Author |
Title |
Year |
Publication |
Volume |
Times cited |
Additional Links |
Saniz, R.; Bekaert, J.; Partoens, B.; Lamoen, D. |
Structural and electronic properties of defects at grain boundaries in CuInSe2 |
2017 |
Physical chemistry, chemical physics |
19 |
12 |
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 |
Dabaghmanesh, S.; Sarmadian, N.; Neyts, E.C.; Partoens, B. |
A first principles study of p-type defects in LaCrO3 |
2017 |
Physical chemistry, chemical physics |
19 |
16 |
UA library record; WoS full record; WoS citing articles |
Dabaghmanesh, S.; Neek-Amal, M.; Partoens, B.; Neyts, E.C. |
The formation of Cr2O3 nanoclusters over graphene sheet and carbon nanotubes |
2017 |
Chemical physics letters |
687 |
2 |
UA library record; WoS full record; WoS citing articles |
Momot, A.; Amini, M.N.; Reekmans, G.; Lamoen, D.; Partoens, B.; Slocombe, D.R.; Elen, K.; Adriaensens, P.; Hardy, A.; Van Bael, M.K. |
A novel explanation for the increased conductivity in annealed Al-doped ZnO: an insight into migration of aluminum and displacement of zinc |
2017 |
Physical chemistry, chemical physics |
19 |
26 |
UA library record; WoS full record; WoS citing articles |
Sanchez-Barriga, J.; Ogorodnikov, I.I.; Kuznetsov, M.V.; Volykhov, A.A.; Matsui, F.; Callaert, C.; Hadermann, J.; Verbitskiy, N.I.; Koch, R.J.; Varykhalov, A.; Rader, O.; Yashina, L.V. |
Observation of hidden atomic order at the interface between Fe and topological insulator Bi2Te3 |
2017 |
Physical chemistry, chemical physics |
19 |
4 |
UA library record; WoS full record; WoS citing articles |
Gorbanev, Y.; Verlackt, C.C.W.; Tinck, S.; Tuenter, E.; Foubert, K.; Cos, P.; Bogaerts, A. |
Combining experimental and modelling approaches to study the sources of reactive species induced in water by the COST RF plasma jet |
2018 |
Physical chemistry, chemical physics |
20 |
23 |
UA library record; WoS full record; WoS citing articles |
Verlackt, C.C.W.; Van Boxem, W.; Bogaerts, A. |
Transport and accumulation of plasma generated species in aqueous solution |
2018 |
Physical chemistry, chemical physics |
20 |
35 |
UA library record; WoS full record; WoS citing articles |
Bal, K.M.; Neyts, E.C. |
Modelling molecular adsorption on charged or polarized surfaces: a critical flaw in common approaches |
2018 |
Physical chemistry, chemical physics |
20 |
8 |
UA library record; WoS full record; WoS citing articles |
Serrano-Sevillano, J.; Reynaud, M.; Saracibar, A.; Altantzis, T.; Bals, S.; van Tendeloo, G.; Casas-Cabanas, M. |
Enhanced electrochemical performance of Li-rich cathode materials through microstructural control |
2018 |
Physical chemistry, chemical physics |
20 |
36 |
UA library record; WoS full record; WoS citing articles |
Kandemir, A.; Peeters, F.M.; Sahin, H. |
Monitoring the effect of asymmetrical vertical strain on Janus single layers of MoSSe via spectrum |
2018 |
The journal of chemical physics |
149 |
11 |
UA library record; WoS full record; WoS citing articles |
Dabral, A.; Lu, A.K.A.; Chiappe, D.; Houssa, M.; Pourtois, G. |
A systematic study of various 2D materials in the light of defect formation and oxidation |
2019 |
Physical chemistry, chemical physics |
21 |
1 |
UA library record; WoS full record; WoS citing articles |
Mefford, J.T.; Kurilovich, A.A.; Saunders, J.; Hardin, W.G.; Abakumov, A.M.; Forslund, R.P.; Bonnefont, A.; Dai, S.; Johnston, K.P.; Stevenson, K.J. |
Decoupling the roles of carbon and metal oxides on the electrocatalytic reduction of oxygen on La1-xSrxCoO3-\delta perovskite composite electrodes |
2019 |
Physical chemistry, chemical physics |
21 |
5 |
UA library record; WoS full record; WoS citing articles |
Gorbanev, Y.; Van der Paal, J.; Van Boxem, W.; Dewilde, S.; Bogaerts, A. |
Reaction of chloride anion with atomic oxygen in aqueous solutions: can cold plasma help in chemistry research? |
2019 |
Physical chemistry, chemical physics |
21 |
4 |
UA library record; WoS full record; WoS citing articles |
de Aquino, B.R.H.; Ghorbanfekr-Kalashami, H.; Neek-Amal, M.; Peeters, F.M. |
Ionized water confined in graphene nanochannels |
2019 |
