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Physical Chemistry

Working Paper

Enthalpies of formation of the benzyloxyl, benzylperoxyl, hydroxyphenyl radicals and related species on the potential energy surface for the reaction of toluene with the hydroxyl radical

Oscar Ventura, Martina Kieninger, Zoi Salta, Agnie M. Kosmas, Vincenzo Barone

Version 2 posted 05 March 2019

1,368

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Earth, Space, and Environmental Chemistry

Working Paper

Atmospheric Oxidation of Piperazine Initiated by OH: A Theoretical Kinetics Investigation

Zhonghua Ren, Gabriel da Silva

Version 1 posted 31 July 2019

655

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Earth, Space, and Environmental Chemistry

Working Paper

Structural Causes of Singlet/triplet Preferences of Norrish Type II Reactions in Carbonyls

Keiran Rowell, Scott Kable, Meredith J. T. Jordan

Version 1 posted 11 September 2020

1,070

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Earth, Space, and Environmental Chemistry

Working Paper

Isomerization of the Isoprene Hydroxy Nitrates and Formation of Orthonitrite Compounds

Gabriel da Silva

Version 1 posted 26 June 2019

504

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Physical Chemistry

Working Paper

Spin-Forbidden Channels in Reactions of Unsaturated Hydrocarbons with O(3P)

Pavel Pokhilko, Robin Shannon, David Glowacki, Hai Wang, Anna I. Krylov

Version 1 posted 22 October 2018

553

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Earth, Space, and Environmental Chemistry

Working Paper

The Under-Explored Possibilities of Ground State Carbonyl Photochemistry

Keiran Rowell, Scott Kable, Meredith J. T. Jordan

Version 1 posted 15 September 2020

394

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Theoretical and Computational Chemistry

Working Paper

A Reinvestigation of the Deceptively Simple Reaction of Toluene with ●OH, and the Fate of the Benzyl Radical. I. a Combined Thermodynamic and Kinetic Study on the Competition Between ●OH Addition and Hydrogen Abstraction Reactions.

Zoi Salta, Agnie M. Kosmas, Marc E. Segovia, Martina Kieninger, Oscar Ventura, Vincenzo Barone

Version 1 posted 17 June 2019

630

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Physical Chemistry

Review

Unraveling the Meaning of Effective Uptake Coefficients in Multiphase and Aerosol Chemistry

Ryan Reynolds, Kevin Wilson

Version 1 posted 18 October 2024

74

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Theoretical and Computational Chemistry

Working Paper

Improved Configurational Sampling Protocol for Large Atmospheric Molecular Clusters

Haide Wu, Morten Engsvang, Yosef Knattrup, Jakub Kubečka, Jonas Elm

Version 1 posted 04 September 2023

117

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1

Citations

Earth, Space, and Environmental Chemistry

Working Paper

Competitive Adsorption and Reaction at the Air-Water Interface studied by Iodide Ozonolysis in Microdroplets

Alexander Prophet, Kevin Wilson

Version 1 posted 05 July 2022

479

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1

Citations

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17 results in atmospheric chemistry in Keywords: atmospheric chemistry

Enthalpies of formation of the benzyloxyl, benzylperoxyl, hydroxyphenyl radicals and related species on the potential energy surface for the reaction of toluene with the hydroxyl radical

Atmospheric Oxidation of Piperazine Initiated by OH: A Theoretical Kinetics Investigation

Structural Causes of Singlet/triplet Preferences of Norrish Type II Reactions in Carbonyls

Isomerization of the Isoprene Hydroxy Nitrates and Formation of Orthonitrite Compounds

Spin-Forbidden Channels in Reactions of Unsaturated Hydrocarbons with O(3P)

The Under-Explored Possibilities of Ground State Carbonyl Photochemistry

A Reinvestigation of the Deceptively Simple Reaction of Toluene with ●OH, and the Fate of the Benzyl Radical. I. a Combined Thermodynamic and Kinetic Study on the Competition Between ●OH Addition and Hydrogen Abstraction Reactions.

Unraveling the Meaning of Effective Uptake Coefficients in Multiphase and Aerosol Chemistry

Improved Configurational Sampling Protocol for Large Atmospheric Molecular Clusters

Competitive Adsorption and Reaction at the Air-Water Interface studied by Iodide Ozonolysis in Microdroplets

17 results in Keywords: atmospheric chemistry