| Author |
Title |
Year |
Publication |
Volume |
Times cited |
Additional Links |
| Yusupov, M.; Bogaerts, A.; Huygh, S.; Snoeckx, R.; van Duin, A.C.T.; Neyts, E.C. |
Plasma-induced destruction of bacterial cell wall components : a reactive molecular dynamics simulation |
2013 |
The journal of physical chemistry: C : nanomaterials and interfaces |
117 |
59 |
UA library record; WoS full record; WoS citing articles |
| Somers, W.; Bogaerts, A.; van Duin, A.C.T.; Neyts, E.C. |
Plasma species interacting with nickel surfaces : toward an atomic scale understanding of plasma-catalysis |
2012 |
The journal of physical chemistry: C : nanomaterials and interfaces |
116 |
37 |
UA library record; WoS full record; WoS citing articles |
| Khalilov, U.; Yusupov, M.; Bogaerts, A.; Neyts, E.C. |
Selective Plasma Oxidation of Ultrasmall Si Nanowires |
2016 |
The journal of physical chemistry: C : nanomaterials and interfaces |
120 |
3 |
UA library record; WoS full record; WoS citing articles |
| Huygh, S.; Bogaerts, A.; Neyts, E.C. |
How Oxygen Vacancies Activate CO2 Dissociation on TiO2 Anatase (001) |
2016 |
The journal of physical chemistry: C : nanomaterials and interfaces |
120 |
49 |
UA library record; WoS full record; WoS citing articles |
| Zhang, Y.-R.; Neyts, E.C.; Bogaerts, A. |
Influence of the Material Dielectric Constant on Plasma Generation inside Catalyst Pores |
2016 |
The journal of physical chemistry: C : nanomaterials and interfaces |
120 |
34 |
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 |
| 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 |
| 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 |
| 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 |
| Bal, K.M.; Neyts, E.C. |
Overcoming Old Scaling Relations and Establishing New Correlations in Catalytic Surface Chemistry: Combined Effect of Charging and Doping |
2019 |
The journal of physical chemistry: C : nanomaterials and interfaces |
123 |
5 |
UA library record; WoS full record; WoS citing articles |
| Jafarzadeh, A.; Bal, K.M.; Bogaerts, A.; Neyts, E.C. |
CO2 activation on TiO2-supported Cu5 and Ni5 nanoclusters : effect of plasma-induced surface charging |
2019 |
The journal of physical chemistry: C : nanomaterials and interfaces |
123 |
4 |
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 |
| Nematollahi, P.; Neyts, E.C. |
Identification of a unique pyridinic FeN4Cx electrocatalyst for N₂ reduction : tailoring the coordination and carbon topologies |
2022 |
Journal Of Physical Chemistry C |
126 |
|
UA library record; WoS full record |
| Van de Sompel, P.; Khalilov, U.; Neyts, E.C. |
Contrasting H-etching to OH-etching in plasma-assisted nucleation of carbon nanotubes |
2021 |
Journal Of Physical Chemistry C |
125 |
|
UA library record; WoS full record |
| Nematollahi, P.; Ma, H.; Schneider, W.F.; Neyts, E.C. |
DFT and microkinetic comparison of ru-doped porphyrin-like graphene and nanotubes toward catalytic formic acid decomposition and formation |
2021 |
Journal Of Physical Chemistry C |
125 |
|
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 |
| Kovács, A.; Yusupov, M.; Cornet, I.; Billen, P.; Neyts, E.C. |
Effect of natural deep eutectic solvents of non-eutectic compositions on enzyme stability |
2022 |
Journal Of Molecular Liquids |
366 |
|
UA library record; WoS full record |
| Heyne, M.H.; Chiappe, D.; Meersschaut, J.; Nuytten, T.; Conard, T.; Bender, H.; Huyghebaert, C.; Radu, I.P.; Caymax, M.; de Marneffe, J.F.; Neyts, E.C.; De Gendt, S.; |
Multilayer MoS2 growth by metal and metal oxide sulfurization |
2016 |
Journal of materials chemistry C : materials for optical and electronic devices |
4 |
|
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 |
| 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 |
| Neyts, E.C.; Thijsse, B.J.; Mees, M.J.; Bal, K.M.; Pourtois, G. |
Establishing uniform acceptance in force biased Monte Carlo simulations |
2012 |
Journal of chemical theory and computation |
8 |
20 |
UA library record; WoS full record; WoS citing articles |
| Bal, K.M.; Neyts, E.C. |
Merging Metadynamics into Hyperdynamics: Accelerated Molecular Simulations Reaching Time Scales from Microseconds to Seconds |
2015 |
Journal of chemical theory and computation |
11 |
41 |
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 |
| 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 |
| Gou, F.; Neyts, E.; Eckert, M.; Tinck, S.; Bogaerts, A. |
Molecular dynamics simulations of Cl+ etching on a Si(100) surface |
2010 |
Journal of applied physics |
107 |
15 |
UA library record; WoS full record; WoS citing articles |
| Neyts, E.; Yan, M.; Bogaerts, A.; Gijbels, R. |
Particle-in-cell/Monte Carlo simulations of a low-pressure capacitively coupled radio-frequency discharge: effect of adding H2 to an Ar discharge |
2003 |
Journal of applied physics |
93 |
15 |
UA library record; WoS full record; WoS citing articles |
| Neyts, E.; Bogaerts, A.; van de Sanden, M.C.M. |
Unraveling the deposition mechanism in a-C:H thin-film growth: a molecular-dynamics study for the reaction behavior of C3 and C3H radicals with a-C:H surfaces |
2006 |
Journal of applied physics |
99 |
25 |
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 |
