|
Author |
Title |
Year |
Publication |
Volume |
Times cited |
Additional Links |
Links |
|
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 |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
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 |
|
|
Engelmann, Y.; van ’t Veer, K.; Gorbanev, Y.; Neyts, E.C.; Schneider, W.F.; Bogaerts, A. |
Plasma Catalysis for Ammonia Synthesis: A Microkinetic Modeling Study on the Contributions of Eley–Rideal Reactions |
2021 |
Acs Sustainable Chemistry & Engineering |
9 |
|
UA library record; WoS full record; WoS citing articles |
|
|
Bogaerts, A.; Neyts, E.C.; Guaitella, O.; Murphy, A.B. |
Foundations of plasma catalysis for environmental applications |
2022 |
Plasma Sources Science & Technology |
|
|
UA library record; WoS full record; WoS citing articles |
|
|
Nematollahi, P.; Barbiellini, B.; Bansil, A.; Lamoen, D.; Qingying, J.; Mukerjee, S.; Neyts, E.C. |
Identification of a Robust and Durable FeN4CxCatalyst for ORR in PEM Fuel Cells and the Role of the Fifth Ligand |
2022 |
ACS catalysis |
|
|
UA library record; WoS full record; WoS full record; WoS citing articles |
|
|
Faraji, F.; Neyts, E.C.; Milošević, M.V.; Peeters, F.M. |
Comment on “Misinterpretation of the Shuttleworth equation” |
2024 |
Scripta Materialia |
250 |
|
|
|
|
Faraji, F.; Neyts, E.C.; Milošević, M.V.; Peeters, F.M. |
Capillary Condensation of Water in Graphene Nanocapillaries |
2024 |
Nano Letters |
24 |
|
|
|
|
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 |
|
|
|