Catalytic activity of Pt38 in the oxygen reduction reaction from first-principles simulations

Catalysis by clusters with precise numbers of atoms

(2015) Eric C. Tyo et al.   Nature Nanotechnology

In situ investigation of dissociation and migration phenomena at the Pt/electrolyte interface of an electrochemical cell

(2015) Yeuk Ting Law et al.   Chemical Science

The atomistic origin of the extraordinary oxygen reduction activity of Pt3Ni7 fuel cell catalysts

(2015) Alessandro Fortunelli et al.   Chemical Science

Ultrathin platinum nanowires grown on single-layered nickel hydroxide with high hydrogen evolution activity

(2015) Huajie Yin et al.   Nature Communications

Electrochemistry of Nanoparticles

(2014) Steven E. F. Kleijn et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Dramatic Increase in the Oxygen Reduction Reaction for Platinum Cathodes from Tuning the Solvent Dielectric Constant

(2014) Alessandro Fortunelli et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Highly Crystalline Multimetallic Nanoframes with Three-Dimensional Electrocatalytic Surfaces

(2014) C. Chen et al.   SCIENCE

Platinum-Based Oxygen Reduction Electrocatalysts

(2013) Jianbo Wu et al.   ACCOUNTS OF CHEMICAL RESEARCH

Finding Correlations of the Oxygen Reduction Reaction Activity of Transition Metal Catalysts with Parameters Obtained from Quantum Mechanics

(2013) Ted H. Yu et al.   Journal of Physical Chemistry C

Strong Effects of Cluster Size and Air Exposure on Oxygen Reduction and Carbon Oxidation Electrocatalysis by Size-Selected Ptn (n ≤ 11) on Glassy Carbon Electrodes

(2013) Sebastian Proch et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Magic Number Pt13 and Misshapen Pt12 Clusters: Which One is the Better Catalyst?

(2013) Takane Imaoka et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

A DFT study of oxygen dissociation on platinum based nanoparticles

(2013) Paul C. Jennings et al.   Nanoscale

Optimum nanoparticles for electrocatalytic oxygen reduction: the size, shape and new design

(2013) Guang-Feng Wei et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Nuclear quantum effects and hydrogen bond fluctuations in water

(2013) M. Ceriotti et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

cp2k: atomistic simulations of condensed matter systems

(2013) Jürg Hutter et al.   Wiley Interdisciplinary Reviews-Computational Molecular Science

Nanomaterials for renewable energy production and storage

(2012) Xiaobo Chen et al.   CHEMICAL SOCIETY REVIEWS

Revised self-consistent continuum solvation in electronic-structure calculations

(2012) Oliviero Andreussi et al.   JOURNAL OF CHEMICAL PHYSICS

Prediction of the Dependence of the Fuel Cell Oxygen Reduction Reactions on Operating Voltage from DFT Calculations

(2012) Yao Sha et al.   Journal of Physical Chemistry C

Mechanism for Oxygen Reduction Reaction on Pt3Ni Alloy Fuel Cell Cathode

(2012) Yao Sha et al.   Journal of Physical Chemistry C

Electrocatalyst approaches and challenges for automotive fuel cells

(2012) Mark K. Debe   NATURE

Oxygen Hydration Mechanism for the Oxygen Reduction Reaction at Pt and Pd Fuel Cell Catalysts

(2011) Yao Sha et al.   Journal of Physical Chemistry Letters

The Hydrogen Issue

(2010) Nicola Armaroli et al.   ChemSusChem

Hydrogen Peroxide Production in the Oxygen Reduction Reaction at Different Electrocatalysts as Quantified by Scanning Electrochemical Microscopy

(2009) Carlos M. Sánchez-Sánchez et al.   ANALYTICAL CHEMISTRY

Combinatorial Density Functional Theory-Based Screening of Surface Alloys for the Oxygen Reduction Reaction

(2009) Jeff Greeley et al.   Journal of Physical Chemistry C

Special Pair Dance and Partner Selection: Elementary Steps in Proton Transport in Liquid Water

(2008) Omer Markovitch et al.   JOURNAL OF PHYSICAL CHEMISTRY B

First-Principles Analysis of Oxygen-Containing Adsorbates Formed from the Electrochemical Discharge of Water on Pt(111)

(2008) V. Rai et al.   Journal of Physical Chemistry C

Electrochemistry on the computer: Understanding how to tailor the metal overlayers for the oxygen reduction reaction

(2008) J. Rossmeisl et al.   SURFACE SCIENCE

Improved oxygen reduction reactivity of platinum monolayers on transition metal surfaces

(2008) Anand Udaykumar Nilekar et al.   SURFACE SCIENCE