Mechanism and microkinetics of methanol synthesis via CO2 hydrogenation on indium oxide
Frei, M.S., Capdevila-Cortada, M., García-Muelas, R., Mondelli, C., López, N., Stewart, J.A., Curulla Ferré, D., Pérez-Ramírez, J.
Published in Journal of catalysis (01.05.2018)
Published in Journal of catalysis (01.05.2018)
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Journal Article
Deactivation of a Co/Al2O3 Fischer–Tropsch catalyst by water-induced sintering in slurry reactor: Modeling and experimental investigations
Sadeqzadeh, M., Chambrey, S., Piché, S., Fongarland, P., Luck, F., Curulla-Ferré, D., Schweich, D., Bousquet, J., Khodakov, A.Y.
Published in Catalysis today (15.10.2013)
Published in Catalysis today (15.10.2013)
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Journal Article
Conference Proceeding
DFT study of CO and NO adsorption on low index and stepped surfaces of gold
Hussain, A., Curulla Ferré, D., Gracia, J., Nieuwenhuys, B.E., Niemantsverdriet, J.W.
Published in Surface science (01.09.2009)
Published in Surface science (01.09.2009)
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Journal Article
Identification of the active species in the working alumina-supported cobalt catalyst under various conditions of Fischer–Tropsch synthesis
Sadeqzadeh, M., Karaca, H., Safonova, O.V., Fongarland, P., Chambrey, S., Roussel, P., Griboval-Constant, A., Lacroix, M., Curulla-Ferré, D., Luck, F., Khodakov, A.Y.
Published in Catalysis today (30.04.2011)
Published in Catalysis today (30.04.2011)
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Journal Article
Conference Proceeding
Migration of Carbon into Subsurface Layers of Rh(100): A DFT Study
Nieskens, Davy L. S., Curulla-Ferré, D., Niemantsverdriet, J. W.
Published in Chemphyschem (12.05.2006)
Published in Chemphyschem (12.05.2006)
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Journal Article
Ethylene Decomposition on Rh(100): Theory and Experiment
Nieskens, Davy L. S, van Bavel, A. P, Curulla Ferre, D, Niemantsverdriet, J. W
Published in The journal of physical chemistry. B (23.09.2004)
Published in The journal of physical chemistry. B (23.09.2004)
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Journal Article
Structure and catalytic processes of N-containing species on Rh(111) from first principles
Ricart, J.M., Ample, F., Clotet, A., Curulla, D., Niemantsverdriet, J.W. (Hans), Paul, J.F., Pérez-Ramírez, J.
Published in Journal of catalysis (15.05.2005)
Published in Journal of catalysis (15.05.2005)
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Journal Article
A density functional study of the adsorption of CO on Rh(111)
Curulla, D., Linke, R., Clotet, A., Ricart, J. M., Niemantsverdriet, J. W.
Published in Physical chemistry chemical physics : PCCP (17.10.2002)
Published in Physical chemistry chemical physics : PCCP (17.10.2002)
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Journal Article
Charge displacement analysis: A new general method to estimate atomic charges in molecules and clusters
Bagus, P.S., Clotet, A., Curulla, D., Illas, F., Ricart, J.M.
Published in Journal of molecular catalysis. A, Chemical (23.05.1997)
Published in Journal of molecular catalysis. A, Chemical (23.05.1997)
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Journal Article
Conference Proceeding
Ab Initio Cluster Model Study of the Chemisorption of CO on Low-Index Platinum Surfaces
Curulla, Daniel, Clotet, Anna, Ricart, Josep M, Illas, Francesc
Published in The journal of physical chemistry. B (24.06.1999)
Published in The journal of physical chemistry. B (24.06.1999)
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Journal Article
Adsorption of CO and CN − on transition metal surfaces: a comparative study of the bonding mechanism
Ample, Francisco, Curulla, Daniel, Fuster, Franck, Clotet, Anna, Ricart, Josep M.
Published in Surface science (20.01.2002)
Published in Surface science (20.01.2002)
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Journal Article
Mechanistic Modeling of Cobalt Based Catalyst Sintering in a Fixed Bed Reactor under Different Conditions of Fischer–Tropsch Synthesis
Sadeqzadeh, Majid, Hong, Jingping, Fongarland, Pascal, Curulla-Ferré, Daniel, Luck, Francis, Bousquet, Jacques, Schweich, Daniel, Khodakov, Andrei Y
Published in Industrial & engineering chemistry research (19.09.2012)
Published in Industrial & engineering chemistry research (19.09.2012)
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Journal Article
Competitive CN and N 2 formation on Rh(1 1 1): a case of entropic stabilization
Ample, Francisco, Ricart, Josep M., Clotet, Anna, Curulla, Daniel, (Hans) Niemantsverdriet, J.W.
Published in Chemical physics letters (02.02.2004)
Published in Chemical physics letters (02.02.2004)
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Journal Article
Effect of Different Reaction Conditions on the Deactivation of Alumina-Supported Cobalt Fischer–Tropsch Catalysts in a Milli-Fixed-Bed Reactor: Experiments and Modeling
Sadeqzadeh, Majid, Chambrey, Stéphane, Hong, Jingping, Fongarland, Pascal, Luck, Francis, Curulla-Ferré, Daniel, Schweich, Daniel, Bousquet, Jacques, Khodakov, Andrei Y
Published in Industrial & engineering chemistry research (30.04.2014)
Published in Industrial & engineering chemistry research (30.04.2014)
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