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Author Title Year Publication Volume Times cited Additional Links
Eckert, M.; Neyts, E.; Bogaerts, A. On the reaction behaviour of hydrocarbon species at diamond (1 0 0) and (1 1 1) surfaces: a molecular dynamics investigation 2008 Journal of physics: D: applied physics 41 17 UA library record; WoS full record; WoS citing articles
Neyts, E.; Bogaerts, A.; van de Sanden, M.C.M. Densification of thin a-C: H films grown from low-kinetic energy hydrocarbon radicals under the influence of H and C particle fluxes: a molecular dynamics study 2006 Journal of physics: D: applied physics 39 3 UA library record; WoS full record; WoS citing articles
Bogaerts, A.; Khosravian, N.; Van der Paal, J.; Verlackt, C.C.W.; Yusupov, M.; Kamaraj, B.; Neyts, E.C. Multi-level molecular modelling for plasma medicine 2016 Journal of physics: D: applied physics 49 11 UA library record; WoS full record; WoS citing articles
Tinck, S.; Tillocher, T.; Dussart, R.; Neyts, E.C.; Bogaerts, A. Elucidating the effects of gas flow rate on an SF6inductively coupled plasma and on the silicon etch rate, by a combined experimental and theoretical investigation 2016 Journal of physics: D: applied physics 49 1 UA library record; WoS full record; WoS citing articles
Verlackt, C.C.W.; Neyts, E.C.; Bogaerts, A. Atomic scale behavior of oxygen-based radicals in water 2017 Journal of physics: D: applied physics 50 11 UA library record; WoS full record; WoS citing articles
Bogaerts, A.; Khosravian, N.; Van der Paal, J.; Verlackt, C.C.W.; Yusupov, M.; Kamaraj, B.; Neyts, E.C. Multi-level molecular modelling for plasma medicine 2016 Journal Of Physics D-Applied Physics 49 UA library record
Khalilov, U.; Bogaerts, A.; Hussain, S.; Kovacevic, E.; Brault, P.; Boulmer-Leborgne, C.; Neyts, E.C. Nanoscale mechanisms of CNT growth and etching in plasma environment 2017 Journal of physics: D: applied physics 50 6 UA library record; WoS full record; WoS citing articles
Bal, K.M.; Neyts, E.C. Quantifying the impact of vibrational nonequilibrium in plasma catalysis: insights from a molecular dynamics model of dissociative chemisorption 2021 Journal Of Physics D-Applied Physics 54 UA library record; WoS full record; WoS citing articles
Liu, Y.H.; Neyts, E.; Bogaerts, A. Monte Carlo method for simulations of adsorbed atom diffusion on a surface 2006 Diamond and related materials 15 5 UA library record; WoS full record; WoS citing articles
Neyts, E.; Tacq, M.; Bogaerts, A. Reaction mechanisms of low-kinetic energy hydrocarbon radicals on typical hydrogenated amorphous carbon (a-C:H) sites: a molecular dynamics study 2006 Diamond and related materials 15 18 UA library record; WoS full record; WoS citing articles
Neyts, E.; Bogaerts, A.; Gijbels, R.; Benedikt, J.; van den Sanden, M.C.M. Molecular dynamics simulations for the growth of diamond-like carbon films from low kinetic energy species 2004 Diamond and related materials 13 53 UA library record; WoS full record; WoS citing articles
Faraji, F.; Neek-Amal, M.; Neyts, E.C.; Peeters, F.M. Cation-controlled permeation of charged polymers through nanocapillaries 2023 Physical review E 107 1 UA library record; WoS full record; WoS citing articles
Neyts, E.; Eckert, M.; Mao, M.; Bogaerts, A. Numerical simulation of hydrocarbon plasmas for nanoparticle formation and the growth of nanostructured thin films 2009 Plasma physics and controlled fusion 51 2 UA library record; WoS full record; WoS citing articles
Neyts, E.C. Plasma-Surface Interactions in Plasma Catalysis 2016 Plasma chemistry and plasma processing 36 66 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
