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  Author Title Year Publication Volume Times cited Additional Links Links (down)
Bal, K.M.; Neyts, E.C. Modelling molecular adsorption on charged or polarized surfaces: a critical flaw in common approaches 2018 Physical chemistry, chemical physics 20 8 UA library record; WoS full record; WoS citing articles pdf 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
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
Bal, K.M.; Neyts, E.C. Direct observation of realistic-temperature fuel combustion mechanisms in atomistic simulations 2016 Chemical science 7 22 UA library record; WoS full record; WoS citing articles pdf url doi
Dabaghmanesh, S.; Saniz, R.; Neyts, E.; Partoens, B. Sulfur-alloyed Cr2O3: a new p-type transparent conducting oxide host 2017 RSC advances 7 9 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
Van der Paal, J.; Neyts, E.C.; Verlackt, C.C.W.; Bogaerts, A. Effect of lipid peroxidation on membrane permeability of cancer and normal cells subjected to oxidative stress 2016 Chemical science 7 106 UA library record; WoS full record; WoS citing articles pdf url doi
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 pdf 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
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
Schoeters, B.; Neyts, E.C.; Khalilov, U.; Pourtois, G.; Partoens, B. Stability of Si epoxide defects in Si nanowires : a mixed reactive force field/DFT study 2013 Physical chemistry, chemical physics 15 3 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
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
Hoon Park, J.; Kumar, N.; Hoon Park, D.; Yusupov, M.; Neyts, E.C.; Verlackt, C.C.W.; Bogaerts, A.; Ho Kang, M.; Sup Uhm, H.; Ha Choi, E.; Attri, P.; A comparative study for the inactivation of multidrug resistance bacteria using dielectric barrier discharge and nano-second pulsed plasma 2015 Scientific reports 5 32 UA library record; WoS full record; WoS citing articles url doi
Marinov, D.; de Marneffe, J.-F.; Smets, Q.; Arutchelvan, G.; Bal, K.M.; Voronina, E.; Rakhimova, T.; Mankelevich, Y.; El Kazzi, S.; Nalin Mehta, A.; Wyndaele, P.-J.; Heyne, M.H.; Zhang, J.; With, P.C.; Banerjee, S.; Neyts, E.C.; Asselberghs, I.; Lin, D.; De Gendt, S. Reactive plasma cleaning and restoration of transition metal dichalcogenide monolayers 2021 npj 2D Materials and Applications 5 UA library record; WoS full record; WoS citing articles url doi
Yusupov, M.; Wende, K.; Kupsch, S.; Neyts, E.C.; Reuter, S.; Bogaerts, A. Effect of head group and lipid tail oxidation in the cell membrane revealed through integrated simulations and experiments 2017 Scientific reports 7 27 UA library record; WoS full record; WoS citing articles url doi
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 url doi
Huygh, S.; Neyts, E.C. Adsorption of C and CHx radicals on anatase (001) and the influence of oxygen vacancies 2015 The journal of physical chemistry: C : nanomaterials and interfaces 119 13 UA library record; WoS full record; WoS citing articles pdf url 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
Engelmann, Y.; van ’t Veer, K.; Gorbanev, Y.; Neyts, E.C.; Schneider, W.F.; Bogaerts, A. Plasma Catalysis for Ammonia Synthesis: A Microkinetic Modeling Study on the Contributions of Eley–Rideal Reactions 2021 Acs Sustainable Chemistry & Engineering 9 UA library record; WoS full record; WoS citing articles pdf url doi
Engelmann, Y.; Mehta, P.; Neyts, E.C.; Schneider, W.F.; Bogaerts, A. Predicted Influence of Plasma Activation on Nonoxidative Coupling of Methane on Transition Metal Catalysts 2020 Acs Sustainable Chemistry & Engineering 8 UA library record; WoS full record; WoS citing articles pdf 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
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 url doi
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 pdf url doi
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 pdf url doi
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 pdf url 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 1 UA library record; WoS full record; WoS citing articles pdf url doi
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 12 UA library record; WoS full record; WoS citing articles url doi
Bal, K.M.; Bogaerts, A.; Neyts, E.C. Ensemble-Based Molecular Simulation of Chemical Reactions under Vibrational Nonequilibrium 2020 Journal Of Physical Chemistry Letters 11 UA library record; WoS full record; WoS citing articles pdf url 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
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