O-2 Reaction: Adiabatic Treatment of Anharmonic Torsional Effects 2012
• Absolute Intensities of NH-Stretching Transitions in Dimethylamine and Pyrrole 2012
• Spectroscopy and Fragmentation of Undercoordinated Bromoiridates 2011
• Electronic and Vibrational Transition Moment Directions in 7-Dimethylamino-3-methyl-N-methyl-d(3)-4-phenylethynylcarbostyril 2011
• Vibrational Autodetachment-Intramolecular Vibrational Relaxation Translated Into Electronic Motion (vol 114, pg 4017, 2010) 2011
• Autocatalyses 2011
• Alignment, Vibronic Level Splitting, and Coherent Coupling Effects on the Pump-Probe Polarization Anisotropy 2011
• Gas-Phase Experiments on Au(III) Photochemistry 2011
• Computational exploration of heterolytic halogen-carbon bond scission photoreactions in ruthenium polypyridyl complexes. 2011
• Excited-State Processes in First-Generation Phenyl-Cored Thiophene Dendrimers 2011
• Global Sensitivity Analysis of Chemical-Kinetic Reaction Mechanisms: Construction and Deconstruction of the Probability Density Function 2011
• Photoelectron Spectroscopic Study of the Oxyallyl Diradical 2011
• Measurement of the Fourth O-H Overtone Absorption Cross Section in Acetic Acid Using Cavity Ring-Down Spectroscopy 2011
• Direct Detection of Products from the Pyrolysis of 2-Phenethyl Phenyl Ether 2011
• Overtone Spectra of 2-Mercaptoethanol and 1,2-Ethanedithiol 2010
• Microhydration of Nitromethane Anions from Both a Solute and Solvent Perspective 2010
• Theoretical Validation of Chemical Kinetic Mechanisms: Combustion of Methanol 2010
• Vibrational Autodetachment-Intramolecular Vibrational Relaxation Translated Into Electronic Motion (vol 114, pg 4017, 2010) 2010
• Cooling Enhancement of Aerosol Particles Due to Surfactant Precipitation 2010
• Intramolecular Hydrogen Migration in Alkylperoxy and Hydroperoxyalkylperoxy Radicals: Accurate Treatment of Hindered Rotors 2010
• D-Atom Products in Predissociation of CD2CD2OH from the 202-215 nm Photodissociation of 2-Bromoethanol 2010
• Vibrational Autodetachment-Intramolecular Vibrational Relaxation Translated into Electronic Motion 2010
• Autobiography of W. Carl Lineberger 2010
• Quartz Crystal Microbalance Studies of Al2O3 Atomic Layer Deposition Using Trimethylaluminum and Water at 125 degrees C 2010
• Simulations of ICI-(CO2)(n) Photodissociation: Effects of Structure, Excited State Charge Flow, and Solvent Dynamics 2010
• Toward Designed Singlet Fission: Electronic States and Photophysics of 1,3-Diphenylisobenzofuran 2010
• Photoelectron Spectroscopy and Thermochemistry of the Peroxyformate Anion 2010
• Optical Properties of Internally Mixed Aerosol Particles Composed of Dicarboxylic Acids and Ammonium Sulfate 2009
• Preface to the Robert W. Field Festschrift 2009
• Propagation and Beam Geometry Effects on Two-Dimensional Fourier Transform Spectra of Multilevel Systems 2009
• Comment on "A New Proposal for the Ground State of the FeO- Cluster in the Gas Phase and for the Assignment of Its Photoelectron Spectra" 2009
• Dealkylation of Alkylbenzenes: A Significant Pathway in the Toluene, o-, m-, p-Xylene plus OH Reaction 2009
• Thermal Decomposition of Furan Generates Propargyl Radicals 2009
• HCO Quantum Yields in the Photolysis of HC(O)C(O)H (Glyoxal) between 290 and 420 nm 2009
• Fundamental and Overtone Vibrational Spectra of Gas-Phase Pyruvic Acid 2009
• SH-Stretching Vibrational Spectra of Ethanethiol and tert-Butylthiol 2009
• Experimental and theoretical studies of the reaction of the OH radical with alkyl sulfides: 3. Kinetics and mechanism of the OH initiated oxidation of dimethyl, dipropyl, and dibutyl sulfides: reactivity trends in the alkyl sulfides and development of a predictive expression for the reaction of OH with DMS. 2009
• Yields of beta-Hydroxynitrates and Dihydroxynitrates in Aerosol Formed from OH Radical-Initiated Reactions of Linear Alkenes in the Presence of NOx 2009
• Spectroscopy of Photoreactive Systems: Implications for Atmospheric Chemistry 2009
• Interpretation of the Electronic Spectra of Four Disilanes 2008
• Computational Study of the Reaction of CH2((XB1)-B-3) with CH3OH 2008
• Experimental and Theoretical Study of the OH Vibrational Spectra and Overtone Chemistry of Gas-Phase Vinylacetic Acid 2008
• Ion chemistry of 1H-1,2,3-triazole. 2. Photoelectron spectrum of the iminodiazomethyl anion and collision induced dissociation of the 1,2,3-triazolide ion 2008
• CO gas sensing by ultrathin tin oxide films grown by atomic layer deposition using transmission FTIR spectroscopy 2008
