University of Iceland, Reykjavík, Iceland

THEORETICAL ACTIVITY

WG1 members: Hannes Jónsson

Università Milano Bicocca, Milan, Italy

MODELLING OF OXIDE MATERIALS FOR ENERGY AND ENVIRONMENT

WG1 membersGianfranco Pacchioni, Cristiana Di Valentin, Livia Giordano, Sergio Tosoni, Tiffany Chen, Diego Fittipaldi

>>>

Vinča Institute of Nuclear Sciences, Belgrade, Serbia

STRUCTURAL AND ELECTRONIC PROPERTIES OF PARTIALLY REDUCED GRAPHENE OXIDE

WG1 members: Željko Šljivančanin, Zoran S. Popović

>>>

Institute of Physics, University of Belgrade, Belgrade, Serbia

SYNTHESIS OF ULTRA-THIN OXIDE LAYER BY LASER-INDUCED SURFACE MODIFICATION OF MATERIALS

WG1 membersBranislav Jelenković, Dejan Pantelić, Branislav Salatić

>>>

Institute of Catalysis and Petrochemistry, CSIC, Madrid, Spain

THEORETICAL MODELING OF PHYSICAL AND CHEMICAL PROPERTIES OF REDUCIBLE OXIDE SURFACES

WG1 membersMaria Veronica Ganduglia-Pirovano, David López-Durán, , Gustavo E. Murgida

>>>

Universidad Autónoma de Madrid, Madrid, Spain

STM/AFM THEORY APPLIED TO OXIDE NANOSTRUCTURES FOR CATALYSIS AND ENERGY APPLICATIONS

WG1 membersRuben Perez, Milica Todorovic, Krzysztof Kosmider, Ruth M. Casado, Lucia Rodrigo, Diego R. Hermoso

>>>

CIC energiGUNE, Miñano, Spain

CHEMICAL ENERGY STORAGE FROM FIRST PRINCIPLES

WG1 members: Javier Carrasco, Nebil Ayape,  Oleksandr Bondarchuk >>>

Characterization of Active Sites/Entities and Redox/Catalytic Correlations in Copper-Ceria-Based Catalysts for Preferential Oxidation of CO in H2-Rich Streams

A. Martínez-Arias, D. Gamarra, A. B. Hungría, M. Fernández-García, G. Munuera, A. Hornés, P. Bera, J. C. Conesa, and A. López Cámara, Catalysts 3, 378 (2013).

Exceptional Thermal Stability of Pd@CeO2 Core−Shell Catalyst Nanostructures Grafted onto an Oxide Surface

L. Adijanto, D. A. Bennett, C. Chen, A. S. Yu, M. Cargnello, P. Fornasiero, R. J. Gorte, J. M. Vohs, Nano Lett. 13, 2252 (2013).

Enhanced Activity and Selectivity in Catalytic Methanol Steam Reforming by Basic Alkali Metal Salt Coatings

M. Kusche, F. Enzenberger, S. Bajus, H. Niedermeyer, A. Bösmann, A. Kaftan, M. Laurin, J. Libuda, and P. Wasserscheid, Angew. Chem. Int. Ed. 52, 5028 (2013).