| 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 | 195 | 2012 |
| 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 | 116 | 2013 |
| 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 | 88 | 2020 |
| 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 | 68 | 2012 |
| 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 | 67 | 2012 |
| 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 | 58 | 2008 |
| 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 | 56 | 2019 |
| 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 | 50 | 2014 |
| 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 | 46 | 2011 |
| 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 | 40 | 2016 |
| 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 | 38 | 2014 |
| 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 | 37 | 2020 |
| 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 | 35 | 2010 |
| 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 | 33 | 2015 |
| 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 | 31 | 2017 |
| 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 | 31 | 2015 |
| 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 | 30 | 2016 |
| 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 | 29 | 2016 |
| 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 | 28 | 2014 |
| Theoretical insights on the effect of reactive gas on the chemical ordering of gold-based alloys H Guesmi Gold Bulletin 46, 213-219, 2013 | 28 | 2013 |
Frederik TielensVrije Universiteit BrusselVerified email at vub.be