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Author |
Title |
Year |
Publication |
Volume |
Times cited |
Additional Links |
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Khalilov, U.; Pourtois, G.; Huygh, S.; van Duin, A.C.T.; Neyts, E.C.; Bogaerts, A. |
New mechanism for oxidation of native silicon oxide |
2013 |
The journal of physical chemistry: C : nanomaterials and interfaces |
117 |
24 |
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 |
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|
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 |
24 |
UA library record; WoS full record; WoS citing articles |
|
|
Neyts, E.C.; Bogaerts, A. |
Combining molecular dynamics with Monte Carlo simulations : implementations and applications |
2013 |
Theoretical chemistry accounts : theory, computation, and modeling |
132 |
27 |
UA library record; WoS full record; WoS citing articles |
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|
Bogaerts, A.; de Bleecker, K.; Georgieva, V.; Kolev, I.; Madani, M.; Neyts, E. |
Computer simulations for processing plasmas |
2006 |
Plasma processes and polymers |
3 |
8 |
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 |
|
|
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 |
|
|
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 |
|
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Khalilov, U.; Pourtois, G.; Bogaerts, A.; van Duin, A.C.T.; Neyts, E.C. |
Reactive molecular dynamics simulations on SiO2-coated ultra-small Si-nanowires |
2013 |
Nanoscale |
5 |
17 |
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 |
|
|
Brault, P.; Chamorro-Coral, W.; Chuon, S.; Caillard, A.; Bauchire, J.-M.; Baranton, S.; Coutanceau, C.; Neyts, E. |
Molecular dynamics simulations of initial Pd and PdO nanocluster growth in a magnetron gas aggregation source |
2019 |
Frontiers of Chemical Science and Engineering |
13 |
3 |
UA library record; WoS full record; WoS citing articles |
|
|
Neyts, E.C. |
Special Issue on future directions in plasma nanoscience |
2019 |
Frontiers of Chemical Science and Engineering |
13 |
|
UA library record; WoS full record; WoS citing articles |
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|
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 |
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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 |
|
|
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 |
|
|
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 |
|
|
Nematollahi, P.; Neyts, E.C. |
Distribution pattern of metal atoms in bimetal-doped pyridinic-N₄ pores determines their potential for electrocatalytic N₂ reduction |
2022 |
Journal Of Physical Chemistry A |
126 |
|
UA library record; WoS full record |
|
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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 |
|
|
Cai, Y.; Michiels, R.; De Luca, F.; Neyts, E.; Tu, X.; Bogaerts, A.; Gerrits, N. |
Improving Molecule–Metal Surface Reaction Networks Using the Meta-Generalized Gradient Approximation: CO2Hydrogenation |
2024 |
The Journal of Physical Chemistry C |
128 |
|
|
|
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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 |
|
|
Neyts, E.C.; Bogaerts, A. |
Understanding plasma catalysis through modelling and simulation : a review |
2014 |
Journal of physics: D: applied physics |
47 |
130 |
UA library record; WoS full record; WoS citing articles |
|
|
Dufour, T.; Minnebo, J.; Abou Rich, S.; Neyts, E.C.; Bogaerts, A.; Reniers, F. |
Understanding polyethylene surface functionalization by an atmospheric He/O2 plasma through combined experiments and simulations |
2014 |
Journal of physics: D: applied physics |
47 |
13 |
UA library record; WoS full record; WoS citing articles |
|
|
Neyts, E.; Bogaerts, A.; de Meyer, M.; van Gils, S. |
Macroscale computer simulations to investigate the chemical vapor deposition of thin metal-oxide films |
2007 |
Surface and coatings technology |
201 |
5 |
UA library record; WoS full record; WoS citing articles |
|
|
Brault, P.; Neyts, E.C. |
Molecular dynamics simulations of supported metal nanocatalyst formation by plasma sputtering |
2015 |
Catalysis today |
256 |
18 |
UA library record; WoS full record; WoS citing articles |
|
|
Neyts, E.C.; Ostrikov, K.(K.) |
Nanoscale thermodynamic aspects of plasma catalysis |
2015 |
Catalysis today |
256 |
14 |
UA library record; WoS full record; WoS citing articles |
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|
Nozaki, T.; Neyts, E.C.; Sankaran, M.; Ostrikov, K.(K.); Liu, C.-J. |
Plasmas for enhanced catalytic processes (ISPCEM 2014) |
2015 |
Catalysis today |
256 |
2 |
UA library record; WoS full record; WoS citing articles |
|
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Heyne, M.H.; de Marneffe, J.-F.; Delabie, A.; Caymax, M.; Neyts, E.C.; Radu, I.; Huyghebaert, C.; De Gendt, S. |
Two-dimensional WS2 nanoribbon deposition by conversion of pre-patterned amorphous silicon |
2017 |
Nanotechnology |
28 |
13 |
UA library record; WoS full record; WoS citing articles |
|
|
Vets, C.; Neyts, E.C. |
Stabilities of bimetallic nanoparticles for chirality-selective carbon nanotube growth and the effect of carbon interstitials |
2017 |
The journal of physical chemistry: C : nanomaterials and interfaces |
121 |
2 |
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 |
|
|
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 |
