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Bunting️

Publications

13 publications

TOC graphic: BaZrO3 synthesis and proton transport through its microstructure

Direct Ab Initio Simulation of the Synthesis of BaZrO3 and the Microstructure Impacts on Proton TransportNew

RJ Bunting, R Paul, N Rampal, BC Wood, T Ogitsu, JB Varley, and TA Pham

ACS Nano · 2026

Figure 1: experimental setup and X-ray diffraction measurements for shock-compressed titanium

High-pressure melt dynamics in shock-compressed titaniumEditor's Pick

S Singh, R Paul, N Rampal, RJ Bunting, S Hamel, N Pulver, CP McGuire, SM Clarke, AL Coleman, C Vennari, TM Hutchinson, KA Pereira, B Nagler, D Khaghani, HJ Lee, NA Czapla, T Volz, IK OCampo, J McNaney, TE Lockard, JH Eggert, A Lazicki, CE Wehrenberg, A Krygier, and RF Smith

Physical Review B · 2026

Publication graphic for Nuclear Quantum Effects of Metal Surface-Mediated C–H Activation

Nuclear Quantum Effects of Metal Surface-Mediated C–H Activation

RJ Bunting, S Shepherd, N Rampal, S Akhade, DM Wilkins*, and TA Pham*

Physical Chemistry Chemical Physics · 2025

Graphical abstract: the Pd–PdO interphase gives high activity and selectivity for hydrogen peroxide synthesis

Identifying Pd9OX as the optimum catalyst for the direct synthesis of H2O2 through microkinetic modeling with coverage effects

J Zhao, Z Yao, RJ Bunting, Y Wang, and J Wang*

Chemical Engineering Science · 2024

Figure 1: coverage-dependent and coverage-independent mechanisms and energy profiles for formic acid decomposition on Pd

Unravelling the reaction mechanism for H2 production via formic acid decomposition over Pd: Coverage-Dependent microkinetic modeling

Z Yao, X Liu, RJ Bunting, and J Wang*

Chemical Engineering Science · 2024

Publication graphic for Reactivity of Single-Atom Alloy Nanoparticles: Modeling the Dehydrogenation of Propane

Reactivity of Single-Atom Alloy Nanoparticles: Modeling the Dehydrogenation of PropaneHighlight

RJ Bunting*, F Wodaczek, T Torabi, B Cheng

Journal of the American Chemical Society · 2023

Publication graphic for Microkinetic Modeling with Size-Dependent and Adsorbate–Adsorbate Interactions for the Direct Synthesis of H2O2 over Pd Nanoparticles

Microkinetic Modeling with Size-Dependent and Adsorbate–Adsorbate Interactions for the Direct Synthesis of H2O2 over Pd Nanoparticles

J Zhao, Z Yao*, RJ Bunting, P Hu*, and J Wang*

ACS Catalysis · 2023

Publication graphic for The Effects of Polymorphism and Lithium Intercalation on the Hydrogen Evolution Reaction for the Basal Planes of MoS2

The Effects of Polymorphism and Lithium Intercalation on the Hydrogen Evolution Reaction for the Basal Planes of MoS2

RJ Bunting, NM Caffrey*

Journal of Chemical Physics · 2023

Publication graphic for Understanding and Tackling the Activity and Selectivity Issues for Methane to Methanol Using Single Atom Alloys

Understanding and Tackling the Activity and Selectivity Issues for Methane to Methanol Using Single Atom Alloys

RJ Bunting, PS Rice, Z Yao, J Thompson, P Hu*

Chemical Communications · 2022

Publication graphic for Quantitative Insights into the Reaction Mechanism for the Direct Synthesis of H2O2 over Transition Metals: Coverage-Dependent Microkinetic Modeling

Quantitative Insights into the Reaction Mechanism for the Direct Synthesis of H2O2 over Transition Metals: Coverage-Dependent Microkinetic Modeling

Z Yao, J Zhao, RJ Bunting, C Zhao, P Hu, J Wang*

ACS Catalysis · 2021

Publication graphic for Investigating the Innate Selectivity Issues of Methane to Methanol: Consideration of an Aqueous Environment

Investigating the Innate Selectivity Issues of Methane to Methanol: Consideration of an Aqueous Environment

RJ Bunting, PS Rice, J Thompson, P Hu*

Chemical Science · 2021

Publication graphic for The Mechanism and Ligand Effects of Single Atom Rhodium Supported on ZSM-5 for the Selective Oxidation of Methane to Methanol

The Mechanism and Ligand Effects of Single Atom Rhodium Supported on ZSM-5 for the Selective Oxidation of Methane to Methanol

RJ Bunting, J Thompson, P Hu*

Physical Chemistry Chemical Physics · 2020

Publication graphic for Amorphous Surface PdOx and Its Activity toward Methane Combustion

Amorphous Surface PdOx and Its Activity toward Methane Combustion

RJ Bunting, X Cheng, J Thompson, P Hu*

ACS Catalysis · 2019