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Author |
Title |
Year |
Publication |
Volume  |
Times cited |
Additional Links |
Links |
|
|
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 |
|
|
|
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 |
|
|
|
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 |
|
|
|
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.; 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 |
|
|
|
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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|
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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 |
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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 |
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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 |
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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 |
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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 |
|
|
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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 |
|
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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 |
|
|
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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 |
|
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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 |
|
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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 |
|
|
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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 |
|
|
|
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 |
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Kato, T.; Neyts, E.C.; Abiko, Y.; Akama, T.; Hatakeyama, R.; Kaneko, T. |
Kinetics of energy selective Cs encapsulation in single-walled carbon nanotubes for damage-free and position-selective doping |
2015 |
The journal of physical chemistry: C : nanomaterials and interfaces |
119 |
3 |
UA library record; WoS full record; WoS citing articles |
|
|
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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 |
|
|
|
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 |
|
|
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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 |
|
|
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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 |
|
|
|
Khalilov, U.; Pourtois, G.; van Duin, A.C.T.; Neyts, E.C. |
Hyperthermal oxidation of Si(100)2x1 surfaces : effect of growth temperature |
2012 |
The journal of physical chemistry: C : nanomaterials and interfaces |
116 |
32 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Khalilov, U.; Pourtois, G.; van Duin, A.C.T.; Neyts, E.C. |
On the c-Si\mid a-SiO2 interface in hyperthermal Si oxidation at room temperature |
2012 |
The journal of physical chemistry: C : nanomaterials and interfaces |
116 |
27 |
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.; Neyts, E.C.; Pourtois, G.; van Duin, A.C.T. |
Can we control the thickness of ultrathin silica layers by hyperthermal silicon oxidation at room temperature? |
2011 |
The journal of physical chemistry: C : nanomaterials and interfaces |
115 |
36 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Neyts, E.C.; Khalilov, U.; Pourtois, G.; van Duin, A.C.T. |
Hyperthermal oxygen interacting with silicon surfaces : adsorption, implantation, and damage creation |
2011 |
The journal of physical chemistry: C : nanomaterials and interfaces |
115 |
28 |
UA library record; WoS full record; WoS citing articles |
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