| Author |
Title |
Year |
Publication |
Volume |
Times cited |
Additional Links |
| 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 |
| 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 |
| 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 |
| Somers, W.; Bogaerts, A.; van Duin, A.C.T.; Huygh, S.; Bal, K.M.; Neyts, E.C. |
Temperature influence on the reactivity of plasma species on a nickel catalyst surface : an atomic scale study |
2013 |
Catalysis today |
211 |
27 |
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 |
| Elliott, J.A.; Shibuta, Y.; Amara, H.; Bichara, C.; Neyts, E.C. |
Atomistic modelling of CVD synthesis of carbon nanotubes and graphene |
2013 |
Nanoscale |
5 |
52 |
UA library record; WoS full record; WoS citing articles |
| Neyts, E.C.; van Duin, A.C.T.; Bogaerts, A. |
Formation of single layer graphene on nickel under far-from-equilibrium high flux conditions |
2013 |
Nanoscale |
5 |
25 |
UA library record; WoS full record; WoS citing articles |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| Somers, W.; Bogaerts, A.; van Duin, A.C.T.; Neyts, E.C. |
Interactions of plasma species on nickel catalysts : a reactive molecular dynamics study on the influence of temperature and surface structure |
2014 |
Applied catalysis : B : environmental |
154 |
23 |
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 |
| 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.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 |
| 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 |
| Khalilov, U.; Bogaerts, A.; Neyts, E.C. |
Microscopic mechanisms of vertical graphene and carbon nanotube cap nucleation from hydrocarbon growth precursors |
2014 |
Nanoscale |
6 |
21 |
UA library record; WoS full record; WoS citing articles |
| 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 |
| 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 |
| 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 |
| 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 |
| Xie, L.; Brault, P.; Coutanceau, C.; Bauchire, J.-M.; Caillard, A.; Baranton, S.; Berndt, J.; Neyts, E.C. |
Efficient amorphous platinum catalyst cluster growth on porous carbon : a combined molecular dynamics and experimental study |
2015 |
Applied catalysis : B : environmental |
162 |
20 |
UA library record; WoS full record; WoS citing articles |
| Huygh, S.; Bogaerts, A.; van Duin, A.C.T.; Neyts, E.C. |
Development of a ReaxFF reactive force field for intrinsic point defects in titanium dioxide |
2014 |
Computational materials science |
95 |
15 |
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.; Yusupov, M.; Van der Paal, J.; Verlackt, C.C.W.; Neyts, E.C. |
Reactive molecular dynamics simulations for a better insight in plasma medicine |
2014 |
Plasma processes and polymers |
11 |
22 |
UA library record; WoS full record; WoS citing articles |
| 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 |
| 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 |
| Yusupov, M.; Neyts, E.C.; Verlackt, C.C.; Khalilov, U.; van Duin, A.C.T.; Bogaerts, A. |
Inactivation of the endotoxic biomolecule lipid A by oxygen plasma species : a reactive molecular dynamics study |
2015 |
Plasma processes and polymers |
12 |
18 |
UA library record; WoS full record; WoS citing articles |
| 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 |
