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Hazar Guesmi
Hazar Guesmi
CNRS
Zweryfikowany adres z enscm.fr - Strona główna
Tytuł
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Lewis Acido-Basic Interactions between CO2 and MgO Surface: DFT and DRIFT Approaches
D Cornu, H Guesmi, JM Krafft, H Lauron-Pernot
The Journal of Physical Chemistry C 116 (11), 6645-6654, 2012
1792012
Evidence of Pd segregation and stabilization at edges of AuPd nano-clusters in the presence of CO: A combined DFT and DRIFTS study
B Zhu, G Thrimurthulu, L Delannoy, C Louis, C Mottet, J Creuze, ...
Journal of catalysis 308, 272-281, 2013
1082013
Chromium oxide species supported on silica: A representative periodic DFT model
H Guesmi, F Tielens
The Journal of Physical Chemistry C 116 (1), 994-1001, 2012
652012
Recent advances in the electrooxidation of biomass-based organic molecules for energy, chemicals and hydrogen production
Y Holade, N Tuleushova, S Tingry, K Servat, TW Napporn, H Guesmi, ...
Catalysis Science & Technology 10 (10), 3071-3112, 2020
612020
DFT study of the M segregation on MAu alloys (M= Ni, Pd, Pt) in presence of adsorbed oxygen O and O2
A Dhouib, H Guesmi
Chemical Physics Letters 521, 98-103, 2012
612012
Nitrous Oxide Decomposition on the Binuclear [FeII(μ-O)(μ-OH)FeII] Center in Fe-ZSM-5 Zeolite
H Guesmi, D Berthomieu, L Kiwi-Minsker
The Journal of Physical Chemistry C 112 (51), 20319-20328, 2008
542008
Reshaping Dynamics of Gold Nanoparticles under H2 and O2 at Atmospheric Pressure
A Chmielewski, J Meng, B Zhu, Y Gao, H Guesmi, H Prunier, D Alloyeau, ...
ACS nano 13 (2), 2024-2033, 2019
482019
Characterization of molybdenum monomeric oxide species supported on hydroxylated silica: a DFT study
H Guesmi, R Gryboś, J Handzlik, F Tielens
Physical Chemistry Chemical Physics 16 (34), 18253-18260, 2014
482014
Chemisorbed atomic oxygen inducing Pd segregation in PdAu (1 1 1) alloy: energetic and electronic DFT analysis
H Guesmi, C Louis, L Delannoy
Chemical Physics Letters 503 (1-3), 97-100, 2011
442011
Characterization of tungsten monomeric oxide species supported on hydroxylated silica; a DFT study
H Guesmi, R Grybos, J Handzlik, F Tielens
RSC advances 6 (45), 39424-39432, 2016
382016
How surface hydroxyls enhance MgO reactivity in basic catalysis: The case of methylbutynol conversion
H Petitjean, H Guesmi, H Lauron-Pernot, G Costentin, D Loffreda, ...
ACS Catalysis 4 (11), 4004-4014, 2014
372014
Theoretical evidence of the observed kinetic order dependence on temperature during the N 2 O decomposition over Fe-ZSM-5
H Guesmi, D Berthomieu, B Bromley, B Coq, L Kiwi-Minsker
Physical Chemistry Chemical Physics 12 (12), 2873-2878, 2010
332010
Crossover among structural motifs in Pd–Au nanoalloys
B Zhu, H Guesmi, J Creuze, B Legrand, C Mottet
Physical Chemistry Chemical Physics 17 (42), 28129-28136, 2015
302015
First-principles study of Au–Cu alloy surface changes induced by gas adsorption of CO, NO, or O2
M Dhifallah, A Dhouib, S Aldulaijan, F Di Renzo, H Guesmi
The Journal of Chemical Physics 145 (2), 2016
292016
Surface segregation in AuPd alloys: Ab initio analysis of the driving forces
J Creuze, H Guesmi, C Mottet, B Zhu, B Legrand
Surface Science 639, 48-53, 2015
292015
Combined DRIFTS and DFT study of CO adsorption and segregation modes in Pt–Sn nanoalloys
Q Wang, D Tichit, F Meunier, H Guesmi
The Journal of Physical Chemistry C 124 (18), 9979-9989, 2020
282020
CO adsorption-induced surface segregation and formation of Pd chains on AuPd (100) alloy: Density Functional Theory based Ising model and Monte Carlo simulations
B Zhu, J Creuze, C Mottet, B Legrand, H Guesmi
The Journal of Physical Chemistry C 120 (1), 350-359, 2016
282016
Density functional theory study of CO-induced segregation in gold-based alloys
M Sansa, A Dhouib, H Guesmi
The Journal of Chemical Physics 141 (6), 2014
282014
How does CO capture process on microporous NaY zeolites? A FTIR and DFT combined study
O Cairon, H Guesmi
Physical Chemistry Chemical Physics 13 (23), 11430-11437, 2011
282011
Does the S− H Bond Always Break after Adsorption of an Alkylthiol on Au (111)?
H Guesmi, NB Luque, E Santos, F Tielens
Chemistry–A European Journal 23 (6), 1402-1408, 2017
272017
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