Silver Nanoparticles for Olefin Production: New Insights into the Mechanistic Description of Propyne Hydrogenation

Thiolate adsorption on Au(hkl) and equilibrium shape of large thiolate-covered gold nanoparticles

(2013) Georgios D. Barmparis et al.   JOURNAL OF CHEMICAL PHYSICS

Freeze-drying for controlled nanoparticle distribution in Co/SiO 2 Fischer–Tropsch catalysts

(2012) T.M. Eggenhuisen et al.   JOURNAL OF CATALYSIS

In situ surface coverage analysis of RuO2-catalysed HCl oxidation reveals the entropic origin of compensation in heterogeneous catalysis

(2012) Detre Teschner et al.   Nature Chemistry

Al13Fe4 as a low-cost alternative for palladium in heterogeneous hydrogenation

(2012) M. Armbrüster et al.   NATURE MATERIALS

Dependence on CO adsorption of the shapes of multifaceted gold nanoparticles: A density functional theory

(2012) Georgios D. Barmparis et al.   PHYSICAL REVIEW B

Density-Functional Theory with Screened van der Waals Interactions for the Modeling of Hybrid Inorganic-Organic Systems

(2012) Victor G. Ruiz et al.   PHYSICAL REVIEW LETTERS

Isolated Metal Atom Geometries as a Strategy for Selective Heterogeneous Hydrogenations

(2012) Georgios Kyriakou et al.   SCIENCE

H2dissociation over Ag/Al2O3: the first step in hydrogen assisted selective catalytic reduction of NOx

(2012) Simon Klacar et al.   Catalysis Science & Technology

Structure Sensitivity of Alkynol Hydrogenation on Shape- and Size-Controlled Palladium Nanocrystals: Which Sites Are Most Active and Selective?

(2011) Micaela Crespo-Quesada et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Spray deposition method for the synthesis of supported catalysts with superior metal dispersion

(2011) Marta Santiago et al.   MICROPOROUS AND MESOPOROUS MATERIALS

C—H Bond Activation in Transition Metal Species from a Computational Perspective

(2010) David Balcells et al.   CHEMICAL REVIEWS

Molecular understanding of alkyne hydrogenation for the design of selective catalysts

(2010) Blaise Bridier et al.   DALTON TRANSACTIONS

Improved Description of the Structure of Molecular and Layered Crystals: Ab Initio DFT Calculations with van der Waals Corrections

(2010) Tomáš Bučko et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Pd−Ga Intermetallic Compounds as Highly Selective Semihydrogenation Catalysts

(2010) Marc Armbrüster et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

C−H Bond Activation and Organometallic Intermediates on Isolated Metal Centers on Oxide Surfaces

(2009) Christophe Coperet   CHEMICAL REVIEWS

Hydrogenation of acetylene–ethylene mixtures over Pd and Pd–Ag alloys: First-principles-based kinetic Monte Carlo simulations

(2009) Donghai Mei et al.   JOURNAL OF CATALYSIS

Organic Molecular Probes in Heterogeneous Catalysis. Hydrogenation of Norbornadiene on Gold

(2008) Valia Amir-Ebrahimi et al.   CATALYSIS LETTERS

Pd catalysed hexyne hydrogenation modified by Bi and by Pb

(2008) J ANDERSON et al.   JOURNAL OF CATALYSIS

The Roles of Subsurface Carbon and Hydrogen in Palladium-Catalyzed Alkyne Hydrogenation

(2008) D. Teschner et al.   SCIENCE

Identification of Non-Precious Metal Alloy Catalysts for Selective Hydrogenation of Acetylene

(2008) F. Studt et al.   SCIENCE