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Nanoscale thermal stabilization via permutational premelting

2012
Francesc Vines , Javier Carrasco Rodríguez, Stefan T. Bromley
Physical Review B
Anomalous higher-than-bulk melting in some metal clusters has been pre...

Insight into the Adsorption of Water on the Clean CeO2(111) Surface with van der Waals and Hybrid Density Functionals

2012
Delia Fernandez-Torre , Krzysztof Kosmider , Javier Carrasco Rodríguez, María Verónica Ganduglia Pirovano, Ruben Perez
Journal of Physical Chemistry C
Understanding the interaction between water and ceria the surfaces is ...

A molecular perspective of water at metal interfaces

2012
Javier Carrasco Rodríguez, Andrew Hodgson , Angelos Michaelides
Nature Materials
Water/solid interfaces are relevant to a broad range of physicochemica...

Periodic Density Functional Theory Study of VO(n) Species Supported on the CeO(2)(111) Surface

2011
Cristina Popa , María Verónica Ganduglia Pirovano, J. Sauer
Journal of Physical Chemistry C
We model monomeric vanadia adspecies on the CeO(2)(111) surface of c...

Electron Localization in Defective Ceria Films: A Study with Scanning-Tunneling Microscopy and Density-Functional Theory

2011
Jan-Frederik Jerratsch , Xiang Shao , Niklas Nilius , H.-J. Freund , Cristina Popa , María Verónica Ganduglia Pirovano, Asbjoern M. Burow , J. Sauer
Physical Review Letters
Scanning-tunneling microscopy and density-functional theory have been ...
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