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Andreas Heyden

Professor

University of South Carolina

United States

Research Interests

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Professors in United States Professors in Catalysis Catalysis professors in United States

Articles (30)

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Collaborators (11)

Byeongdu Lee

Physicist

Argonne National Laboratory

UNITED STATES

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Jörg Behler

Full Professor

Ruhr-Universität Bochum

GERMANY

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wenqiang yang

Research Assistant Professor

University of South Carolina

UNITED STATES

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Yomaira Pagán-Torres

Professor

University of Puerto Rico-Mayaguez

UNITED STATES

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JAMES MEDLIN

University of Colorado Boulder

UNITED STATES

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Massimiliano Delferro

Scientist

University of Chicago

UNITED STATES

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Jeremy Kropf

Physicist

Argonne National Laboratory

UNITED STATES

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Aaron Sadow

Professor

Iowa State University

UNITED STATES

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Fanglin Chen

UNITED STATES

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Jianguo Wen

Materials Scientist

Argonne National Laboratory

UNITED STATES

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Long Qi

Iowa State University

UNITED STATES

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Andreas Heyden

Research Interests

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Articles (30)

A Mesopore-Confined and Graphene Oxide-Localized Ruthenium Catalyst Increases Rates of Mid-Chain Polyolefin Hydrogenolysis

A semi-flow reactor design diverts catalytic hydrogenolysis of polyolefins to metastable kinetic products

First-Principles Modeling in Heterogenous Catalysis: Where Are We?

Removal of Emerging Contaminants from Wastewater via Adsorption in H-MFI Zeolite: A Hybrid QM/MM Study

Unraveling Solvent Effects on n-Butane Cracking and Deprotonation in H-MFI Zeolites: A Hybrid QM/MM Approach

Atomistic Insights into Aqueous Phase Carbonyl Hydrogenation over Ru Catalysts from a Hybrid Quantum Mechanical/Molecular Mechanical/Machine Learning Potential

Mechanistic Insights into Light Alkane Dehydrogenation over Coordinatively Unsaturated Zr Sites on Zirconia

Hydrogen Adsorption over Transition Metals in Water

Data-Driven Discovery of Bimetallic Nanoparticles Catalysts for the Hydrogenolysis of Polyethylene

Understanding the Effect of Platinum Particle Size on Ethane Dehydrogenation and Hydrogenolysis: Particle-Based Microkinetic Modeling at Finite Conversion

Investigating the Kinetics of Methyl Acetate Hydrogenolysis over Copper: A Combined Experimental and Computational Study

Surface structure effects on the methylcyclohexane dehydrogenation over Ni catalysts predicted by density functional theory

Liquid Phase Modeling in Porous Media: Adsorption of Methanol and Ethanol in H-MFI in Condensed Water

Reactor evaluation and active site identification of molybdenum carbide powder catalyst for the hydrodeoxygenation of glycerol

Population Balance Equations for Reactive Separation in Polymer Upcycling

Machine Learning Accelerated First-Principles Study of the Hydrodeoxygenation of Propanoic Acid

Invariant Molecular Representations for Heterogeneous Catalysis

Hybrid Quantum Mechanical, Molecular Mechanical, and Machine Learning Potential for Computing Aqueous-Phase Adsorption Free Energies on Metal Surfaces

Polyolefin melt-phase effects on alkane hydrogenolysis over Pt catalysts

First principles material screening and trend discovery for the development of perovskite electrolytes for proton-conducting solid oxide fuel cells

A redox-reversible A/B-site co-doped BaFeO3 electrode for direct hydrocarbon solid oxide fuel cells

A redox-reversible A/B-site co-doped BaFeO<sub>3</sub> electrode for direct hydrocarbon solid oxide fuel cells

Unlocking the Potential of A-Site Ca-Doped LaCo0.2Fe0.8O3−δ: A Redox-Stable Cathode Material Enabling High Current Density in Direct CO2 Electrolysis

Benchmarking the Accuracy of Density Functional Theory against the Random Phase Approximation for the Ethane Dehydrogenation Network on Pt(111)

Kinetics Study of the Hydrodeoxygenation of Xylitol over a ReO<sub>x</sub>-Pd/CeO<sub>2</sub> Catalyst

Dependency of solvation effects on metal identity in surface reactions

Understanding the effect of Mo2C support on the activity of Cu for the hydrodeoxygenation of glycerol

Preferential Oxidation of CO in Hydrogen at Nonmetal Active Sites with High Activity and Selectivity

A Multiple Filter Based Neural Network Approach to the Extrapolation of Adsorption Energies on Metal Surfaces for Catalysis Applications

Unraveling the mechanism of the hydrodeoxygenation of propionic acid over a Pt (1 1 1) surface in vapor and liquid phases

Collaborators (11)

Byeongdu Lee

Jörg Behler

wenqiang yang

Yomaira Pagán-Torres

JAMES MEDLIN

Massimiliano Delferro

Jeremy Kropf

Aaron Sadow

Fanglin Chen

Jianguo Wen

Long Qi

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