Water-gas shift reaction on oxide/Cu(111): Rational catalyst screening from density functional theory

A theoretical insight into the catalytic effect of a mixed-metal oxide at the nanometer level: The case of the highly active metal/CeOx/TiO2(110) catalysts

(2010) Jesús Graciani et al.   JOURNAL OF CHEMICAL PHYSICS

Theoretical and Experimental Study of the Electronic Structures of MoO3and MoO2

(2010) David O. Scanlon et al.   Journal of Physical Chemistry C

Interface-Confined Ferrous Centers for Catalytic Oxidation

(2010) Q. Fu et al.   SCIENCE

Water-Gas Shift Reaction on a Highly Active Inverse CeOx/Cu(111) Catalyst: Unique Role of Ceria Nanoparticles

(2009) José A. Rodriguez et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Water–gas-shift reaction on a Ni2P(001) catalyst: Formation of oxy-phosphides and highly active reaction sites

(2009) Ping Liu et al.   JOURNAL OF CATALYSIS

High Water−Gas Shift Activity in TiO2(110) Supported Cu and Au Nanoparticles: Role of the Oxide and Metal Particle Size

(2009) José A. Rodríguez et al.   Journal of Physical Chemistry C

Gold, Copper, and Platinum Nanoparticles Dispersed on CeOx/TiO2(110) Surfaces: High Water-Gas Shift Activity and the Nature of the Mixed-Metal Oxide at the Nanometer Level

(2009) Joon B. Park et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Valence-band electronic structure of CdO, ZnO, and MgO from x-ray photoemission spectroscopy and quasi-particle-corrected density-functional theory calculations

(2009) P. D. C. King et al.   PHYSICAL REVIEW B

High catalytic activity of Au/CeOx/TiO2(110) controlled by the nature of the mixed-metal oxide at the nanometer level

(2009) J. B. Park et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

A theoretical study of the water gas shift reaction mechanism on Cu(111) model system

(2009) Qian-Lin Tang et al.   SURFACE SCIENCE

Shape and Crystal-Plane Effects of Nanoscale Ceria on the Activity of Au-CeO2 Catalysts for the Water–Gas Shift Reaction

(2008) Rui Si et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Water-gas shift activity of Cu surfaces and Cu nanoparticles supported on metal oxides

(2008) J.A. Rodriguez et al.   CATALYSIS TODAY

CO Oxidation by Rutile TiO2(110) Doped with V, W, Cr, Mo, and Mn

(2008) Hyun You Kim et al.   Journal of Physical Chemistry C

Mechanism of the Water Gas Shift Reaction on Pt:  First Principles, Experiments, and Microkinetic Modeling

(2008) Lars C. Grabow et al.   Journal of Physical Chemistry C

Intrinsic Diffusion of Hydrogen on Rutile TiO2(110)

(2008) Shao-Chun Li et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

On the Mechanism of Low-Temperature Water Gas Shift Reaction on Copper

(2008) Amit A. Gokhale et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Water–gas shift activity of Au and Cu nanoparticles supported on molybdenum oxides

(2007) J.A. Rodríguez et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL