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Origins of hydrogen peroxide selectivity during oxygen reduction on organic mixed ionic-electronic conducting polymers

Ana De La Fuente Durán, Allen Yu-Lun Liang, Ilaria Denti, Hang Yu, Drew Pearce, Adam Marks, Emily Penn, Karrie Weaver, Lily Turaski, Iuliana P. Maria, Sophie Griggs, Xingxing Chen, Alberto Salleo, William C. Chueh, Jenny Nelson, Alexander Giovannitti, J. Tyler Mefford

Version 2 posted 29 May 2023

880

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Catalysis

Working Paper

Linking Experimental and Ab-initio Thermochemistry of Adsorbates with a Generalized Thermochemical Hierarchy

Bjarne Kreitz, Kento Abeywardane, C. Franklin Goldsmith

Version 1 posted 06 January 2023

201

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1

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Physical Chemistry

Working Paper

Microkinetic Modeling of the Methanol Electro-oxidation Reaction on Platinum

Enrique Paredes-Salazar, Alfredo Calderón-Cárdenas, Hamilton Varela

Version 1 posted 22 February 2023

171

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Catalysis

Working Paper

Automatic Mechanism Generation Involving Kinetics of Surface Reactions with Bidentate Adsorbates

Bjarne Kreitz, Katrin Blöndal, Kirk Badger, Richard H. West, C. Franklin Goldsmith

Version 1 posted 14 September 2023

126

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Catalysis

Working Paper

Deposited PtGe clusters as active and durable catalysts for CO oxidation

Andoni Ugartemendia Biurrun, Jose M. Mercero, Abel de Cózar, Marko M. Melander, Jaakko Akola, Elisa Jimenez-Izal

Version 1 posted 12 September 2023

155

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Theoretical and Computational Chemistry

Working Paper

Plasma radicals as kinetics-controlling species during plasma-assisted catalytic NH3 formation: support from microkinetic modeling

Tsung-Wei Liu, Fnu Gorky, Maria Carreon, Diego Gomez-Gualdron

Version 1 posted 21 June 2023

259

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Catalysis

Working Paper

Mechanistic Insights into the Conversion of Dimethyl Ether over ZSM-5 Catalysts: A Combined Temperature Programmed Surface Reaction and Microkinetic Modelling Study

Toyin Omojola, Andre van Veen

Version 1 posted 09 March 2021

380

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Catalysis

Working Paper

Observation and Rationalization of Nitrogen Oxidation Enabled Only by Coupled Plasma and Catalyst

Hanyu Ma, Rakesh Sharma, Stefan Welzel, M.C.M. van de Sanden, Michail Tsampas, William F. Schneider

Version 1 posted 06 May 2021

330

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1

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Physical Chemistry

Working Paper

Unraveling the Activity of Iron Carbide Clusters Embedded in Silica for Thermocatalytic Conversion of Methane

Gopal K. Dixit, Manish Kumar, Ankita Katiyar, Antonius P. J. Jansen, Alexander van Bavel, Ravi Agrawal, Prathamesh M. Shenai, Varadharajan Srinivasan

Version 1 posted 09 December 2020

360

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Catalysis

Working Paper

Understanding activity trends in furfural hydrogenation on transition metal surfaces

Sihang Liu, Nitish Govindarajan, Karen Chan

Version 1 posted 02 August 2022

347

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15 results in microkinetic modeling in Keywords: microkinetic modeling

Origins of hydrogen peroxide selectivity during oxygen reduction on organic mixed ionic-electronic conducting polymers

Linking Experimental and Ab-initio Thermochemistry of Adsorbates with a Generalized Thermochemical Hierarchy

Microkinetic Modeling of the Methanol Electro-oxidation Reaction on Platinum

Automatic Mechanism Generation Involving Kinetics of Surface Reactions with Bidentate Adsorbates

Deposited PtGe clusters as active and durable catalysts for CO oxidation

Plasma radicals as kinetics-controlling species during plasma-assisted catalytic NH3 formation: support from microkinetic modeling

Mechanistic Insights into the Conversion of Dimethyl Ether over ZSM-5 Catalysts: A Combined Temperature Programmed Surface Reaction and Microkinetic Modelling Study

Observation and Rationalization of Nitrogen Oxidation Enabled Only by Coupled Plasma and Catalyst

Unraveling the Activity of Iron Carbide Clusters Embedded in Silica for Thermocatalytic Conversion of Methane

Understanding activity trends in furfural hydrogenation on transition metal surfaces

15 results in Keywords: microkinetic modeling