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  Author Title Year Publication Volume Times cited Additional Links Links
Van Schoubroeck, S.; Thomassen, G.; Van Passel, S.; Malina, R.; Springael, J.; Lizin, S.; Venditti, R.A.; Yao, Y.; Van Dael, M. An integrated techno-sustainability assessment (TSA) framework for emerging technologies 2021 Green Chemistry 23 UA library record; WoS full record; WoS citing articles pdf url doi
Mallick, S.; Zhang, W.; Batuk, M.; Gibbs, A.S.; Hadermann, J.; Halasyamani, P.S.; Hayward, M.A. The crystal and defect structures of polar KBiNb2O7 2022 Journal of the Chemical Society : Dalton transactions 51 UA library record; WoS full record url doi
Salzmann, B.B.V.; Wit, J. de; Li, C.; Arenas-Esteban, D.; Bals, S.; Meijerink, A.; Vanmaekelbergh, D. Two-Dimensional CdSe-PbSe Heterostructures and PbSe Nanoplatelets: Formation, Atomic Structure, and Optical Properties 2022 The journal of physical chemistry: C : nanomaterials and interfaces 126 12 UA library record; WoS full record; WoS citing articles url doi
Windels, S.; Diefenhardt, T.; Jain, N.; Marquez, C.; Bals, S.; Schlummer, M.; De Vos, D.E. Catalytic upcycling of PVC waste-derived phthalate esters into safe, hydrogenated plasticizers 2022 Green chemistry : cutting-edge research for a greener sustainable future 24 8 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Faraji, M.; Ziabari, A.A.; Fadlallah, M.M.; Nguyen, C., V; Ghergherehchi, M.; Feghhi, S.A.H. A van der Waals heterostructure of MoS₂/MoSi₂N₄ : a first-principles study 2021 New Journal Of Chemistry 45 UA library record; WoS full record; WoS citing articles url doi
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 url doi
Akbali, B.; Yagmurcukardes, M.; Peeters, F.M.; Lin, H.-Y.; Lin, T.-Y.; Chen, W.-H.; Maher, S.; Chen, T.-Y.; Huang, C.-H. Determining the molecular orientation on the metal nanoparticle surface through surface-enhanced Raman spectroscopy and density functional theory simulations 2021 Journal Of Physical Chemistry C 125 9 UA library record; WoS full record; WoS citing articles pdf 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
Alihosseini, M.; Ghasemi, S.; Ahmadkhani, S.; Alidoosti, M.; Esfahani, D.N.; Peeters, F.M.; Neek-Amal, M. Electronic properties of oxidized graphene : effects of strain and an electric field on flat bands and the energy gap 2021 The journal of physical chemistry letters 7 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.; 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
Faraji, M.; Bafekry, A.; Gogova, D.; Hoat, D.M.; Ghergherehchi, M.; Chuong, N.V.; Feghhi, S.A.H. Novel two-dimensional ZnO₂, CdO₂ and HgO₂ monolayers: a first-principles-based prediction 2021 New Journal Of Chemistry 45 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Faraji, M.; Fadlallah, M.M.; Mortazavi, B.; Ziabari, A.A.; Khatibani, A.B.; Nguyen, C., V; Ghergherehchi, M.; Gogova, D. Point defects in a two-dimensional ZnSnN₂ nanosheet : a first-principles study on the electronic and magnetic properties 2021 Journal Of Physical Chemistry C 125 UA library record; WoS full record; WoS citing articles pdf 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
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
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
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
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
