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  Author Title Year Publication Volume Times cited Additional Links Links
Yusupov, M.; Neyts, E.C.; Khalilov, U.; Snoeckx, R.; van Duin, A.C.T.; Bogaerts, A. Atomic-scale simulations of reactive oxygen plasma species interacting with bacterial cell walls 2012 New journal of physics 14 47 UA library record; WoS full record; WoS citing articles url doi
Neyts, E.C.; Ostrikov, K.; Han, Z.J.; Kumar, S.; van Duin, A.C.T.; Bogaerts, A. Defect healing and enhanced nucleation of carbon nanotubes by low-energy ion bombardment 2013 Physical review letters 110 50 UA library record; WoS full record; WoS citing articles url doi
Zhang, Y.-R.; Neyts, E.C.; Bogaerts, A. Enhancement of plasma generation in catalyst pores with different shapes 2018 Plasma sources science and technology 27 11 UA library record; WoS full record; WoS citing articles pdf url doi
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 pdf url doi
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 pdf url
Bruggeman, P.J.; Kushner, M.J.; Locke, B.R.; Gardeniers, J.G.E.; Graham, W.G.; Graves, D.B.; Hofman-Caris, R.C.H.M.; Maric, D.; Reid, J.P.; Ceriani, E.; Fernandez Rivas, D.; Foster, J.E.; Garrick, S.C.; Gorbanev, Y.; Hamaguchi, S.; Iza, F.; Jablonowski, H.; Klimova, E.; Kolb, J.; Krcma, F.; Lukes, P.; Machala, Z.; Marinov, I.; Mariotti, D.; Mededovic Thagard, S.; Minakata, D.; Neyts, E.C.; Pawlat, J.; Petrovic, Z.L.; Pflieger, R.; Reuter, S.; Schram, D.C.; Schröter, S.; Shiraiwa, M.; Tarabová, B.; Tsai, P.A.; Verlet, J.R.R.; von Woedtke, T.; Wilson, K.R.; Yasui, K.; Zvereva, G. Plasma–liquid interactions: a review and roadmap 2016 Plasma sources science and technology 25 460 UA library record; WoS full record; WoS citing articles url doi
Van der Paal, J.; Verheyen, C.; Neyts, E.C.; Bogaerts, A. Hampering Effect of Cholesterol on the Permeation of Reactive Oxygen Species through Phospholipids Bilayer: Possible Explanation for Plasma Cancer Selectivity 2017 Scientific reports 7 27 UA library record; WoS full record; WoS citing articles pdf url doi
Grubova, I.Y.; Surmeneva, M.A.; Surmenev, R.A.; Neyts, E.C. Effect of van der Waals interactions on the adhesion strength at the interface of the hydroxyapatite-titanium biocomposite : a first-principles study 2020 RSC advances 10 UA library record; WoS full record; WoS citing articles url doi
Heyne, M.H.; Marinov, D.; Braithwaite, N.; Goodyear, A.; de Marneffe, J.-F.; Cooke, M.; Radu, I.; Neyts, E.C.; De Gendt, S. A route towards the fabrication of 2D heterostructures using atomic layer etching combined with selective conversion 2019 2D materials 6 UA library record; WoS full record; WoS citing articles pdf doi
Gogoi, A.; Neyts, E.C.; Milošević, M.V.; Peeters, F.M. Arresting aqueous swelling of layered graphene-oxide membranes with H3O+ and OH- ions 2022 ACS applied materials and interfaces 14 9 UA library record; WoS full record; WoS citing articles pdf url doi
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 doi
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 doi
Neyts, E.C. PECVD growth of carbon nanotubes : from experiment to simulation 2012 Journal of vacuum science and technology: B: micro-electronics processing and phenomena 30 42 UA library record; WoS full record; WoS citing articles pdf doi
Tinck, S.; Neyts, E.C.; Bogaerts, A. Fluorinesilicon surface reactions during cryogenic and near room temperature etching 2014 The journal of physical chemistry: C : nanomaterials and interfaces 118 11 UA library record; WoS full record; WoS citing articles url doi
Khosravian, N.; Bogaerts, A.; Huygh, S.; Yusupov, M.; Neyts, E.C. How do plasma-generated OH radicals react with biofilm components? Insights from atomic scale simulations 2015 Biointerphases 10 10 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
Zhang, Y.-R.; Neyts, E.C.; Bogaerts, A. Influence of the Material Dielectric Constant on Plasma Generation inside Catalyst Pores 2016 The journal of physical chemistry: C : nanomaterials and interfaces 120 34 UA library record; WoS full record; WoS citing articles pdf url doi
Yusupov, M.; Neyts, E.C.; Simon, P.; Berdiyorov, G.; Snoeckx, R.; van Duin, A.C.T.; Bogaerts, A. Reactive molecular dynamics simulations of oxygen species in a liquid water layer of interest for plasma medicine 2014 Journal of physics: D: applied physics 47 51 UA library record; WoS full record; WoS citing articles pdf doi
Khalilov, U.; Neyts, E.C.; Pourtois, G.; van Duin, A.C.T. Can we control the thickness of ultrathin silica layers by hyperthermal silicon oxidation at room temperature? 2011 The journal of physical chemistry: C : nanomaterials and interfaces 115 36 UA library record; WoS full record; WoS citing articles doi
Bal, K.M.; Huygh, S.; Bogaerts, A.; Neyts, E.C. Effect of plasma-induced surface charging on catalytic processes: application to CO2activation 2018 Plasma sources science and technology 27 19 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
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
Khalilov, U.; Pourtois, G.; van Duin, A.C.T.; Neyts, E.C. On the c-Si\mid a-SiO2 interface in hyperthermal Si oxidation at room temperature 2012 The journal of physical chemistry: C : nanomaterials and interfaces 116 27 UA library record; WoS full record; WoS citing articles doi
Huygh, S.; Bogaerts, A.; Neyts, E.C. How Oxygen Vacancies Activate CO2 Dissociation on TiO2 Anatase (001) 2016 The journal of physical chemistry: C : nanomaterials and interfaces 120 49 UA library record; WoS full record; WoS citing articles pdf url doi
Somers, W.; Bogaerts, A.; van Duin, A.C.T.; Neyts, E.C. Plasma species interacting with nickel surfaces : toward an atomic scale understanding of plasma-catalysis 2012 The journal of physical chemistry: C : nanomaterials and interfaces 116 37 UA library record; WoS full record; WoS citing articles pdf doi
Khosravian, N.; Kamaraj, B.; Neyts, E.C.; Bogaerts, A. Structural modification of P-glycoprotein induced by OH radicals: Insights from atomistic simulations 2016 Scientific reports 6 7 UA library record; WoS full record; WoS citing articles url 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
Nematollahi, P.; Ma, H.; Schneider, W.F.; Neyts, E.C. DFT and microkinetic comparison of ru-doped porphyrin-like graphene and nanotubes toward catalytic formic acid decomposition and formation 2021 Journal Of Physical Chemistry C 125 UA library record; WoS full record; WoS citing articles pdf url doi
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 pdf doi
Grubova, I.Y.; Surmeneva, M.A.; Huygh, S.; Surmenev, R.A.; Neyts, E.C. Density functional theory study of interface interactions in hydroxyapatite/rutile composites for biomedical applications 2017 The journal of physical chemistry: C : nanomaterials and interfaces 121 5 UA library record; WoS full record; WoS citing articles doi
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