• Direct measurement of the angular dependence of the single-photon ionization of aligned N-2 and CO2 2008
• Overtone dissociation of peroxynitric acid (HO2NO2): Absorption cross sections and photolysis products 2008
• Vibrational spectroscopy of nitroalkane chains using electron autodetachment and Ar predissociation 2008
• Dynamics of vibrational overtone excited pyruvic acid in the gas phase: Line broadening through hydrogen-atom chattering 2008
• Angular distributions for vibrationally inelastic nonresonant scattering of electrons by molecules 2007
• Gauge-Origin-Independent Coupled Cluster Singles and Doubles Calculation of Magnetic Circular Dichroism of Azabenzenes and Phosphabenzene Using London Orbitals 2007
• Thermochemical studies of N-methylpyrazole and N-methylimidazole 2007
• Structure of the vinyldiazomethyl anion and energetic comparison to the cyclic isomers 2007
• Overtone spectroscopy of sulfonic acid derivatives 2007
• Vibrational overtone spectroscopy of three-membered rings 2007
• General method for reducing adaptive laser pulse-shaping experiments to a single control variable. 2007
• Comparison of DFT methods for molecular orbital eigenvalue calculations 2007
• Elucidation of control mechanisms discovered during adaptive manipulation of [Ru(dpb)3](PF6)2 emission in the solution phase. 2007
• Spectroscopic characterization of the isolated SF6- and C4F8- anions: Observation of very long harmonic progressions in symmetric deformation modes upon photodetachment 2007
• Experimental and theoretical studies of the reaction of the OH radical with alkyl sulfides: 1. Direct observations of the formation of the OH-DMS adduct-pressure dependence of the forward rate of addition and development of a predictive expression at low temperature. 2007
• Thermochemical studies of pyrazolide 2006
• Permeability of acetic acid through organic films at the air-aqueous interface 2006
• Vibrational overtone spectroscopy of phenol and its deuterated isotopomers 2006
• Uptake of small oxygenated organic molecules onto ammonium nitrate under upper tropospheric conditions 2006
• Experimental and theoretical investigation of vibrational overtones of glycolic acid and its hydrogen bonding interactions with water 2006
• General Method for the Dimension Reduction of Adaptive Control Experiments 2006
• Reaction of oleic acid particles with NO3 radicals: Products, mechanism, and implications for radical-initiated organic aerosol oxidation 2006
• A simple picture for the rotational enhancement of the rate for the F+HCl -> HF+Cl reaction: A dynamical study using a new ab initio potential energy surface 2006
• Photoelectron spectra and ion chemistry of imidazolide 2005
• One-electron reduction of an "extended viologen" p-phenylene-bis-4,4 '-(1-aryl-2,6-diphenylpyridinium) dication 2005
• Electric field fluctuations drive vibrational dephasing in water. 2005
• Products and mechanism of secondary organic aerosol formation from reactions of linear alkenes with NO3 radicals 2005
• Products and Mechanism of Secondary Organic Aerosol Formation from Reactions of Linear Alkenes with NO3Radicals 2005
• An infrared investigation of the (CO2)(n)(-) clusters: Core ion switching from both the ion and solvent perspectives 2005
• Laboratory studies of butane nucleation on organic haze particles: Application to Titan's clouds 2005
• Unimolecular dissociation of formyl radical, HCO -> H plus CO, studied over 1-100 bar pressure range 2004
• Photoelectron spectroscopy of AuO- and AuS- 2004
• Uptake of acetic acid on thin ammonium nitrate films as a function of temperature and relative humidity 2004
• Argon cluster-mediated trapping and vibrational spectroscopic characterization of an OH-center dot HCH2 center dot intermediate in the O center dot-+CH4 reaction 2004
• Thermochemistry and electronic structure of the pyrrolyl radical 2004
• Comparative OHD-RIKES and THz-TDS probes of ultrafast structural dynamics in molecular liquids 2004
• Vapor-phase vibrational spectrum of glycolic acid, CH2OHCOOH, in the region 2000-8500 cm(-1) 2004
• Calculating cumulene/poly-yne isomerization energies 2004
• Magnetic circular dichroism of nonaromatic cyclic pi-electron systems. 5. Biphenylene and its aza analogues 2004
• The electronic structure and vibrational spectrum of trans-HNOO 2004
• Heterogeneous reaction of gaseous nitric acid on gamma-phase iron(III) oxide 2004
