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

Revised self-consistent continuum solvation in electronic-structure calculations

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

Hydrophobic Segregation, Phase Transitions and the Anomalous Thermodynamics of Water/Methanol Mixtures

(2012) Tod A. Pascal et al.   JOURNAL OF PHYSICAL CHEMISTRY B

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

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

Mechanism for Degradation of Nafion in PEM Fuel Cells from Quantum Mechanics Calculations

(2011) Ted H. Yu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Theoretical Studies of Potential-Dependent and Competing Mechanisms of the Electrocatalytic Oxygen Reduction Reaction on Pt(111)

(2010) John A. Keith et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

The role of hydrogen bonding in water–metal interactions

(2010) Adrien Poissier et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

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

Towards the computational design of solid catalysts

(2009) J. K. Nørskov et al.   Nature Chemistry

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

First-Principles Analysis of the Initial Electroreduction Steps of Oxygen over Pt(111)

(2008) Michael J. Janik et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY