张亮老师课题组

Composition-Dependent Oxygen Reduction Reaction Activity of Pt-Surfaced PtNi Dodecahedral Nanoframes

2020

期刊 ACS Applied Energy Materials

作者 Yongchen Wang · Shutang Chen · Xudong Wang · Adam Rosen · William Beatrez · Lukasz Sztaberek · Haiyan Tan · Liang Zhang · Christopher Koenigsmann · Jing Zhao

Kinetic interactions between H2 and CO in catalytic oxidation over PdO

2020

期刊 Combustion and Flame

作者 Ran Sui · Wenkai Liang · Liang Zhang · John Mantzaras · Chung K Law

Anisotropic iron-doping patterns in two-dimensional cobalt oxide nanoislands on Au(111)

2019

期刊 Nano Research

作者 Anthony Curto · Zhaozong Sun · Jonathan Rodríguez-Fernández · Liang Zhang · Ayush Parikh · Ting Tan · Jeppe V. Lauritsen · Aleksandra Vojvodic

Enhancing Oxygen Exchange Activity by Tailoring Perovskite Surfaces

2019

期刊 The Journal of Physical Chemistry Letters

作者 Yuan Cheng · Abhinav S. Raman · Julian Paige · Liang Zhang · Danyi Sun · Mavis U. Chen · Aleksandra Vojvodic · Raymond J. Gorte · John M. Vohs

Molybdenum Trioxide (α-MoO3) Nanoribbons for Ultrasensitive Ammonia (NH3) Gas Detection: Integrated Experimental and Density Functional Theory Simulation Studies

2019

期刊 ACS Applied Materials & Interfaces

作者 Dongwook Kwak · Mengjing Wang · Kristie J. Koski · Liang Zhang · Henry Sokol · Radenka Maric · Yu Lei

MXene Materials for the Electrochemical Nitrogen Reduction—Functionalized or Not?

2019

期刊 ACS Catalysis

作者 Luke R. Johnson · Sudiksha Sridhar · Liang Zhang · Kurt D. Fredrickson · Abhinav S. Raman · Joonbaek Jang · Connor Leach · Ashwin Padmanabhan · Christopher C. Price · Nathan C. Frey · Abhishek Raizada · Vishwanathan Rajaraman · Sai Aparna Saiprasad · Xiaoxin Tang · Aleksandra Vojvodic

Structural and electronic properties of Fe dopants in cobalt oxide nanoislands on Au(111)

2019

期刊 The Journal of Chemical Physics

作者 Jonathan Rodríguez-Fernández · Zhaozong Sun · Liang Zhang · Ting Tan · Anthony Curto · Jakob Fester · Aleksandra Vojvodic · Jeppe V. Lauritsen

Ultrasensitive ammonia (NH3) gas sensor: DFT Simulation-Directed Selection of High-Performance Metal-Doped Molybdenum Tri-oxide (α-MoO3) Nanoribbons for NH3 Detection

2019

会议 2019 IEEE SENSORS

作者 Dongwook Kwak · Henry Sokol · Bryan P. Moser · Heejeong Ryu · Kristie J. Koski · Radenka Maric · Liang Zhang · Yu Lei

Activation of ultrathin SrTiO3 with subsurface SrRuO3 for the oxygen evolution reaction

2018

期刊 Energy & Environmental Science

作者 A. R. Akbashev · L. Zhang · J. T. Mefford · J. Park · B. Butz · H. Luftman · W. C. Chueh · A. Vojvodic

The effect of single pd atoms on the energetics of recombinative O2 desorption from Au(111)

2018

期刊 Surface Science

作者 Felicia R. Lucci · Liang Zhang · Theodore Thuening · Matthew B. Uhlman · Alex C. Schilling · Graeme Henkelman · E. Charles H. Sykes

Interface engineering for a rational design of poison-free bimetallic CO oxidation catalysts

2017

期刊 Nanoscale

作者 Kihyun Shin · Liang Zhang · Hyesung An · Hyunwoo Ha · Mi Yoo · Hyuck Mo Lee · Graeme Henkelman · Hyun You Kim

Computational screening of core@shell nanoparticles for the hydrogen evolution and oxygen reduction reactions

