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Roldán, Alberto, Ricart, Josep Manel, Illas, Francesc, Pacchioni, Gianfranco (2010) O2 Activation by Au5 Clusters Stabilized on Clean and Electron-Rich MgO Stepped Surfaces. The Journal of Physical Chemistry C, 114 (40). 16973-16978 doi:10.1021/jp1017357

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Reference TypeJournal (article/letter/editorial)
TitleO2 Activation by Au5 Clusters Stabilized on Clean and Electron-Rich MgO Stepped Surfaces
JournalThe Journal of Physical Chemistry C
AuthorsRoldán, AlbertoAuthor
Ricart, Josep ManelAuthor
Illas, FrancescAuthor
Pacchioni, GianfrancoAuthor
Year2010 (October 14)Volume114
Issue40
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/jp1017357Search in ResearchGate
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Mindat Ref. ID3902922Long-form Identifiermindat:1:5:3902922:1
GUID0
Full ReferenceRoldán, Alberto, Ricart, Josep Manel, Illas, Francesc, Pacchioni, Gianfranco (2010) O2 Activation by Au5 Clusters Stabilized on Clean and Electron-Rich MgO Stepped Surfaces. The Journal of Physical Chemistry C, 114 (40). 16973-16978 doi:10.1021/jp1017357
Plain TextRoldán, Alberto, Ricart, Josep Manel, Illas, Francesc, Pacchioni, Gianfranco (2010) O2 Activation by Au5 Clusters Stabilized on Clean and Electron-Rich MgO Stepped Surfaces. The Journal of Physical Chemistry C, 114 (40). 16973-16978 doi:10.1021/jp1017357
In(2010, October) The Journal of Physical Chemistry C Vol. 114 (40) American Chemical Society (ACS)

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Roldán, Alberto, Ricart, Josep Manel, Illas, Francesc, Pacchioni, Gianfranco (2010) O2 adsorption and dissociation on neutral, positively and negatively charged Aun (n = 5–79) clusters. Physical Chemistry Chemical Physics, 12 (36). 10723pp. doi:10.1039/c004110f
Roldán, Alberto, Novell, Gerard, Ricart, Josep M., Illas, Francesc (2010) Theoretical Simulation of Temperature Programmed Desorption of Molecular Oxygen on Isolated Au Nanoparticles from Density Functional Calculations and Microkinetics Models. The Journal of Physical Chemistry C, 114 (11). 5101-5106 doi:10.1021/jp911283j
Illas, Francesc, Rubio, Jaime, Ricart, Josep Manel, Pacchioni, Gianfranco (1996) The importance of correlation effects on the bonding of atomic oxygen on Pt(111). The Journal of Chemical Physics, 105 (16). 7192-7199 doi:10.1063/1.472522
Pacchioni, Gianfranco, Ricart, Josep M., Illas, Francesc (1994) Ab Initio Cluster Model Calculations on the Chemisorption of CO2 and SO2 Probe Molecules on MgO and CaO (100) Surfaces. A Theoretical Measure of Oxide Basicity. Journal Of The American Chemical Society, 116 (22) 10152-10158 doi:10.1021/ja00101a038
López, Núria, Illas, Francesc, Pacchioni, Gianfranco (1999) Electronic Effects in the Activation of Supported Metal Clusters:  Density Functional Theory Study of H2Dissociation on Cu/SiO2. The Journal of Physical Chemistry B, 103 (40). 8552-8557 doi:10.1021/jp991655t
Martinez, Umberto, Pacchioni, Gianfranco, Illas, Francesc (2009) Enhanced magnetic moments of Fe clusters supported on MgO/Fe(001) ultrathin films. The Journal of Chemical Physics, 130 (18). 184711pp. doi:10.1063/1.3132768
Roldán, Alberto, Torres, Daniel, Ricart, Josep M., Illas, Francesc (2008) The chemistry of chlorine on Ag(111) over the sub-monolayer range: A density functional theory investigation. Surface Science, 602 (15). 2639-2642 doi:10.1016/j.susc.2008.06.014
Roldán, Alberto, Boronat, Mercé, Corma, Avelino, Illas, Francesc (2010) Theoretical Confirmation of the Enhanced Facility to Increase Oxygen Vacancy Concentration in TiO2 by Iron Doping. The Journal of Physical Chemistry C, 114 (14). 6511-6517 doi:10.1021/jp911851h
Sousa, Carmen, Illas, Francesc, Ricart, Josep Manel., Bagus, Paul S. (1995) Theoretical evidence for the existence of excitons in MgO. Chemical Physics Letters, 239. 263-266 doi:10.1016/0009-2614(95)00489-q
Clotet, Anna, Ricart, Josep Manel, Pacchioni, Gianfranco (1998) Bonding of vinylidene on Pd(111). Journal of Molecular Structure: THEOCHEM, 458. 123-129 doi:10.1016/s0166-1280(98)00355-8
Lopez, Nuria, Illas, Francesc, Pacchioni, Gianfranco (1999) Ab Initio Theory of Metal Deposition on SiO2. 1. Cun(n= 1−5) Clusters on Nonbridging Oxygen Defects. The Journal of Physical Chemistry B, 103 (10). 1712-1718 doi:10.1021/jp9840174
 
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