| 1 |
Computational chemistry approaches for the preparation of supported catalysts: Progress and challenges
Valero MC, Raybaud P
Journal of Catalysis, 391, 539, 2020 |
| 2 |
Dehydrogenation mechanisms of methyl-cyclohexane on gamma-Al2O3 supported Pt-13: Impact of cluster ductility
Zhao W, Chizallet C, Sautet P, Raybaud P
Journal of Catalysis, 370, 118, 2019 |
| 3 |
Dehydrogenation mechanisms of methyl-cyclohexane on gamma-Al2O3 supported Pt-13: Impact of cluster ductility
Zhao W, Chizallet C, Sautet P, Raybaud P
Journal of Catalysis, 370, 118, 2019 |
| 4 |
On the origin of the difference between type A and type B skeletal isomerization of alkenes catalyzed by zeolites: The crucial input of ab initio molecular dynamics
Rey J, Gomez A, Raybaud P, Chizallet C, Bucko T
Journal of Catalysis, 373, 361, 2019 |
| 5 |
Beyond gamma-Al2O3 crystallite surfaces: The hidden features of edges revealed by solid-state H-1 NMR and DFT calculations
Batista ATF, Wisser D, Pigeon T, Gajan D, Diehl F, Rivallan M, Catita L, Gay AS, Lesage A, Chizallet C, Raybaud P
Journal of Catalysis, 378, 140, 2019 |
| 6 |
Active sites speciation of supported CoMoS phase probed by NO molecule: A combined IR and DFT study
Caron F, Rivallan M, Humbert S, Daudin A, Bordiga S, Raybaud P
Journal of Catalysis, 361, 62, 2018 |
| 7 |
Deep HDS of FCC gasoline over alumina supported CoMoS catalyst: Inhibiting effects of carbon monoxide and water
Pelardy F, Daudin A, Devers E, Dupont C, Raybaud P, Brunet S
Applied Catalysis B: Environmental, 183, 317, 2016 |
| 8 |
Competitive adsorption of nitrogen and sulphur compounds on a multisite model of NiMoS catalyst: A theoretical study
Humbert S, Izzet G, Raybaud P
Journal of Catalysis, 333, 78, 2016 |
| 9 |
Dealumination mechanisms of zeolites and extra-framework aluminum confinement
Silaghi MC, Chizallet C, Sauer J, Raybaud P
Journal of Catalysis, 339, 242, 2016 |
| 10 |
Improved promoter effect in NiWS catalysts through a molecular approach and an optimized Ni edge decoration
Alphazan T, Bonduelle-Skrzypczak A, Legens C, Boudene Z, Taleb AL, Gay AS, Ersen O, Coperet C, Raybaud P
Journal of Catalysis, 340, 60, 2016 |