2016

期刊 The Journal of Chemical Physics

作者 Benjamin Corona · Marco Howard · Liang Zhang · Graeme Henkelman

Efficient CO Oxidation Using Dendrimer-Encapsulated Pt Nanoparticles Activated with <2% Cu Surface Atoms

2016

期刊 ACS Nano

作者 Long Luo · Liang Zhang · Zhiyao Duan · Aliya S. Lapp · Graeme Henkelman · Richard M. Crooks

Microwave-Assisted Synthesis of PdxAu100–xAlloy Nanoparticles: A Combined Experimental and Theoretical Assessment of Synthetic and Compositional Effects upon Catalytic Reactivity

2016

期刊 ACS Catalysis

作者 Pranaw Kunal · Hao Li · Beth L. Dewing · Liang Zhang · Karalee Jarvis · Graeme Henkelman · Simon M. Humphrey

A Theoretical and Experimental Approach for Correlating Nanoparticle Structure and Electrocatalytic Activity

2015

期刊 Accounts of Chemical Research

作者 Rachel M. Anderson · David F. Yancey · Liang Zhang · Samuel T. Chill · Graeme Henkelman · Richard M. Crooks

ChemInform Abstract: Correlating Structure and Function of Metal Nanoparticles for Catalysis

2015

期刊 ChemInform

作者 Liang Zhang · Rachel M. Anderson · Richard M. Crooks · Graeme Henkelman

Control of selectivity in allylic alcohol oxidation on gold surfaces: the role of oxygen adatoms and hydroxyl species

2015

期刊 Physical Chemistry Chemical Physics

作者 Gregory M. Mullen · Liang Zhang · Edward J. Evans · Ting Yan · Graeme Henkelman · C. Buddie Mullins

Correlating Structure and Function of Metal Nanoparticles for Catalysis

2015

期刊 Surface Science

作者 Liang Zhang · Rachel M. Anderson · Richard M. Crooks · Graeme Henkelman

Distributed replica dynamics

2015

期刊 The Journal of Chemical Physics

作者 Liang Zhang · Samuel T. Chill · Graeme Henkelman

Effect of annealing in oxygen on alloy structures of Pd–Au bimetallic model catalysts

2015

期刊 Physical Chemistry Chemical Physics

作者 Wen-Yueh Yu · Liang Zhang · Gregory M. Mullen · Edward J. Evans · Graeme Henkelman · C. Buddie Mullins

Oxygen Activation and Reaction on Pd–Au Bimetallic Surfaces

2015

期刊 The Journal of Physical Chemistry C

作者 Wen-Yueh Yu · Liang Zhang · Gregory M. Mullen · Graeme Henkelman · C. Buddie Mullins

Ridge-based bias potentials to accelerate molecular dynamics

2015

期刊 The Journal of Chemical Physics

作者 Penghao Xiao · Juliana Duncan · Liang Zhang · Graeme Henkelman

Unusual Activity Trend for CO Oxidation on PdxAu140–x@Pt Core@Shell Nanoparticle Electrocatalysts

2015

期刊 The Journal of Physical Chemistry Letters

作者 Long Luo · Liang Zhang · Graeme Henkelman · Richard M. Crooks

Computational Design of Alloy-Core@Shell Metal Nanoparticle Catalysts

2014

期刊 ACS Catalysis

作者 Liang Zhang · Graeme Henkelman

EON: software for long time simulations of atomic scale systems

2014

期刊 Modelling and Simulation in Materials Science and Engineering

作者 Samuel T. Chill · Matthew Welborn · Rye Terrell · Liang Zhang · Jean-Claude Berthet · Andreas Pedersen · Hannes Jónsson · Graeme Henkelman

Microwave Synthesis of Classically Immiscible Rhodium–Silver and Rhodium–Gold Alloy Nanoparticles: Highly Active Hydrogenation Catalysts

2014

期刊 ACS Nano

作者 Stephany García · Liang Zhang · Graham W. Piburn · Graeme Henkelman · Simon M. Humphrey

Oxygen and Hydroxyl Species Induce Multiple Reaction Pathways for the Partial Oxidation of Allyl Alcohol on Gold

2014

期刊 Journal of the American Chemical Society

作者 Gregory M. Mullen · Liang Zhang · Edward J. Evans · Ting Yan · Graeme Henkelman · C. Buddie Mullins