• Reaction of OH with HO2NO2 (peroxynitric acid): Rate coefficients between 218 and 335 K and product yields at 298 K 2004
• Complexes of importance to the absorption of solar radiation 2003
• Experimental thermodynamics of cluster ions composed of H2SO4 and H2O. 1. Positive ions 2003
• Experimental thermodynamics of cluster ions composed of H2SO4 and H2O. 2. Measurements and a initio structures of negative ions 2003
• The only stable state of O-2(-) is the X (2)Pi(g) ground state and it (still!) has an adiabatic electron detachment energy of 0.45 eV 2003
• Kinetics of the removal of OH(v=1) and OD(v= 1) by HNO3 and DNO3 from 253 to 383 K 2003
• Infrared signatures of a water molecule attached to triatomic domains of molecular anions: Evolution of the H-bonding configuration with domain length 2003
• The transoid, ortho, and gauche conformers of decamethyl-n-tetrasilane, n-Si4Me10: Electronic transitions in the multistate complete active space second-order perturbation theory description 2003
• Charge hopping in molecular wires as a sequence of electron-transfer reactions 2003
• The disilane chromophore: Photoelectron and electronic spectra of hexaalkyldisilanes and 1,(n+2)-disila[n.n.n]propellanes 2003
• Formation of alkoxyhydroperoxy aldehydes and cyclic peroxyhemiacetals from reactions of cyclic alkenes with O-3 in the presence of alcohols 2003
• Vibrational and electronic spectroscopy of sulfuric acid vapor 2003
• Electron autodetachment from isolated nickel and copper phthalocyanine-tetrasulfonate tetraanions: Isomer specific rates 2003
• Conformational effects on the ultraviolet absorption spectrum of n-tetrasilane: Multistate complete active space second-order perturbation theory treatment 2002
• Heat of formation of the hydroperoxyl radical HOO via negative ion studies 2002
• Uptake of nitric acid on ice at tropospheric temperatures: Implications for cirrus clouds 2002
• Solvatochromism and solvation dynamics of structurally related cyanine dyes 2002
• A possible reinterpretation of the photoelectron spectra of [CCl2](-center dot), [CBr2](-center dot), and [CI2](-center dot): A role for quartet isodihalocarbene or dihalocarbene radical anions? 2002
• Kinetics of O-2(1 Sigma(+)(g)) reaction with H-2 and an upper limit for OH production 2002
• Polar solvation dynamics in the femtosecond evolution of two-dimensional Fourier transform spectra 2002
• General trends for bulk diffusion in ice and surface diffusion on ice 2002
• Effect of sodium on HCl hydrate diffusion in ice: Evidence for anion-cation trapping 2002
• Evidence for low-volatility diacyl peroxides as a nucleating agent and major component of aerosol formed from reactions of O-3 with cyclohexene and homologous compounds 2002
• The interaction of methanol, acetone, and acetaldehyde with ice and nitric acid-doped ice: Implications for cirrus clouds 2002
• A molecular theory for doubly resonant IR-UV-vis sum-frequency generation 2002
• Peralkylated tetrasilanes: Conformational dependence of the photoelectron spectrum 2002
• Measuring intramolecular charge transfer via coherent generation of THz radiation 2002
• The hydration of formic acid 2002
• Cluster ion thermal decomposition (I): Experimental kinetics study and ab initio calculations for HSO4-(H2SO4)(x)(HNO3)(y) 2001
• Naphthyl radical: Negative ion photoelectron spectroscopy, Franck-Condon simulation, and thermochemistry 2001
• Geometrical simplification of complex kinetic systems 2001
• UV, MCD, and LD spectra of a conformationally constrained ortho-tetrasilane: Support for the avoided crossing model of conformational effects on excited states 2001
• Primary and secondary glyoxal formation from aromatics: Experimental evidence for the bicycloalkyl-radical pathway from benzene, toluene, and p-xylene 2001
• Kinetics of the gas-phase reactions of alcohols, aldehydes, carboxylic acids, and water with the C13 stabilized Criegee intermediate formed from ozonolysis of 1-tetradecene 2001
• Diffusion kinetics of HC1 hydrates in ice measured using infrared laser resonant desorption depth-profiling 2001
• Quasi-classical trajectory studies of the insertion reactions S(D-1)+H-2, HD, and D-2 2001
• Reaction of hydroxyl radical with nitric acid: Insights into its mechanism 2001
• Sources, sinks, and the distribution of OH in the lower stratosphere 2001
• The NOx-HNO3 system in the lower stratosphere: Insights from in situ measurements and implications of the J(HNO3)-[OH] relationship 2001
