First-principles simulation of oxygen evolution reaction (OER) catalytic performance of IrO2 bulk-like structures: Nanosphere, nanowire and nanotube

Constructing MoS2/g-C3N4 heterojunction with enhanced oxygen evolution reaction activity: A theoretical insight

(2020) Zhe Xue et al.   APPLIED SURFACE SCIENCE

Probing the structural evolution and electronic properties of divalent metal Be2Mgn clusters from small to medium-size

(2020) Feige Zhang et al.   Scientific Reports

High‐Indexed PtNi Alloy Skin Spiraled on Pd Nanowires for Highly Efficient Oxygen Reduction Reaction Catalysis

(2019) Yueping Zhao et al.   Small

Recent Progress on Surface Reconstruction of Earth‐Abundant Electrocatalysts for Water Oxidation

(2019) Yaoyao Li et al.   Small

Experimental Activity Descriptors for Iridium-Based Catalysts for the Electrochemical Oxygen Evolution Reaction (OER)

(2019) Camillo Spöri et al.   ACS Catalysis

Nanoporous Iridium-Based Alloy Nanowires as Highly Efficient Electrocatalysts Toward Acidic Oxygen Evolution Reaction

(2019) Ying Wang et al.   ACS Applied Materials & Interfaces

Mesoporous iridium oxide/Sb-doped SnO2 nanostructured electrodes for polymer electrolyte membrane water electrolysis

(2019) Sang-Beom Han et al.   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

The adsorption and dissociation of O 2 on Pd and Pt modified TaC (1 0 0) surface: A first principles study

(2018) Yanan Meng et al.   APPLIED SURFACE SCIENCE

Reducing Iridium Loading in Oxygen Evolution Reaction Electrocatalysts Using Core–Shell Particles with Nitride Cores

(2018) Brian M. Tackett et al.   ACS Catalysis

First-principles study of the nanotubes from the TiO2 hexagonal sheet

(2018) Jiao An et al.   JOURNAL OF MATERIALS SCIENCE

Single-Step Electrospun Ir/IrO2 Nanofibrous Structures Decorated with Au Nanoparticles for Highly Catalytic Oxygen Evolution Reaction

(2018) Sinyoung Moon et al.   ACS Applied Materials & Interfaces

Modulating Electronic Structures of Inorganic Nanomaterials for Efficient Electrocatalytic Water Splitting

(2018) Xinchuan Du et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Combining theory and experiment in electrocatalysis: Insights into materials design

(2017) Zhi Wei Seh et al.   SCIENCE

Density functional theory is straying from the path toward the exact functional

(2017) Michael G. Medvedev et al.   SCIENCE

Graphene-coated copper nanowire networks as a highly stable transparent electrode in harsh environments toward efficient electrocatalytic hydrogen evolution reactions

(2017) Arumugam Manikandan et al.   Journal of Materials Chemistry A

Hierarchical Fe-doped NiO x nanotubes assembled from ultrathin nanosheets containing trivalent nickel for oxygen evolution reaction

(2017) Geng Wu et al.   Nano Energy

Using Density Functional Theory to Model Realistic TiO2 Nanoparticles, Their Photoactivation and Interaction with Water

(2017) Daniele Selli et al.   Catalysts

Porous MoO2 Nanosheets as Non-noble Bifunctional Electrocatalysts for Overall Water Splitting

(2016) Yanshuo Jin et al.   ADVANCED MATERIALS

Tuning Nanowires and Nanotubes for Efficient Fuel-Cell Electrocatalysis

(2016) Wei Wang et al.   ADVANCED MATERIALS

Accurate first-principles structures and energies of diversely bonded systems from an efficient density functional

(2016) Jianwei Sun et al.   Nature Chemistry

Density functional theory study of oxygen reduction reaction on Pt/Pd3Al(111) alloy electrocatalyst

(2016) B. B. Xiao et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Superb Alkaline Hydrogen Evolution and Simultaneous Electricity Generation by Pt-Decorated Ni3N Nanosheets

(2016) Yuhang Wang et al.   Advanced Energy Materials

Oxide-Supported IrNiOxCore-Shell Particles as Efficient, Cost-Effective, and Stable Catalysts for Electrochemical Water Splitting

(2015) Hong Nhan Nong et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

First-Principles Modeling of a Dye-Sensitized TiO2/IrO2 Photoanode for Water Oxidation

(2015) Mariachiara Pastore et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Prediction of Ir0.5M0.5O2 (M = Cr, Ru or Pb) Mixed Oxides as Active Catalysts for Oxygen Evolution Reaction from First-Principles Calculations

(2015) Ya Song et al.   TOPICS IN CATALYSIS

Oxide-supported Ir nanodendrites with high activity and durability for the oxygen evolution reaction in acid PEM water electrolyzers

(2015) Hyung-Suk Oh et al.   Chemical Science

N-doped graphene as catalysts for oxygen reduction and oxygen evolution reactions: Theoretical considerations

(2014) Mingtao Li et al.   JOURNAL OF CATALYSIS

Understanding the Electronic Structure ofIrO2Using Hard-X-ray Photoelectron Spectroscopy and Density-Functional Theory

(2014) J. M. Kahk et al.   PHYSICAL REVIEW LETTERS

Electrochemical controlled synthesis and characterization of well-aligned IrO2 nanotube arrays with enhanced electrocatalytic activity toward oxygen evolution reaction

(2012) Chenxing Zhao et al.   JOURNAL OF ELECTROANALYTICAL CHEMISTRY

Symmetry and Stability of the Rutile-Based TiO2 Nanowires: Models and Comparative LCAO-Plane Wave DFT Calculations

(2012) R. A. Evarestov et al.   Journal of Physical Chemistry C

Electrocatalytic Oxygen Evolution Reaction (OER) on Ru, Ir, and Pt Catalysts: A Comparative Study of Nanoparticles and Bulk Materials

(2012) Tobias Reier et al.   ACS Catalysis

Universality in Oxygen Evolution Electrocatalysis on Oxide Surfaces

(2011) Isabela C. Man et al.   ChemCatChem

A Perovskite Oxide Optimized for Oxygen Evolution Catalysis from Molecular Orbital Principles

(2011) J. Suntivich et al.   SCIENCE

Hydrogen energy — Abundant, efficient, clean: A debate over the energy-system-of-change☆

(2009) Carl-Jochen Winter   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

Stability and Electronic Properties of TiO2 Nanostructures With and Without B and N Doping

(2009) D. J. Mowbray et al.   Journal of Physical Chemistry C