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  Author Title Year (down) Publication Volume Times cited Additional Links Links
Yorulmaz, U.; Šabani, D.; Yagmurcukardes, M.; Sevik, C.; Milošević, M.V. High-throughput analysis of tetragonal transition metal Xenes 2022 Physical chemistry, chemical physics 24 1 UA library record; WoS full record; WoS citing articles pdf doi
Demirkol, Ö.; Sevik, C.; Demiroğlu, I. First principles assessment of the phase stability and transition mechanisms of designated crystal structures of pristine and Janus transition metal dichalcogenides 2022 Physical chemistry, chemical physics 24 UA library record; WoS full record; WoS citing articles url doi
Chaney, G.; Cakir, D.; Peeters, F.M.; Ataca, C. Stability of adsorption of Mg and Na on sulfur-functionalized MXenes 2021 Physical Chemistry Chemical Physics 23 7 UA library record; WoS full record; WoS citing articles doi
Sozen, Y.; Yagmurcukardes, M.; Sahin, H. Vibrational and optical identification of GeO₂ and GeO single layers : a first-principles study 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles doi
Vermeyen, T.; Brence, J.; Van Echelpoel, R.; Aerts, R.; Acke, G.; Bultinck, P.; Herrebout, W. Exploring machine learning methods for absolute configuration determination with vibrational circular dichroism 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Faraji, M.; Fadlallah, M.M.; Jappor, H.R.; Karbasizadeh, S.; Ghergherehchi, M.; Sarsari, I.A.; Ziabari, A.A. Novel two-dimensional AlSb and InSb monolayers with a double-layer honeycomb structure : a first-principles study 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles url doi
Nazar, N.D.; Vazifehshenas, T.; Ebrahimi, M.R.; Peeters, F.M. Strong anisotropic optical properties of 8-Pmmn borophene : a many-body perturbation study 2021 Physical Chemistry Chemical Physics 23 4 UA library record; WoS full record doi
Faraji, M.; Bafekry, A.; Fadlallah, M.M.; Molaei, F.; Hieu, N.N.; Qian, P.; Ghergherehchi, M.; Gogova, D. Surface modification of titanium carbide MXene monolayers (Ti₂C and Ti₃C₂) via chalcogenide and halogenide atoms 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Karbasizadeh, S.; Stampfl, C.; Faraji, M.; Hoat, D.M.; Sarsari, I.A.; Feghhi, S.A.H.; Ghergherehchi, M. Two-dimensional Janus semiconductor BiTeCl and BiTeBr monolayers : a first-principles study on their tunable electronic properties via an electric field and mechanical strain 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles url doi
Naseri, M.; Bafekry, A.; Faraji, M.; Hoat, D.M.; Fadlallah, M.M.; Ghergherehchi, M.; Sabbaghi, N.; Gogova, D. Two-dimensional buckled tetragonal cadmium chalcogenides including CdS, CdSe, and CdTe monolayers as photo-catalysts for water splitting 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles doi
Baskurt, M.; Nair, R.R.; Peeters, F.M.; Sahin, H. Ultra-thin structures of manganese fluorides : conversion from manganese dichalcogenides by fluorination 2021 Physical Chemistry Chemical Physics 23 1 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Yagmurcukardes, M.; Akgenc, B.; Ghergherehchi, M.; Mortazavi, B. First-principles investigation of electronic, mechanical and thermoelectric properties of graphene-like XBi (X = Si, Ge, Sn) monolayers 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles url doi
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 url doi
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 url doi
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 url doi
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 url doi
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 url doi
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 url doi
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 url doi
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 pdf doi
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 pdf doi
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 url doi
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 pdf doi
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 pdf url doi
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 url doi
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 pdf doi
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 url doi
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 pdf url doi
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 pdf url doi
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 pdf url doi
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