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Author Title Year Publication Volume Times cited Additional Links
Heyne, M.H.; de Marneffe, J.-F.; Nuytten, T.; Meersschaut, J.; Conard, T.; Caymax, M.; Radu, I.; Delabie, A.; Neyts, E.C.; De Gendt, S. The conversion mechanism of amorphous silicon to stoichiometric WS2 2018 Journal of materials chemistry C : materials for optical and electronic devices 6 4 UA library record; WoS full record; WoS citing articles
Kovács, A.; Billen, P.; Cornet, I.; Wijnants, M.; Neyts, E.C. Modeling the physicochemical properties of natural deep eutectic solvents : a review 2020 Chemsuschem 13 UA library record; WoS full record; WoS citing articles
Nematollahi, P.; Neyts, E.C. Distribution pattern of metal atoms in bimetal-doped pyridinic-N₄ pores determines their potential for electrocatalytic N₂ reduction 2022 Journal Of Physical Chemistry A 126 UA library record; WoS full record
Neyts, E.C.; Bogaerts, A. Numerical study of the size-dependent melting mechanisms of nickel nanoclusters 2009 The journal of physical chemistry: C : nanomaterials and interfaces 113 UA library record; WoS full record; WoS citing articles
Khalilov, U.; Pourtois, G.; van Duin, A.C.T.; Neyts, E.C. Self-limiting oxidation in small-diameter Si nanowires 2012 Chemistry of materials 24 45 UA library record; WoS full record; WoS citing articles
Wang, Z.; Zhang, Y.; Neyts, E.C.; Cao, X.; Zhang, X.; Jang, B.W.-L.; Liu, C.-jun Catalyst preparation with plasmas : how does it work? 2018 ACS catalysis 8 81 UA library record; WoS full record; WoS citing articles
Neyts, E.C.; Thijsse, B.J.; Mees, M.J.; Bal, K.M.; Pourtois, G. Establishing uniform acceptance in force biased Monte Carlo simulations 2012 Journal of chemical theory and computation 8 20 UA library record; WoS full record; WoS citing articles
Nematollahi, P.; Neyts, E.C. Linking bi-metal distribution patterns in porous carbon nitride fullerene to its catalytic activity toward gas adsorption 2021 Nanomaterials 11 UA library record; WoS full record; WoS citing articles
Yi, Y.; Wang, X.; Jafarzadeh, A.; Wang, L.; Liu, P.; He, B.; Yan, J.; Zhang, R.; Zhang, H.; Liu, X.; Guo, H.; Neyts, E.C.; Bogaerts, A. Plasma-Catalytic Ammonia Reforming of Methane over Cu-Based Catalysts for the Production of HCN and H2at Reduced Temperature 2021 Acs Catalysis 11 UA library record; WoS full record; WoS citing articles
Khalilov, U.; Bogaerts, A.; Xu, B.; Kato, T.; Kaneko, T.; Neyts, E.C. How the alignment of adsorbed ortho H pairs determines the onset of selective carbon nanotube etching 2017 Nanoscale 9 6 UA library record; WoS full record; WoS citing articles
Cui, Z.; Meng, S.; Yi, Y.; Jafarzadeh, A.; Li, S.; Neyts, E.C.; Hao, Y.; Li, L.; Zhang, X.; Wang, X.; Bogaerts, A. Plasma-catalytic methanol synthesis from CO₂ hydrogenation over a supported Cu cluster catalyst : insights into the reaction mechanism 2022 Acs Catalysis 12 UA library record; WoS full record; WoS citing articles
Neyts, E.C.; Bogaerts, A. Combining molecular dynamics with Monte Carlo simulations : implementations and applications 2013 Theoretical chemistry accounts : theory, computation, and modeling 132 27 UA library record; WoS full record; WoS citing articles
Heyne, M.H.; Chiappe, D.; Meersschaut, J.; Nuytten, T.; Conard, T.; Bender, H.; Huyghebaert, C.; Radu, I.P.; Caymax, M.; de Marneffe, J.F.; Neyts, E.C.; De Gendt, S.; Multilayer MoS2 growth by metal and metal oxide sulfurization 2016 Journal of materials chemistry C : materials for optical and electronic devices 4 UA library record; WoS full record; WoS citing articles