Physical chemistry, chemical physics |
21 |
10 |
UA library record; WoS full record; WoS citing articles |
Bafekry, A.; Ghergherehchi, M.; Shayesteh, S.F. |
Tuning the electronic and magnetic properties of antimonene nanosheets via point defects and external fields: first-principles calculations |
2019 |
Physical chemistry, chemical physics |
21 |
17 |
UA library record; WoS full record; WoS citing articles |
Heirman, P.; Van Boxem, W.; Bogaerts, A. |
Reactivity and stability of plasma-generated oxygen and nitrogen species in buffered water solution: a computational study |
2019 |
Physical chemistry, chemical physics |
21 |
7 |
UA library record; WoS full record; WoS citing articles |
Nakhaee, M.; Yagmurcukardes, M.; Ketabi, S.A.; Peeters, F.M. |
Single-layer structures of a100- and b010-Gallenene : a tight-binding approach |
2019 |
Physical chemistry, chemical physics |
21 |
14 |
UA library record; WoS full record; WoS citing articles |
Bafekry, A.; Ghergherehchi, M.; Shayesteh, S.F.; Peeters, F.M. |
Adsorption of molecules on C3N nanosheet : a first-principles calculations |
2019 |
Chemical physics |
526 |
52 |
UA library record; WoS full record; WoS citing articles |
Van der Paal, J.; Hong, S.-H.; Yusupov, M.; Gaur, N.; Oh, J.-S.; Short, R.D.; Szili, E.J.; Bogaerts, A. |
How membrane lipids influence plasma delivery of reactive oxygen species into cells and subsequent DNA damage : an experimental and computational study |
2019 |
Physical chemistry, chemical physics |
21 |
1 |
UA library record; WoS full record; WoS citing articles |
Bafekry, A.; Shayesteh, S.F.; Peeters, F.M. |
Introducing novel electronic and magnetic properties in C3N nanosheets by defect engineering and atom substitution |
2019 |
Physical chemistry, chemical physics |
21 |
59 |
UA library record; WoS full record; WoS citing articles |
Bafekry, A.; Stampfl, C.; Akgenc, B.; Ghergherehchi, M. |
Control of C3N4 and C4N3 carbon nitride nanosheets' electronic and magnetic properties through embedded atoms |
2020 |
Physical Chemistry Chemical Physics |
22 |
18 |
UA library record; WoS full record; WoS citing articles |
Bafekry, A.; Stampfl, C.; Akgenc, B.; Mortazavi, B.; Ghergherehchi, M.; Nguyen, C.V. |
Embedding of atoms into the nanopore sites of the C₆N₆ and C₆N₈ porous carbon nitride monolayers with tunable electronic properties |
2020 |
Physical Chemistry Chemical Physics |
22 |
17 |
UA library record; WoS full record; WoS citing articles |
Baskurt, M.; Yagmurcukardes, M.; Peeters, F.M.; Sahin, H. |
Stable single-layers of calcium halides (CaX₂, X = F, Cl, Br, I) |
2020 |
Journal Of Chemical Physics |
152 |
14 |
UA library record; WoS full record; WoS citing articles |
Obeid, M.M.; Stampfl, C.; Bafekry, A.; Guan, Z.; Jappor, H.R.; Nguyen, C., V; Naseri, M.; Hoat, D.M.; Hieu, N.N.; Krauklis, A.E.; Tuan V Vu; Gogova, D. |
First-principles investigation of nonmetal doped single-layer BiOBr as a potential photocatalyst with a low recombination rate |
2020 |
Physical Chemistry Chemical Physics |
22 |
18 |
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 |
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 |
Payne, L.M.; Masia, F.; Zilli, A.; Albrecht, W.; Borri, P.; Langbein, W. |
Quantitative morphometric analysis of single gold nanoparticles by optical extinction microscopy: Material permittivity and surface damping effects |
2021 |
Journal Of Chemical Physics |
154 |
|
UA library record; WoS full record; WoS citing articles |
Bafekry, A.; Gogova, D.; M. Fadlallah, M.; V. Chuong, N.; Ghergherehchi, M.; Faraji, M.; Feghhi, S.A.H.; Oskoeian, M. |
Electronic and optical properties of two-dimensional heterostructures and heterojunctions between doped-graphene and C- and N-containing materials |
2021 |
Physical Chemistry Chemical Physics |
23 |
|
UA library record; WoS full record; WoS citing articles |
Hamid, I.; Jalali, H.; Peeters, F.M.; Neek-Amal, M. |
Abnormal in-plane permittivity and ferroelectricity of confined water : from sub-nanometer channels to bulk |
2021 |
Journal Of Chemical Physics |
154 |
13 |
UA library record; WoS full record; WoS citing articles |