4.6 Article

First principles based mean field model for oxygen reduction reaction

Related references

Note: Only part of the references are listed.
Article Chemistry, Multidisciplinary

Tuning the Activity of Pt(111) for Oxygen Electroreduction by Subsurface Alloying

Ifan E. L. Stephens et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2011)

Article Chemistry, Physical

DFT-Based Coverage-Dependent Model of Pt-Catalyzed NO Oxidation

Rachel B. Getman et al.

CHEMCATCHEM (2010)

Article Electrochemistry

The oxygen reduction reaction mechanism on Pt(111) from density functional theory calculations

Vladimir Tripkovic et al.

ELECTROCHIMICA ACTA (2010)

Article Chemistry, Physical

Hyper-Volcano Surface for Oxygen Reduction Reactions over Noble Metals

Yasuharu Okamoto et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2010)

Article Chemistry, Physical

Solvation and Zero-Point-Energy Effects on OH(ads) Reduction on Pt(111) Electrodes

Alfred B. Anderson et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2010)

Article Chemistry, Physical

Theoretical Study of Solvent Effects on the Platinum-Catalyzed Oxygen Reduction Reaction

Yao Sha et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2010)

Article Chemistry, Physical

First-principles molecular dynamics simulations at solid-liquid interfaces with a continuum solvent

Veronica M. Sanchez et al.

JOURNAL OF CHEMICAL PHYSICS (2009)

Article Chemistry, Multidisciplinary

Alloys of platinum and early transition metals as oxygen reduction electrocatalysts

J. Greeley et al.

NATURE CHEMISTRY (2009)

Article Chemistry, Physical

Steady state oxygen reduction and cyclic voltammetry

Jan Rossmeisl et al.

FARADAY DISCUSSIONS (2008)

Article Chemistry, Physical

Aqueous and surface redox potentials from self-consistently determined Gibbs energies

Ryosuke Jinnouchi et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2008)

Article Chemistry, Physical

Increased oxygen coverage at Pt-Fe alloy cathode for the enhanced oxygen reduction reaction studied by EC-XPS

Mitsuru Wakisaka et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2008)

Article Chemistry, Physical

Improved oxygen reduction reactivity of platinum monolayers on transition metal surfaces

Anand Udaykumar Nilekar et al.

SURFACE SCIENCE (2008)

Article Chemistry, Physical

Double-trap kinetic equation for the oxygen reduction reaction on Pt(111) in acidic media

Jia X. Wang et al.

JOURNAL OF PHYSICAL CHEMISTRY A (2007)

Article Chemistry, Physical

Theoretical analysis of reactivity on Pt(111) and Pt-Pd(111) alloys

Sergio R. Calvo et al.

SURFACE SCIENCE (2007)

Article Chemistry, Analytical

Theoretical investigations on the potential-induced formation of Pt-oxide surfaces

Timo Jacob

JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2007)

Article Multidisciplinary Sciences

Improved oxygen reduction activity on Pt3Ni(111) via increased surface site availability

Vojislav R. Stamenkovic et al.

SCIENCE (2007)

Article Chemistry, Physical

Calculated phase diagrams for the electrochemical oxidation and reduction of water over Pt(111)

Jan Rossmeisl et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2006)

Article Chemistry, Physical

How well does Poisson-Boltzmann implicit solvent agree with explicit solvent? A quantitative analysis

Chunhu Tan et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2006)

Article Chemistry, Physical

A unified electrostatic and cavitation model for first-principles molecular dynamics in solution

DA Scherlis et al.

JOURNAL OF CHEMICAL PHYSICS (2006)

Article Chemistry, Multidisciplinary

Changing the activity of electrocatalysts for oxygen reduction by tuning the surface electronic structure

Vojislav Stamenkovic et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2006)

Article Electrochemistry

Pt3Cr(111) alloy effect on the reversible potential of OOH(ads) formation from O2(ads) relative to Pt(111)

Jerome Roques et al.

JOURNAL OF FUEL CELL SCIENCE AND TECHNOLOGY (2005)

Article Electrochemistry

Potential shift for OH( ads) formation on the Pt skin on Pt3Co-(111) electrodes in acid

J Roques et al.

JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2005)

Article Chemistry, Multidisciplinary

Adsorption and dissociation of O2 on Pt-Co and Pt-Fe alloys

Y Xu et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)

Article Electrochemistry

Theory for the potential shift for OHads formation on the Pt skin on Pt3Cr(111) in acid

RM Roques et al.

JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2004)

Article Materials Science, Multidisciplinary

Phase diagram of oxygen adsorbed on platinum (111) by first-principles investigation

HR Tang et al.

PHYSICAL REVIEW B (2004)

Article Chemistry, Physical

Origin of the overpotential for oxygen reduction at a fuel-cell cathode

JK Norskov et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2004)

Article Chemistry, Physical

First-principles molecular dynamics simulations in a continuum solvent

JL Fattebert et al.

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2003)

Article Electrochemistry

Applications of surface X-ray scattering to electrochemistry problems

Z Nagy et al.

ELECTROCHIMICA ACTA (2002)

Article Chemistry, Physical

Universality in heterogeneous catalysis

JK Norskov et al.

JOURNAL OF CATALYSIS (2002)

Article Chemistry, Analytical

Density functional theory study of O2 electroreduction when bonded to a Pt dual site

RA Sidik et al.

JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2002)

Article Chemistry, Multidisciplinary

Density functional theory for efficient ab initio molecular dynamics simulations in solution

JL Fattebert et al.

JOURNAL OF COMPUTATIONAL CHEMISTRY (2002)

Article Chemistry, Physical

A density functional theory study of hydroxyl and the intermediate in the water formation reaction on Pt

A Michaelides et al.

JOURNAL OF CHEMICAL PHYSICS (2001)

Article Electrochemistry

Catalytic effect of platinum on oxygen reduction -: An ab initio model including electrode potential dependence

AB Anderson et al.

JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2000)