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
Ghasemitarei, M.; Privat-Maldonado, A.; Yusupov, M.; Rahnama, S.; Bogaerts, A.; Ejtehadi, M.R. Effect of Cysteine Oxidation in SARS-CoV-2 Receptor-Binding Domain on Its Interaction with Two Cell Receptors: Insights from Atomistic Simulations 2022 Journal Of Chemical Information And Modeling 62 UA library record; WoS full record; WoS citing articles url doi
Girard-Sahun, F.; Biondo, O.; Trenchev, G.; van Rooij, G.; Bogaerts, A. Carbon bed post-plasma to enhance the CO2 conversion and remove O2 from the product stream 2022 Chemical Engineering Journal 442 UA library record; WoS full record; WoS citing articles pdf url doi
Girard-Sahun, F.; Biondo, O.; Trenchev, G.; van Rooij, G.; Bogaerts, A. Carbon bed post-plasma to enhance the CO2 conversion and remove O2 from the product stream 2022 Chemical Engineering Journal 442 UA library record; WoS full record; WoS citing articles pdf url doi
Hollevoet, L.; Vervloessem, E.; Gorbanev, Y.; Nikiforov, A.; De Geyter, N.; Bogaerts, A.; Martens, J.A. Energy‐Efficient Small‐Scale Ammonia Synthesis Process with Plasma‐enabled Nitrogen Oxidation and Catalytic Reduction of Adsorbed NOx 2022 Chemsuschem UA library record; WoS full record; WoS citing articles pdf url doi
Van Alphen, S.; Ahmadi Eshtehardi, H.; O'Modhrain, C.; Bogaerts, J.; Van Poyer, H.; Creel, J.; Delplancke, M.-P.; Snyders, R.; Bogaerts, A. Effusion nozzle for energy-efficient NOx production in a rotating gliding arc plasma reactor 2022 Chemical Engineering Journal 443 UA library record; WoS full record; WoS citing articles pdf url doi
Rogolino, A.; Claes, N.; Cizaurre, J.; Marauri, A.; Jumbo-Nogales, A.; Lawera, Z.; Kruse, J.; Sanroman-Iglesias, M.; Zarketa, I.; Calvo, U.; Jimenez-Izal, E.; Rakovich, Y.P.; Bals, S.; Matxain, J.M.; Grzelczak, M. Metal-polymer heterojunction in colloidal-phase plasmonic catalysis 2022 The journal of physical chemistry letters 13 1 UA library record; WoS full record; WoS citing articles url doi
Li, W.; Tong, W.; Yadav, A.; Bladt, E.; Bals, S.; Funston, A.M.; Etheridge, J. Shape control beyond the seeds in gold nanoparticles 2021 Chemistry Of Materials 33 3 UA library record; WoS full record; WoS citing articles pdf doi
Canossa, S.; Ferrari, E.; Sippel, P.; Fischer, J.K.H.; Pfattner, R.; Frison, R.; Masino, M.; Mas-Torrent, M.; Lunkenheimer, P.; Rovira, C.; Girlando, A. Tetramethylbenzidine-TetrafluoroTCNQ (TMB-TCNQF(4)) : a narrow-gap semiconducting salt with room-temperature relaxor ferroelectric behavior 2021 Journal Of Physical Chemistry C 125 UA library record; WoS full record; WoS citing articles pdf doi
Savina, A.A.; Saiutina, V.V.; Morozov, A.V.; Boev, A.O.; Aksyonov, D.A.; Dejoie, C.; Batuk, M.; Bals, S.; Hadermann, J.; Abakumov, A.M. Chemistry, local molybdenum clustering, and electrochemistry in the Li2+xMo1-xO3 solid solutions 2022 Inorganic chemistry 61 3 UA library record; WoS full record; WoS citing articles pdf doi
Otero-Martinez, C.; Imran, M.; Schrenker, N.J.; Ye, J.; Ji, K.; Rao, A.; Stranks, S.D.; Hoye, R.L.Z.; Bals, S.; Manna, L.; Perez-Juste, J.; Polavarapu, L. Fast A-site cation cross-exchange at room temperature : single-to double- and triple-cation halide perovskite nanocrystals 2022 Angewandte Chemie: international edition in English 61 28 UA library record; WoS full record; WoS citing articles url doi
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