An Experimental and Theoretical Investigation of the Inversion of Pd@Pt Core@Shell Dendrimer-Encapsulated Nanoparticles

2013

期刊 ACS Nano

作者 Rachel M. Anderson · Liang Zhang · James A. Loussaert · Anatoly I. Frenkel · Graeme Henkelman · Richard M. Crooks

A theoretical and experimental examination of systematic ligand-induced disorder in Au dendrimer-encapsulated nanoparticles

2013

期刊 Chemical Science

作者 David F. Yancey · Samuel T. Chill · Liang Zhang · Anatoly I. Frenkel · Graeme Henkelman · Richard M. Crooks

CO Oxidation at the Au–Cu Interface of Bimetallic Nanoclusters Supported on CeO2(111)

2013

期刊 The Journal of Physical Chemistry Letters

作者 Liang Zhang · Hyun You Kim · Graeme Henkelman

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Composition-Dependent Oxygen Reduction Reaction Activity of Pt-Surfaced PtNi Dodecahedral Nanoframes

Kinetic interactions between H2 and CO in catalytic oxidation over PdO

Anisotropic iron-doping patterns in two-dimensional cobalt oxide nanoislands on Au(111)

Enhancing Oxygen Exchange Activity by Tailoring Perovskite Surfaces

Molybdenum Trioxide (α-MoO3) Nanoribbons for Ultrasensitive Ammonia (NH3) Gas Detection: Integrated Experimental and Density Functional Theory Simulation Studies

MXene Materials for the Electrochemical Nitrogen Reduction—Functionalized or Not?

Structural and electronic properties of Fe dopants in cobalt oxide nanoislands on Au(111)

Ultrasensitive ammonia (NH3) gas sensor: DFT Simulation-Directed Selection of High-Performance Metal-Doped Molybdenum Tri-oxide (α-MoO3) Nanoribbons for NH3 Detection

Activation of ultrathin SrTiO3 with subsurface SrRuO3 for the oxygen evolution reaction

The effect of single pd atoms on the energetics of recombinative O2 desorption from Au(111)

Interface engineering for a rational design of poison-free bimetallic CO oxidation catalysts

Computational screening of core@shell nanoparticles for the hydrogen evolution and oxygen reduction reactions

Efficient CO Oxidation Using Dendrimer-Encapsulated Pt Nanoparticles Activated with <2% Cu Surface Atoms

Microwave-Assisted Synthesis of PdxAu100–xAlloy Nanoparticles: A Combined Experimental and Theoretical Assessment of Synthetic and Compositional Effects upon Catalytic Reactivity

A Theoretical and Experimental Approach for Correlating Nanoparticle Structure and Electrocatalytic Activity

ChemInform Abstract: Correlating Structure and Function of Metal Nanoparticles for Catalysis

Control of selectivity in allylic alcohol oxidation on gold surfaces: the role of oxygen adatoms and hydroxyl species

Correlating Structure and Function of Metal Nanoparticles for Catalysis

Distributed replica dynamics

Effect of annealing in oxygen on alloy structures of Pd–Au bimetallic model catalysts

Oxygen Activation and Reaction on Pd–Au Bimetallic Surfaces

Ridge-based bias potentials to accelerate molecular dynamics

Unusual Activity Trend for CO Oxidation on PdxAu140–x@Pt Core@Shell Nanoparticle Electrocatalysts

Computational Design of Alloy-Core@Shell Metal Nanoparticle Catalysts

EON: software for long time simulations of atomic scale systems

Microwave Synthesis of Classically Immiscible Rhodium–Silver and Rhodium–Gold Alloy Nanoparticles: Highly Active Hydrogenation Catalysts

Oxygen and Hydroxyl Species Induce Multiple Reaction Pathways for the Partial Oxidation of Allyl Alcohol on Gold

An Experimental and Theoretical Investigation of the Inversion of Pd@Pt Core@Shell Dendrimer-Encapsulated Nanoparticles

A theoretical and experimental examination of systematic ligand-induced disorder in Au dendrimer-encapsulated nanoparticles

CO Oxidation at the Au–Cu Interface of Bimetallic Nanoclusters Supported on CeO2(111)