Neyts, E.C.; van Duin, A.C.T.; Bogaerts, A. Insights in the plasma-assisted growth of carbon nanotubes through atomic scale simulations : effect of electric field 2012 Journal of the American Chemical Society 134 56 UA library record; WoS full record; WoS citing articles
Bogaerts, A.; Yusupov, M.; Van der Paal, J.; Verlackt, C.C.W.; Neyts, E.C. Reactive molecular dynamics simulations for a better insight in plasma medicine 2014 Plasma processes and polymers 11 22 UA library record; WoS full record; WoS citing articles
Neyts, E.C.; Bogaerts, A. Formation of endohedral Ni@C60 and exohedral NiC60 metallofullerene complexes by simulated ion implantation 2009 Carbon 47 15 UA library record; WoS full record; WoS citing articles
Bogaerts, A.; Neyts, E.C. Plasma Technology: An Emerging Technology for Energy Storage 2018 ACS energy letters 3 56 UA library record; WoS full record; WoS citing articles
Nematollahi, P.; Neyts, E.C. A comparative DFT study on CO oxidation reaction over Si-doped BC2N nanosheet and nanotube 2018 Applied surface science 439 8 UA library record; WoS full record; WoS citing articles
Yusupov, M.; Van der Paal, J.; Neyts, E.C.; Bogaerts, A. Synergistic effect of electric field and lipid oxidation on the permeability of cell membranes 2017 Biochimica et biophysica acta : G : general subjects 1861 UA library record; WoS full record; WoS citing articles
Fukuhara, S.; Bal, K.M.; Neyts, E.C.; Shibuta, Y. Entropic and enthalpic factors determining the thermodynamics and kinetics of carbon segregation from transition metal nanoparticles 2021 Carbon 171 UA library record; WoS full record; WoS citing articles
Khalilov, U.; Bogaerts, A.; Neyts, E.C. Toward the Understanding of Selective Si Nano-Oxidation by Atomic Scale Simulations 2017 Accounts of chemical research 50 5 UA library record; WoS full record; WoS citing articles
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
Neyts, E.C.; Bogaerts, A. Ion irradiation for improved graphene network formation in carbon nanotube growth 2014 Carbon 77 7 UA library record; WoS full record; WoS citing articles
Khalilov, U.; Pourtois, G.; Bogaerts, A.; van Duin, A.C.T.; Neyts, E.C. Reactive molecular dynamics simulations on SiO2-coated ultra-small Si-nanowires 2013 Nanoscale 5 17 UA library record; WoS full record; WoS citing articles
Somers, W.; Dubreuil, M.F.; Neyts, E.C.; Vangeneugden, D.; Bogaerts, A. Incorporation of fluorescent dyes in atmospheric pressure plasma coatings for in-line monitoring of coating homogeneity 2014 Plasma processes and polymers 11 3 UA library record; WoS full record; WoS citing articles
Khalilov, U.; Vets, C.; Neyts, E.C. Molecular evidence for feedstock-dependent nucleation mechanisms of CNTs 2019 Nanoscale Horizons 4 1 UA library record; WoS full record; WoS citing articles
Khalilov, U.; Uljayev, U.; Mehmonov, K.; Nematollahi, P.; Yusupov, M.; Neyts, E.C.; Neyts, E.C. Can endohedral transition metals enhance hydrogen storage in carbon nanotubes? 2024 International journal of hydrogen energy 55 UA library record; WoS full record; WoS citing articles
Shirazi, M.; Neyts, E.C.; Bogaerts, A. DFT study of Ni-catalyzed plasma dry reforming of methane 2017 Applied catalysis : B : environmental 205 26 UA library record; WoS full record; WoS citing articles
Huygh, S.; Bogaerts, A.; van Duin, A.C.T.; Neyts, E.C. Development of a ReaxFF reactive force field for intrinsic point defects in titanium dioxide 2014 Computational materials science 95 15 UA library record; WoS full record; WoS citing articles
Aussems, D.U.B.; Bal, K.M.; Morgan, T.W.; van de Sanden, M.C.M.; Neyts, E.C. Mechanisms of elementary hydrogen ion-surface interactions during multilayer graphene etching at high surface temperature as a function of flux 2018 Carbon 137 4 UA library record; WoS full record; WoS citing articles