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  Author Title Year Publication Volume Times cited Additional Links Links
Lamonier, J.-F.; Bogaerts, A. Feature Papers to Celebrate “Environmental Catalysis”—Trends & Outlook 2022 Catalysts 12 UA library record; WoS full record pdf url doi
Oliveira, M.C.; Cordeiro, R.M.; Bogaerts, A. Effect of lipid oxidation on the channel properties of Cx26 hemichannels : a molecular dynamics study 2023 Archives of biochemistry and biophysics 746 UA library record; WoS full record pdf url doi
Rezaei, M.; Ghasemitarei, M.; Razzokov, J.; Yusupov, M.; Ghorbanalilu, M.; Ejtehadi, M.R. In silico study of the impact of oxidation on pyruvate transmission across the hVDAC1 protein channel 2024 Archives of biochemistry and biophysics 751 UA library record; WoS full record pdf doi
Bathula, G.; Rana, S.; Bandalla, S.; Dosarapu, V.; Mavurapu, S.; Rajeevan, V.V.A.; Sharma, B.; Jonnalagadda, S.B.; Baithy, M.; Vasam, C.S. The role of WOx and dopants (ZrO₂ and SiO₂) on CeO₂-based nanostructure catalysts in the selective oxidation of benzyl alcohol to benzaldehyde under ambient conditions 2023 RSC advances 13 UA library record; WoS full record url doi
Guo, J.; Clima, S.; Pourtois, G.; Van Houdt, J. Identifying alternative ferroelectric materials beyond Hf(Zr)O-₂ 2020 Applied Physics Letters 117 UA library record; WoS full record; WoS citing articles doi
Eckert, M.; Neyts, E.; Bogaerts, A. Differences between ultrananocrystalline and nanocrystalline diamond growth: theoretical investigation of CxHy species at diamond step edges 2010 Crystal growth & design 10 11 UA library record; WoS full record; WoS citing articles doi
Eckert, M.; Neyts, E.; Bogaerts, A. Insights into the growth of (ultra)nanocrystalline diamond by combined molecular dynamics and Monte Carlo simulations 2010 Crystal growth & design 10 13 UA library record; WoS full record; WoS citing articles doi
Georgieva, V.; Voter, A.F.; Bogaerts, A. Understanding the surface diffusion processes during magnetron sputter-deposition of complex oxide Mg-Al-O thin films 2011 Crystal growth & design 11 14 UA library record; WoS full record; WoS citing articles doi
Almohammadi, G.; O'Modhrain, C.; Kelly, S.; Sullivan, J.A. Ti-doped SBA-15 catalysts used in phenol oxidation reactions 2020 ACS Omega 5 UA library record; WoS full record; WoS citing articles url doi
Grubova, I.Y.; Surmenev, R.A.; Neyts, E.C.; Koptyug, A.V.; Volkova, A.P.; Surmeneva, M.A. Combined first-principles and experimental study on the microstructure and mechanical characteristics of the multicomponent additive-manufactured Ti-35Nb-7Zr-5Ta alloy 2023 ACS Omega 8 UA library record; WoS full record; WoS citing articles url doi
Houssa, M.; van den Broek, B.; Scalise, E.; Pourtois, G.; Afanas'ev, V.V.; Stesmans, A. An electric field tunable energy band gap at silicene/(0001) ZnS interfaces 2013 Physical chemistry, chemical physics 15 74 UA library record; WoS full record; WoS citing articles pdf doi
Neyts, E.; Bogaerts, A. Influence of internal energy and impact angle on the sticking behaviour of reactive radicals in thin a-C:H film growth: a molecular dynamics study 2006 Physical chemistry, chemical physics 8 7 UA library record; WoS full record; WoS citing articles doi
Schoeters, B.; Neyts, E.C.; Khalilov, U.; Pourtois, G.; Partoens, B. Stability of Si epoxide defects in Si nanowires : a mixed reactive force field/DFT study 2013 Physical chemistry, chemical physics 15 3 UA library record; WoS full record; WoS citing articles url doi
Ali, S.; Myasnichenko, V.S.; Neyts, E.C. Size-dependent strain and surface energies of gold nanoclusters 2016 Physical chemistry, chemical physics 18 37 UA library record; WoS full record; WoS citing articles pdf url doi
Dabaghmanesh, S.; Neyts, E.C.; Partoens, B. van der Waals density functionals applied to corundum-type sesquioxides : bulk properties and adsorption of CH3 and C6H6 on (0001) surfaces 2016 Physical chemistry, chemical physics 18 6 UA library record; WoS full record; WoS citing articles pdf doi
Mees, M.J.; Pourtois, G.; Rosciano, F.; Put, B.; Vereecken, P.M.; Stesmans, A. First-principles material modeling of solid-state electrolytes with the spinel structure 2014 Physical chemistry, chemical physics 8 UA library record; WoS full record; WoS citing articles doi
