Jeffrey Greeley

davidson school of chemical engineering purdue university

H指数:69

被引数:2.1万

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Reconstructions on Disordered Surface Alloys: Strain-Minimizing First Principles Treatments for Heterogeneous Catalysis

无序表面合金的重建：用于异质催化应变最小化的第一性原理处理

The Journal of Physical Chemistry C

IF3.2

2026-06-300

PRE

Mercaptan-Mediated Ethylene Formation in Sulfur Oxidative Ethane Dehydrogenation on Iron Sulfide (FeS2) Catalysts

二硫化铁(FeS2)催化剂上硫醇介导的乙烷氧化脱硫生成乙烯

ACS Catalysis

IF13.1

2026-03-200

First-Principles and Machine Learning-Based Analysis of Sulfur Poisoning of High-Entropy Alloy Catalysts

Chemistry of Materials

IF7

2026-01-200

PRE

2D MXene Anodes with Engineered Electrolyte for High-Performing Lithium-Ion Batteries in Extreme Cold

用于极端低温高性能锂离子电池的二维MXene阳极与工程化电解质

Small

IF12.1

2025-10-280

PRE

Low-Temperature Direct Oxidation of Propane to Propylene Oxide Using Supported Subnanometer Cu Clusters

以负载型次纳米Cu团簇低温直接氧化丙烷制环氧丙烷

ACS CATALYSIS

IF13.1

2025-03-240

Tuning surface chemistry of inverse catalysts ZnOxHy/Pt(111) without site blocking

调节ZnOxHy/Pt(111)逆催化剂的表面化学性质而不阻塞活性位点

CHEM CATALYSIS

IF11.6

2025-02-010

PRE

Tribute to Jens K. Norskov

向Jens K. Norskov致敬

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2025-01-160

PRE

A Combined First-Principles and Data-Driven Computational Framework to Analyze the Surface Structure, Composition, and Stability of Binary Alloy Catalysts

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2024-09-260

PRE

Active learning of ternary alloy structures and energies

NPJ COMPUTATIONAL MATERIALS

IF11.9

2024-05-301

Site-specific reactivity of stepped Pt surfaces driven by stress release

应力释放驱动的阶梯状Pt表面的特定位置反应性

Nature

IF48.5

2024-02-280

PRE

Disproportionation chemistry in K2PtCl4 visualized at atomic resolution using scanning transmission electron microscopy

SCIENCE ADVANCES

IF12.5

2024-02-091

OAAI

Solvation Enthalpy Determination for Aqueous-Phase Reaction Adsorbates Using Ab Initio Molecular Dynamics-Based Structure Sampling

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2024-01-184

PRE

Valence-to-core X-ray emission spectroscopy to resolve the size-dependent valence electronic structure of Pt nanoparticles

CATALYSIS SCIENCE & TECHNOLOGY

IF4.2

2024-01-011

Origin of Stability and Activity Enhancements in Pt-based Oxygen Reduction Reaction Catalysts via Defect-Mediated Dopant Adsorption

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

IF16.9

2023-12-2211

A first principles analysis of potential- dependent structural evolution of active sites in Fe- N- C catalysts

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

IF9.1

2023-11-2911

OAAI

Influence of the Mechanism of Discharge Product Formation on the Electrochemical Performance and Cyclability of Aprotic Na-O2 Batteries

ACS ENERGY LETTERS

IF18.2

2023-10-091

PRE

Origin of Rate and Selectivity Trends and Exceptional Yield in Sulfur-Oxidative Propane Dehydrogenation Over Supported Vanadium Catalysts

负载型钒催化剂上硫氧化丙烷脱氢的速率和选择性趋势以及异常产率的起源

ACS CATALYSIS

IF13.1

2023-10-033

PRE

Elucidation of Parasitic Reaction Mechanisms at Interfaces in Na-O2 Batteries

CHEMISTRY OF MATERIALS

IF7

2023-07-263

PRE

Universal properties of metal-supported oxide films from linear scaling relationships: elucidation of mechanistic origins of strong metal-support interactions

CHEMICAL SCIENCE

IF7.4

2023-01-016

OAAI

Density functional theory study of active sites and reaction mechanism of ORR on Pt surfaces under anhydrous conditions

无水条件下Pt表面ORR活性位和反应机理的密度泛函理论研究

Chinese Journal of Catalysis

IF17.7

2022-12-019

OAAI

Jeffrey Greeley

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