Derechos | Preview | Fecha Public. | Título | Autor(es) | Tipo |
closedAccess | | 18-abr-2013 | DFT study of ethyne hydrogenation on CeO2(111) | Carrasco Rodríguez, Javier; Vilé, Gianvito; Fernández Torre, Delia CSIC; Pérez, R.; Pérez-Ramírez, J.; Ganduglia-Pirovano, M. V. CSIC ORCID | comunicación de congreso |
closedAccess | | 7-feb-2013 | Does water dissociates on the clean CeO2(111) surface? A study with van der Waals and hybrid functionals | Fernández Torre, Delia CSIC; Kosmider, Krzysztof; Carrasco Rodríguez, Javier; Ganduglia-Pirovano, M. V. CSIC ORCID; Pérez, R. | póster de congreso |
closedAccess | | 6-nov-2013 | Hydrogen activation and diffusion on CeO2(111) studied with DFT+U | Fernández Torre, Delia CSIC; Carrasco Rodríguez, Javier; Ganduglia-Pirovano, M. V. CSIC ORCID; Pérez, R. | comunicación de congreso |
openAccess | | 2014 | Hydrogen activation, diffusion and clustering on CeO2(111): a DFT+U study | Fernández Torre, Delia CSIC; Carrasco Rodríguez, Javier; Ganduglia-Pirovano, M. V. CSIC ORCID; Pérez, R. | artículo |
closedAccess | | 23-mar-2015 | In situ and theoretical studies for the dissociation of water on an active Ni/CeO2 Catalyst: Importance of strong metal-support interactions for the cleavage of O-H bonds | Carrasco Rodríguez, Javier; López-Durán, David CSIC ORCID; Liu, Z.; Duchon, Tomás; Evans, Jaime; Senanayake, Sanjaya D.; Crumlin, Ethan J.; Matolín, Vladimir; Rodríguez, José A.; Ganduglia-Pirovano, M. V. CSIC ORCID | artículo |
openAccess | | 25-oct-2013 | Molecular switches from benzene derivatives adsorbed on metal surfaces | Liu, W.; Filimonov, Sergey N.; Carrasco Rodríguez, Javier; Tkatchenko, Alexandre | artículo |
closedAccess | | 6-nov-2013 | Molecular-level understanding of CeO2 as a catalyst for partial alkyne hydrogenation | Carrasco Rodríguez, Javier; Vilé, Gianvito; Fernández Torre, Delia CSIC; Pérez, R.; Pérez-Ramírez, J.; Ganduglia-Pirovano, M. V. CSIC ORCID | póster de congreso |
closedAccess | | 2014 | Molecular-level understanding of CeO2 as a catalyst for partial alkyne hydrogenation | Carrasco Rodríguez, Javier; Vilé, Gianvito; Fernández Torre, Delia CSIC; Pérez, Rubén; Pérez-Ramírez, J.; Ganduglia-Pirovano, M. V. CSIC ORCID | artículo |
openAccess | | 4-abr-2014 | Ni/CeO2 as a catalyst for hydrogen production: A theoretical perspective | Ganduglia-Pirovano, M. V. CSIC ORCID; Carrasco Rodríguez, Javier; López-Durán, David CSIC ORCID; Barrio Pliego, Laura CSIC ORCID; Rodríguez, José A. | comunicación de congreso |
openAccess | | 16-ago-2015 | Ni/CeO2 for hydrogen production: The role of metal-support interactions | Ganduglia-Pirovano, M. V. CSIC ORCID; López-Durán, David CSIC ORCID; Carrasco Rodríguez, Javier; Liu, Z.; Duchon, Tomás; Evans, Jaime; Senanayake, Sanjaya D.; Crumlin, Ethan J.; Matolín, Vladimir; Rodríguez, J. A. | comunicación de congreso |
closedAccess | | 18-abr-2013 | Ni/CeO2(111): a model catalyst for water-gas shift reaction | López-Durán, David CSIC ORCID; Carrasco Rodríguez, Javier; Barrio Pliego, Laura CSIC ORCID; Liu, P.; Rodríguez, José A.; Ganduglia-Pirovano, M. V. CSIC ORCID | póster de congreso |
closedAccess | | 28-abr-2014 | Ni/CeO2: a monofunctional model catalyst for the water-gas shift reaction | López-Durán, David CSIC ORCID; Carrasco Rodríguez, Javier; Rodríguez, J. A.; Ganduglia-Pirovano, M. V. CSIC ORCID | comunicación de congreso |
closedAccess | | 8-sep-2013 | Ni/CeO2: A promising catalyst for water-gas shift | Ganduglia-Pirovano, M. V. CSIC ORCID; Carrasco Rodríguez, Javier; López-Durán, David CSIC ORCID; Barrio Pliego, Laura CSIC ORCID; Liu, P.; Rodríguez, J. A. | comunicación de congreso |
closedAccess | | 18-abr-2013 | Ni/ceria catalysts: Are they bifunctional? ‒ The role of the
ceria support | López-Durán, David CSIC ORCID; Rodríguez, J. A.; Ganduglia-Pirovano, M. V. CSIC ORCID; Carrasco Rodríguez, Javier | póster de congreso |
closedAccess | | 14-sep-2014 | The role of electron localization in the catalytic function of cerium-oxide-based systems | Ganduglia-Pirovano, M. V. CSIC ORCID; López-Durán, David CSIC ORCID; Carrasco Rodríguez, Javier; Fernández Torre, Delia CSIC; Pérez, Rubén | comunicación de congreso |
closedAccess | | 2013 | The role of van der Waals forces in water adsorption on metals | Carrasco Rodríguez, Javier; Klimeš, Jiri; Michaelides, Angelos | artículo |
closedAccess | | 12-nov-2015 | Theoretical studies of the adsorption of CH4 on Ni-CeO2 systems: Evidence of a strong metal-support interaction | Lustemberg, P. G.; Busnengo, H. F.; Carrasco Rodríguez, Javier; Senanayake, Sanjaya D.; Rodríguez, J. A.; Ganduglia-Pirovano, M. V. CSIC ORCID | comunicación de congreso |
closedAccess | | 2013 | Theoretical studies of the adsorption of CO and C on Ni(111) and Ni/CeO2(111): Evidence of a strong metal-support interaction | Carrasco Rodríguez, Javier; Barrio Pliego, Laura CSIC ORCID; Liu, P.; Rodríguez, José A.; Ganduglia-Pirovano, M. V. CSIC ORCID | artículo |