Shirazi, M.; Bogaerts, A.; Neyts, E.C. A DFT study of H-dissolution into the bulk of a crystalline Ni(111) surface: a chemical identifier for the reaction kinetics 2017 Physical chemistry, chemical physics 19 10 UA library record; WoS full record; WoS citing articles pdf url doi
Dabaghmanesh, S.; Sarmadian, N.; Neyts, E.C.; Partoens, B. A first principles study of p-type defects in LaCrO3 2017 Physical chemistry, chemical physics 19 16 UA library record; WoS full record; WoS citing articles url doi
Momot, A.; Amini, M.N.; Reekmans, G.; Lamoen, D.; Partoens, B.; Slocombe, D.R.; Elen, K.; Adriaensens, P.; Hardy, A.; Van Bael, M.K. A novel explanation for the increased conductivity in annealed Al-doped ZnO: an insight into migration of aluminum and displacement of zinc 2017 Physical chemistry, chemical physics 19 26 UA library record; WoS full record; WoS citing articles pdf url doi
Gorbanev, Y.; Verlackt, C.C.W.; Tinck, S.; Tuenter, E.; Foubert, K.; Cos, P.; Bogaerts, A. Combining experimental and modelling approaches to study the sources of reactive species induced in water by the COST RF plasma jet 2018 Physical chemistry, chemical physics 20 23 UA library record; WoS full record; WoS citing articles pdf url doi
Verlackt, C.C.W.; Van Boxem, W.; Bogaerts, A. Transport and accumulation of plasma generated species in aqueous solution 2018 Physical chemistry, chemical physics 20 35 UA library record; WoS full record; WoS citing articles pdf url doi
Bal, K.M.; Neyts, E.C. Modelling molecular adsorption on charged or polarized surfaces: a critical flaw in common approaches 2018 Physical chemistry, chemical physics 20 8 UA library record; WoS full record; WoS citing articles pdf url doi
Gorbanev, Y.; Van der Paal, J.; Van Boxem, W.; Dewilde, S.; Bogaerts, A. Reaction of chloride anion with atomic oxygen in aqueous solutions: can cold plasma help in chemistry research? 2019 Physical chemistry, chemical physics 21 4 UA library record; WoS full record; WoS citing articles pdf url doi
Dabral, A.; Lu, A.K.A.; Chiappe, D.; Houssa, M.; Pourtois, G. A systematic study of various 2D materials in the light of defect formation and oxidation 2019 Physical chemistry, chemical physics 21 1 UA library record; WoS full record; WoS citing articles pdf doi
de Aquino, B.R.H.; Ghorbanfekr-Kalashami, H.; Neek-Amal, M.; Peeters, F.M. Ionized water confined in graphene nanochannels 2019 Physical chemistry, chemical physics 21 9 UA library record; WoS full record; WoS citing articles pdf doi
Van der Paal, J.; Hong, S.-H.; Yusupov, M.; Gaur, N.; Oh, J.-S.; Short, R.D.; Szili, E.J.; Bogaerts, A. How membrane lipids influence plasma delivery of reactive oxygen species into cells and subsequent DNA damage : an experimental and computational study 2019 Physical chemistry, chemical physics 21 1 UA library record; WoS full record; WoS citing articles url doi
Heirman, P.; Van Boxem, W.; Bogaerts, A. Reactivity and stability of plasma-generated oxygen and nitrogen species in buffered water solution: a computational study 2019 Physical chemistry, chemical physics 21 7 UA library record; WoS full record; WoS citing articles pdf doi
Izadi, M.E.; Bal, K.M.; Maghari, A.; Neyts, E.C. Reaction mechanisms of C(3PJ) and C+(2PJ) with benzene in the interstellar medium from quantum mechanical molecular dynamics simulations 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles url doi
Janssens, K.; Bogaerts, A.; van Grieken, R. Colloquium Spectroscopicum Internationale 34, Antwerp, Belgium, 4-9 September 2005: preface 2006 Talanta : the international journal of pure and applied analytical chemistry 70 UA library record; WoS full record doi
Mueller, G.; Stahnke, F.; Bleiner, D. Fast steel-cleanness characterization by means of laser-assisted plasma spectrometric methods 2006 Talanta : the international journal of pure and applied analytical chemistry T2 – 34th Colloquium Spectroscopicum Internationale, SEP 04-09, 2005, Univ Antwerp, Antwerp, BELGIUM 12 UA library record; WoS full record; WoS citing articles pdf doi
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