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  Author Title Year Publication Volume Times cited Additional Links Links
Fukuhara, S.; Bal, K.M.; Neyts, E.C.; Shibuta, Y. Accelerated molecular dynamics simulation of large systems with parallel collective variable-driven hyperdynamics 2020 Computational Materials Science 177 UA library record; WoS full record; WoS citing articles pdf url doi
Neyts, E.C.; Bogaerts, A. Modeling the growth of SWNTs and graphene on the atomic scale 2012 ECS transactions 45 2 UA library record; WoS full record; WoS citing articles doi
Khalilov, U.; Neyts, E.C. Mechanisms of selective nanocarbon synthesis inside carbon nanotubes 2021 Carbon 171 UA library record; WoS full record pdf url doi
Amini, M.N.; Altantzis, T.; Lobato, I.; Grzelczak, M.; Sánchez-Iglesias, A.; Van Aert, S.; Liz-Marzán, L.M.; Partoens, B.; Bals, S.; Neyts, E.C. Understanding the Effect of Iodide Ions on the Morphology of Gold Nanorods 2018 Particle and particle systems characterization 35 6 UA library record; WoS full record; WoS citing articles url doi
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 pdf url doi
Eckert, M.; Neyts, E.; Bogaerts, A. Molecular dynamics simulations of the sticking and etch behavior of various growth species of (ultra)nanocrystalline diamond films 2008 Chemical vapor deposition 14 25 UA library record; WoS full record; WoS citing articles doi
Javdani, Z.; Hassani, N.; Faraji, F.; Zhou, R.; Sun, C.; Radha, B.; Neyts, E.; Peeters, F.M.; Neek-Amal, M. Clogging and unclogging of hydrocarbon-contaminated nanochannels 2022 The journal of physical chemistry letters 13 UA library record; WoS full record pdf url doi
Huygh, S.; Bogaerts, A.; Bal, K.M.; Neyts, E.C. High Coke Resistance of a TiO2Anatase (001) Catalyst Surface during Dry Reforming of Methane 2018 Journal Of Physical Chemistry C 122 1 UA library record; WoS full record; WoS citing articles pdf url doi
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 pdf doi
Ostrikov, K.; Neyts, E.C.; Meyyappan, M. Plasma nanoscience : from nano-solids in plasmas to nano-plasmas in solids 2013 Advances in physics 62 380 UA library record; WoS full record; WoS citing articles pdf doi
Neyts, E.C. Atomistic simulations of plasma catalytic processes 2018 Frontiers of Chemical Science and Engineering 12 5 UA library record; WoS full record; WoS citing articles pdf doi
Neyts, E.C.; Ostrikov, K.K.; Sunkara, M.K.; Bogaerts, A. Plasma Catalysis: Synergistic Effects at the Nanoscale 2015 Chemical reviews 115 204 UA library record; WoS full record; WoS citing articles pdf url doi
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 doi
Baguer, N.; Neyts, E.; van Gils, S.; Bogaerts, A. Study of atmospheric MOCVD of TiO2 thin films by means of computational fluid dynamics simulations 2008 Chemical vapor deposition 14 14 UA library record; WoS full record; WoS citing articles doi
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 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
Van de Sompel, P.; Khalilov, U.; Neyts, E.C. Contrasting H-etching to OH-etching in plasma-assisted nucleation of carbon nanotubes 2021 Journal Of Physical Chemistry C 125 UA library record; WoS full record pdf url 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
Zhang, Y.-R.; Van Laer, K.; Neyts, E.C.; Bogaerts, A. Can plasma be formed in catalyst pores? A modeling investigation 2016 Applied catalysis : B : environmental 185 75 UA library record; WoS full record; WoS citing articles pdf url doi
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 pdf url doi
Neyts, E.; Shibuta, Y.; Bogaerts, A. Bond switching regimes in nickel and nickel-carbon nanoclusters 2010 Chemical physics letters 488 20 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
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 doi
Bal, K.M.; Neyts, E.C. On the time scale associated with Monte Carlo simulations 2014 The journal of chemical physics 141 26 UA library record; WoS full record; WoS citing articles url doi
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 pdf url doi
Berdiyorov, G.R.; Khalilov, U.; Hamoudi, H.; Neyts, E.C. Effect of chemical modification on electronic transport properties of carbyne 2021 Journal Of Computational Electronics UA library record; WoS full record; WoS citing articles url doi
Khalilov, U.; Pourtois, G.; van Duin, A.C.T.; Neyts, E.C. Hyperthermal oxidation of Si(100)2x1 surfaces : effect of growth temperature 2012 The journal of physical chemistry: C : nanomaterials and interfaces 116 32 UA library record; WoS full record; WoS citing articles 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
Engelmann; Bogaerts, A.; Neyts, E.C. Thermodynamics at the nanoscale: phase diagrams of nickel-carbon nanoclusters and equilibrium constants for phase transitions 2014 Nanoscale 6 20 UA library record; WoS full record; WoS citing articles url doi
Engelmann, Y.; Bogaerts, A.; Neyts, E.C. Thermodynamics at the nanoscale : phase diagrams of nickel-carbon nanoclusters and equilibrium constants for face transitions 2014 Nanoscale 6 20 UA library record; WoS full record; WoS citing articles url doi
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