• Use of quantum methods with transition state theory: Application to H-atom metathesis reactions 2001
• HBr uptake on ice: Uptake coefficient, H2O/HBr hydrate formation, and H2O desorption kinetics 2001
• Sequential two-photon dissociation of atmospheric water 2001
• Charge flow and solvent dynamics in the photodissociation of solvated molecular ions 2000
• Electronic excitation in a saturated chain: An MS-CASPT2 treatment of the anti conformer of n-tetrasilane 2000
• MCD of nonaromatic cyclic pi-electron systems. 3. The perimeter model for low-symmetry "unaromatic" and "ambiaromatic" molecules derived from 4N-electron [n]annulenes 2000
• MCD of nonaromatic cyclic pi-electron systems. 4. Explicit relations between molecular structure and spectra 2000
• Simultaneous kinetics and ring-down: Rate coefficients from single cavity loss temporal profiles 2000
• Physicochemical properties of hydrated complexes in the Earth's atmosphere 2000
• Absolute intensities for third and fourth overtone absorptions in HNO3 and H2O2 measured by cavity ring down spectroscopy 2000
• Reaction of NH (X (3)Sigma(-)) with NO in xenon matrix: Infrared detection of the HNNO intermediate 2000
• Transoid, ortho, and gauche conformers of n-Si4Cl10: Raman and mid-IR matrix-isolation spectra 2000
• Conformers of n-Si6Me14: Ab initio, molecular mechanics, and additive increment methods 2000
• A theoretical study of the structure and thermochemistry of 1,3-butadiene on the Ge/Si(100)-2 x 1 surface 2000
• Ultraviolet photoelectron spectroscopy of o-, m-, and p-halobenzyl anions 1999
• Organic peroxyl radical photolysis in the near-infrared: Effects on tropospheric chemistry 1999
• Photodissociation dynamics of gas-phase BrICl- and IBr2- anions 1999
• Two-dimensional electronic correlation and relaxation spectra: Theory and model calculations 1999
• Investigation of the heterogeneous reactivity of HCl, HBr, and HI on ice surfaces 1999
• Direct absorption spectroscopy of water clusters 1999
• Singlet-triplet splittings in CX2 (X = F, Cl, Br, I) dihalocarbenes via negative ion photoelectron spectroscopy 1999
• How rapidly does the SH radical react with N2O? 1999
• An experimental study of the low-lying electronic states of WO2 1999
• Reconsideration of the rate constant for the reaction of hydroxyl radicals with nitric acid 1999
• Conformers of n-Si5Me12: A comparison of ab initio and molecular mechanics methods 1999
• Atmospheric oxidation of toluene in a large-volume outdoor photoreactor: In situ determination of ring-retaining product yields 1998
• Effect of HNO3 and HCl on D2O desorption kinetics from crystalline D2O ice 1998
• Photodissociation of I-2(-)(OCS)(n) cluster ions: Structural implications 1998
• Properties of diazocarbene [CNN] and the diazomethyl radical [HCNN] via ion chemistry and spectroscopy 1998
• Condensed-phase products in heterogeneous reactions: N2O5, ClONO2, and HNO3 reacting on ice films at 185 K 1998
• Spin-orbit coupling in biradicals. 2. Ab initio methodology and application to 1,1-biradicals: Carbene and silylene 1998
• Absolute intensities of nitric acid overtones 1998
• Theoretical Studies of Steric Effects on Intraligand Electron Delocalization: Implications for the Temporal Evolution of MLCT Excited States 1998
• Electronic structure of (CS(2))(2)(-) 1998
• Rotational relaxation in supercritical carbon dioxide revisited: A study of solute-induced local density augmentation 1998
• Surface sensitive studies of the reactive uptake of chlorine nitrate on ice 1997
• A kinetic and product study of the hydrolysis of ClONO2 on type Ia polar stratospheric cloud materials at 185 K 1997
• Direct measurement of the rate coefficient for the CH2=C(CH3)C(O)O-2+NO reaction using chemical ionization mass spectrometry 1997
• Photodissociation, recombination, and electron transfer in cluster ions: A nonadiabatic molecular dynamics study of I-2(-)(CO2)(n) 1997
• Femtosecond dynamics of linear Ag-3 1997
• Interaction of HCl with ice: Investigation of the predicted trihydrate, hexahydrate, and monolayer regimes 1997
• Conformational effects in photoelectron spectra of tetrasilanes 1997
• An experimental and computational study of the electron affinity of boron oxide 1997
• Photoelectron spectroscopy of the NCN- and HNCN- ions 1997
• Cubic-grid gaussian basis sets for electron-scattering calculations .6. Applications to H-2, H2O, and CH4 1997
• Crystallization kinetics of HNO3/H2O films representative of polar stratospheric clouds 1997