|
Author |
Title |
Year |
Publication |
Volume |
Times cited |
Additional Links |
Links |
|
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 |
|
|
Izadi, M.E.; Bal, K.M.; Maghari, A.; Neyts, E.C. |
Reaction mechanisms of C(3PJ) and C+(2PJ) with benzene in the interstellar medium from quantum mechanical molecular dynamics simulations |
2021 |
Physical Chemistry Chemical Physics |
23 |
|
UA library record; WoS full record; WoS citing articles |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
Khalilov, U.; Neyts, E.C. |
Mechanisms of selective nanocarbon synthesis inside carbon nanotubes |
2021 |
Carbon |
171 |
|
UA library record; WoS full record |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
Jafarzadeh, A.; Bal, K.M.; Bogaerts, A.; Neyts, E.C. |
Activation of CO2on Copper Surfaces: The Synergy between Electric Field, Surface Morphology, and Excess Electrons |
2020 |
Journal Of Physical Chemistry C |
124 |
|
UA library record; WoS full record; WoS citing articles |
|
|
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 |
|
|
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 |
|
|
Khalilov, U.; Vets, C.; Neyts, E.C. |
Catalyzed growth of encapsulated carbyne |
2019 |
Carbon |
153 |
|
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 |
|
|
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 |
|
|
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 |
|
|
Heyne, M.H.; de Marneffe, J.-F.; Nuytten, T.; Meersschaut, J.; Conard, T.; Caymax, M.; Radu, I.; Delabie, A.; Neyts, E.C.; De Gendt, S. |
The conversion mechanism of amorphous silicon to stoichiometric WS2 |
2018 |
Journal of materials chemistry C : materials for optical and electronic devices |
6 |
4 |
UA library record; WoS full record; WoS citing articles |
|
|
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 |
|
|
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 |
|
|
Razzokov, J.; Yusupov, M.; Vanuytsel, S.; Neyts, E.C.; Bogaerts, A. |
Phosphatidylserine flip-flop induced by oxidation of the plasma membrane: a better insight by atomic scale modeling |
2017 |
Plasma processes and polymers |
14 |
9 |
UA library record; WoS full record; WoS citing articles |
|
|
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 |
|
|
Aussems, D.U.B.; Bal, K. M.; Morgan, T.W.; van de Sanden, M.C.M.; Neyts, E.C. |
Atomistic simulations of graphite etching at realistic time scales |
2017 |
Chemical science |
8 |
3 |
UA library record; WoS full record; WoS citing articles |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
Verlackt, C.C.W.; Van Boxem, W.; Dewaele, D.; Lemière, F.; Sobott, F.; Benedikt, J.; Neyts, E.C.; Bogaerts, A. |
Mechanisms of Peptide Oxidation by Hydroxyl Radicals: Insight at the Molecular Scale |
2017 |
The journal of physical chemistry: C : nanomaterials and interfaces |
121 |
5 |
UA library record; WoS full record; WoS citing articles |
|
|
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 |
|
|
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 |
|
|
Neyts, E.C.; Brault, P. |
Molecular Dynamics Simulations for Plasma-Surface Interactions: Molecular Dynamics Simulations… |
2017 |
Plasma processes and polymers |
14 |
13 |
UA library record; WoS full record; WoS citing articles |
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