Grubova, I.Y.; Surmeneva, M.A.; Huygh, S.; Surmenev, R.A.; Neyts, E.C. Effects of silicon doping on strengthening adhesion at the interface of the hydroxyapatite-titanium biocomposite : a first-principles study 2019 Computational materials science 159 1 UA library record; WoS full record; WoS citing articles
Gou, F.; Neyts, E.; Eckert, M.; Tinck, S.; Bogaerts, A. Molecular dynamics simulations of Cl+ etching on a Si(100) surface 2010 Journal of applied physics 107 15 UA library record; WoS full record; WoS citing articles
Neyts, E.; Bogaerts, A.; van de Sanden, M.C.M. Unraveling the deposition mechanism in a-C:H thin-film growth: a molecular-dynamics study for the reaction behavior of C3 and C3H radicals with a-C:H surfaces 2006 Journal of applied physics 99 25 UA library record; WoS full record; WoS citing articles
Neyts, E.; Yan, M.; Bogaerts, A.; Gijbels, R. Particle-in-cell/Monte Carlo simulations of a low-pressure capacitively coupled radio-frequency discharge: effect of adding H2 to an Ar discharge 2003 Journal of applied physics 93 15 UA library record; WoS full record; WoS citing articles
Nematollahi, P.; Esrafili, M.D.; Neyts, E.C. The role of healed N-vacancy defective BC2N sheet and nanotube by NO molecule in oxidation of NO and CO gas molecules 2018 Surface science : a journal devoted to the physics and chemistry of interfaces 672-673 1 UA library record; WoS full record; WoS citing articles
Neyts, E.C.; Shibuta, Y.; van Duin, A.C.T.; Bogaerts, A. Catalyzed growth of carbon nanotube with definable chirality by hybrid molecular dynamics-force biased Monte Carlo simulations 2010 ACS nano 4 129 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
Neyts, E.C.; van Duin, A.C.T.; Bogaerts, A. Changing chirality during single-walled carbon nanotube growth : a reactive molecular dynamics/Monte Carlo study 2011 Journal of the American Chemical Society 133 116 UA library record; WoS full record; WoS citing articles
Nematollahi, P.; Barbiellini, B.; Bansil, A.; Lamoen, D.; Qingying, J.; Mukerjee, S.; Neyts, E.C. Identification of a Robust and Durable FeN4CxCatalyst for ORR in PEM Fuel Cells and the Role of the Fifth Ligand 2022 ACS catalysis UA library record; WoS full 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
Villarreal, R.; Lin, P.-C.; Faraji, F.; Hassani, N.; Bana, H.; Zarkua, Z.; Nair, M.N.; Tsai, H.-C.; Auge, M.; Junge, F.; Hofsaess, H.C.; De Gendt, S.; De Feyter, S.; Brems, S.; Ahlgren, E.H.; Neyts, E.C.; Covaci, L.; Peeters, F.M.; Neek-Amal, M.; Pereira, L.M.C. Breakdown of universal scaling for nanometer-sized bubbles in graphene 2021 Nano Letters 21 24 UA library record; WoS full record; WoS citing articles
Chernozem, R., V; Romanyuk, K.N.; Grubova, I.; Chernozem, P., V.; Surmeneva, M.A.; Mukhortova, Y.R.; Wilhelm, M.; Ludwig, T.; Mathur, S.; Kholkin, A.L.; Neyts, E.; Parakhonskiy, B.; Skirtach, A.G.; Surmenev, R.A. Enhanced piezoresponse and surface electric potential of hybrid biodegradable polyhydroxybutyrate scaffolds functionalized with reduced graphene oxide for tissue engineering 2021 Nano Energy 89 UA library record; WoS full record; WoS citing articles
Khalilov, U.; Bogaerts, A.; Neyts, E.C. Atomic scale simulation of carbon nanotube nucleation from hydrocarbon precursors 2015 Nature communications 6 37 UA library record; WoS full record; WoS citing articles
Faraji, F.; Neyts, E.C.; Milošević, M.V.; Peeters, F.M. Capillary Condensation of Water in Graphene Nanocapillaries 2024 Nano Letters 24
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