DFT study of composites formed by M2 metallic clusters (M = Ni, Cu, Fe and Au) embedded in faujasite

A DFT study of copper-oxide clusters embedded in dry and water-immersed siliceous mordenite

(2015) Joel Antúnez-García et al.   COMPUTATIONAL MATERIALS SCIENCE

Plasmon resonance of gold nanoparticles supported on Y-zeolite in the presence of various co-cations

(2014) Elena Smolentseva et al.   APPLIED SURFACE SCIENCE

Revisiting Photoemission and Inverse Photoemission Spectra of Nickel Oxide from First Principles: Implications for Solar Energy Conversion

(2014) Nima Alidoust et al.   JOURNAL OF PHYSICAL CHEMISTRY B

A theoretical study of Cu clusters in siliceous erionite

(2013) Joel Antúnez-García et al.   JOURNAL OF MOLECULAR STRUCTURE

Plasmon Features of Coinage Metal Nanoparticles Supported on Zeolites

(2013) Catalina López-Bastidas et al.   Plasmonics

Hydrogen Lean-DeNOxas an Alternative to the Ammonia and Hydrocarbon Selective Catalytic Reduction (SCR)

(2011) Petros G. Savva et al.   CATALYSIS REVIEWS-SCIENCE AND ENGINEERING

First principles scheme to evaluate band edge positions in potential transition metal oxide photocatalysts and photoelectrodes

(2011) Maytal Caspary Toroker et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Catalytic processes activated by light

(2010) R. E. Galian et al.   Energy & Environmental Science

Efficient Band Gap Prediction for Solids

(2010) M. K. Y. Chan et al.   PHYSICAL REVIEW LETTERS

Quasiparticle band structures of the antiferromagnetic transition-metal oxides MnO, FeO, CoO, and NiO

(2009) C. Rödl et al.   PHYSICAL REVIEW B

Influence of sodium on activation of gold species in Y–zeolites

(2007) A. Simakov et al.   CATALYSIS COMMUNICATIONS