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Author Title Year Publication Volume Times cited Additional Links
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
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
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
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
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
Dumpala, S.; Broderick, S.R.; Khalilov, U.; Neyts, E.C.; van Duin, A.C.T.; Provine, J.; Howe, R.T.; Rajan, K. Integrated atomistic chemical imaging and reactive force field molecular dynamic simulations on silicon oxidation 2015 Applied physics letters 106 19 UA library record; WoS full record; WoS citing articles
Khalilov, U.; Bogaerts, A.; Neyts, E.C. Atomic-scale mechanisms of plasma-assisted elimination of nascent base-grown carbon nanotubes 2017 Carbon 118 2 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
Khalilov, U.; Vets, C.; Neyts, E.C. Catalyzed growth of encapsulated carbyne 2019 Carbon 153 UA library record; WoS full record; WoS citing articles
Khalilov, U.; Neyts, E.C. Mechanisms of selective nanocarbon synthesis inside carbon nanotubes 2021 Carbon 171 UA library record; WoS full record
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
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
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
Shariat, M.; Hosseini, S.I.; Shokri, B.; Neyts, E.C. Plasma enhanced growth of single walled carbon nanotubes at low temperature : a reactive molecular dynamics simulation 2013 Carbon 65 21 UA library record; WoS full record; WoS citing articles
Dabaghmanesh, S.; Neek-Amal, M.; Partoens, B.; Neyts, E.C. The formation of Cr2O3 nanoclusters over graphene sheet and carbon nanotubes 2017 Chemical physics letters 687 2 UA library record; WoS full record; WoS citing articles
Shariat, M.; Shokri, B.; Neyts, E.C. On the low-temperature growth mechanism of single walled carbon nanotubes in plasma enhanced chemical vapor deposition 2013 Chemical physics letters 590 14 UA library record; WoS full record; WoS citing articles
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
Bal, K.M.; Fukuhara, S.; Shibuta, Y.; Neyts, E.C. Free energy barriers from biased molecular dynamics simulations 2020 Journal Of Chemical Physics 153 UA library record; WoS full record; WoS citing articles
Bal, K.M.; Neyts, E.C. Extending and validating bubble nucleation rate predictions in a Lennard-Jones fluid with enhanced sampling methods and transition state theory 2022 Journal Of Chemical Physics 157 UA library record; WoS full record; WoS citing articles
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
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
Neyts, E.C.; Yusupov, M.; Verlackt, C.C.; Bogaerts, A. Computer simulations of plasmabiomolecule and plasmatissue interactions for a better insight in plasma medicine 2014 Journal of physics: D: applied physics 47 28 UA library record; WoS full record; WoS citing articles
Van der Paal, J.; Aernouts, S.; van Duin, A.C.T.; Neyts, E.C.; Bogaerts, A. Interaction of O and OH radicals with a simple model system for lipids in the skin barrier : a reactive molecular dynamics investigation for plasma medicine 2013 Journal of physics: D: applied physics 46 36 UA library record; WoS full record; WoS citing articles
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
Bogaerts, A.; Neyts, E.C.; Rousseau, A. Special issue on fundamentals of plasmasurface interactions 2014 Journal of physics: D: applied physics 47 2 UA library record; WoS full record; WoS citing articles