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Jiayu Peng

Massachusetts Institute of Technology · US
Area of research
Renewable Energy, Sustainability and the Environment · Electrical and Electronic Engineering
Research interest
Research interests include Catalysis, Chemistry, Oxygen evolution, Materials science, Computer science, and Hydroxide.
h-index
citations
2,853
works
18
NIH funding
primary concept
email

Recent publications

Confined Water for Catalysis: Thermodynamic Properties and Reaction Kinetics
Chemical Reviews 2025cited by 57position: middledoi
Interpolation and differentiation of alchemical degrees of freedom in machine learning interatomic potentials
Nature Communications 2025cited by 13position: middledoi
Accelerating and Enhancing Thermodynamic Simulations of Electrochemical Interfaces
ACS Central Science 2025cited by 8position: middledoi
Towards atom-level understanding of metal oxide catalysts for the oxygen evolution reaction with machine learning
npj Computational Materials 2024cited by 29position: middledoi
Representations of Materials for Machine Learning
Annual Review of Materials Research 2023cited by 105position: middledoi
Linker-Dependent Stability of Metal-Hydroxide Organic Frameworks for Oxygen Evolution
Chemistry of Materials 2023cited by 41position: middledoi
Tunable metal hydroxide–organic frameworks for catalysing oxygen evolution
Nature Materials 2022cited by 298position: middledoi
Human- and machine-centred designs of molecules and materials for sustainability and decarbonization
Nature Reviews Materials 2022cited by 129position: firstdoi
Tuning the Catalytic Activity of Fe-Phthalocyanine-Based Catalysts for the Oxygen Reduction Reaction by Ligand Functionalization
ACS Catalysis 2022cited by 87position: middledoi
Stability Design Principles of Manganese-Based Oxides in Acid
Chemistry of Materials 2022cited by 67position: firstdoi
New challenges in oxygen reduction catalysis: a consortium retrospective to inform future research
Energy & Environmental Science 2022cited by 46position: middledoi
Design principles for transition metal nitride stability and ammonia generation in acid
Joule 2022cited by 41position: firstdoi
Switchable wetting of oxygen-evolving oxide catalysts
Nature Catalysis 2021cited by 166position: middledoi
pH- and Cation-Dependent Water Oxidation on Rutile RuO<sub>2</sub>(110)
The Journal of Physical Chemistry C 2021cited by 144position: middledoi
Oxygen Evolution Reaction in Ba<sub>0.5</sub>Sr<sub>0.5</sub>Co<sub>0.8</sub>Fe<sub>0.2</sub>O<sub>3-δ</sub> Aided by Intrinsic Co/Fe Spinel-Like Surface
Journal of the American Chemical Society 2020cited by 134position: middledoi
Conversion of Methane into Liquid Fuels—Bridging Thermal Catalysis with Electrocatalysis
Advanced Energy Materials 2020cited by 110position: middledoi
Bismuth Substituted Strontium Cobalt Perovskites for Catalyzing Oxygen Evolution
The Journal of Physical Chemistry C 2020cited by 63position: middledoi
Recommended Practices and Benchmark Activity for Hydrogen and Oxygen Electrocatalysis in Water Splitting and Fuel Cells
Advanced Materials 2019cited by 1,315position: middledoi

Grants

No grants ingested yet.

Frequent collaborators

Yang Shao‐Horn · National University of Singapore15 papers (2019–2025)Yuriy Román‐Leshkov · Massachusetts Institute of Technology8 papers (2020–2025)Livia Giordano · Massachusetts Institute of Technology6 papers (2020–2022)Rafael Gómez‐Bombarelli · Massachusetts Institute of Technology5 papers (2022–2025)Yirui Zhang · Massachusetts Institute of Technology4 papers (2021–2025)Jaclyn R. Lunger · Massachusetts Institute of Technology4 papers (2021–2024)Reshma R. Rao · Massachusetts Institute of Technology4 papers (2019–2025)Shuai Yuan · Shandong University4 papers (2020–2025)Botao Huang · Massachusetts Institute of Technology3 papers (2019–2025)Karthik Akkiraju · Massachusetts Institute of Technology3 papers (2020–2022)Daniel J. Zheng · Children's Hospital of Philadelphia3 papers (2020–2022) · 2 papers (2020–2021) · 2 papers (2020–2021)Kaylee McCormack · Massachusetts Institute of Technology2 papers (2023–2025)Jeffrey C. Grossman · Massachusetts Institute of Technology2 papers (2022–2025)Sujay Bagi · Massachusetts Institute of Technology2 papers (2020–2022)Daniel J. Zheng · Massachusetts Institute of Technology2 papers (2023–2025)Tzu‐Hsien Shen · National Taiwan University2 papers (2020–2021)Hoje Chun · Massachusetts Institute of Technology2 papers (2024–2025)Steven B. Torrisi · University of Rochester1 papers (2022–2022)