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  Author Title Year Publication Volume Times cited Additional Links Links
Schoeters, B.; Neyts, E.C.; Khalilov, U.; Pourtois, G.; Partoens, B. Stability of Si epoxide defects in Si nanowires : a mixed reactive force field/DFT study 2013 Physical chemistry, chemical physics 15 3 UA library record; WoS full record; WoS citing articles url doi
Dabaghmanesh, S.; Neyts, E.C.; Partoens, B. van der Waals density functionals applied to corundum-type sesquioxides : bulk properties and adsorption of CH3 and C6H6 on (0001) surfaces 2016 Physical chemistry, chemical physics 18 6 UA library record; WoS full record; WoS citing articles pdf doi
Mees, M.J.; Pourtois, G.; Rosciano, F.; Put, B.; Vereecken, P.M.; Stesmans, A. First-principles material modeling of solid-state electrolytes with the spinel structure 2014 Physical chemistry, chemical physics 8 UA library record; WoS full record; WoS citing articles doi
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 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
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
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
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
Ali, S.; Myasnichenko, V.S.; Neyts, E.C. Size-dependent strain and surface energies of gold nanoclusters 2016 Physical chemistry, chemical physics 18 37 UA library record; WoS full record; WoS citing articles pdf url doi
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 pdf url doi
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 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
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
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
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
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
Cornil, D.; Li, H.; Wood, C.; Pourtois, G.; Bredas, J.-L.; Cornil, J. Work-function modification of Au and Ag surfaces upon deposition of self-assembled monolayers : influence of the choice of the theoretical approach and the thiol decomposition scheme 2013 ChemPhysChem : a European journal of chemical physics and physical chemistry 14 9 UA library record; WoS full record; WoS citing articles doi
Duan, Z.L.; Chen, Z.Y.; Zhang, J.T.; Feng, X.L.; Xu, Z.Z. Scheme for the generation of entangled atomic state in cavity QED 2004 European physical journal : D : atomic, molecular and optical physics 30 4 UA library record; WoS full record; WoS citing articles doi
Drukarev, E.; Mikhailov, A.; Rakhimov, K.Y.; Yusupov, H. Relativistic photoeffect for s states in a central field 2020 European Physical Journal D 74 UA library record; WoS full record pdf doi
Pietanza, L.D.; Guaitella, O.; Aquilanti, V.; Armenise, I.; Bogaerts, A.; Capitelli, M.; Colonna, G.; Guerra, V.; Engeln, R.; Kustova, E.; Lombardi, A.; Palazzetti, F.; Silva, T. Advances in non-equilibrium $$\hbox {CO}_2$$ plasma kinetics: a theoretical and experimental review 2021 European Physical Journal D 75 UA library record; WoS full record; WoS citing articles pdf url doi
Maeyens, A.; Tempère, J. Magnetohydrodynamic properties of incompressible Meissner fluids 2007 European physical journal : B : condensed matter and complex systems 58 UA library record; WoS full record doi
Cassimon, J.; Kovács, A.; Neyts, E.; Cornet, I.; Billen, P. Deacetylation of mannosylerythritol lipids in hydrophobic natural deep eutectic solvents 2023 European journal of organic chemistry 27 UA library record pdf doi
Hollevoet, L.; Jardali, F.; Gorbanev, Y.; Creel, J.; Bogaerts, A.; Martens, J.A. Towards green ammonia synthesis through plasma-driven nitrogen oxidation and catalytic reduction 2020 Angewandte Chemie-International Edition 1 UA library record; WoS full record; WoS citing articles pdf url doi
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 doi
Phung, Q.M.; Vancoillie, S.; Delabie, A.; Pourtois, G.; Pierloot, K. Ruthenocene and cyclopentadienyl pyrrolyl ruthenium as precursors for ruthenium atomic layer deposition : a comparative study of dissociation enthalpies 2012 Theoretical chemistry accounts : theory, computation, and modeling 131 5 UA library record; WoS full record; WoS citing articles doi
Verlinden, G.; Gijbels, R.; Geuens, I. Chemical microcharacterization of ultrathin iodide conversion layers and adsorbed thiocyanate surface layers on silver halide microcrystals with time-of-flight SIMS 2002 Microscopy and microanalysis 8 1 UA library record; WoS full record; WoS citing articles doi
Lin, A.; Truong, B.; Patel, S.; Kaushik, N.; Choi, E.H.; Fridman, G.; Fridman, A.; Miller, V. Nanosecond-pulsed DBD plasma-generated reactive oxygen species trigger immunogenic cell death in A549 lung carcinoma cells through intracellular oxidative stress 2017 International journal of molecular sciences 18 UA library record; WoS full record; WoS citing articles url doi
Bengtson, C.; Bogaerts, A. The Quest to Quantify Selective and Synergistic Effects of Plasma for Cancer Treatment: Insights from Mathematical Modeling 2021 International Journal Of Molecular Sciences 22 UA library record; WoS full record; WoS citing articles url doi
Privat-Maldonado, A.; Verloy, R.; Cardenas Delahoz, E.; Lin, A.; Vanlanduit, S.; Smits, E.; Bogaerts, A. Cold Atmospheric Plasma Does Not Affect Stellate Cells Phenotype in Pancreatic Cancer Tissue in Ovo 2022 International Journal Of Molecular Sciences 23 UA library record; WoS full record; WoS citing articles url doi
Ignatova, V.A.; van Vaeck, L.; Gijbels, R.; Adams, F. Molecular speciation of inorganic mixtures by Fourier transform laser microprobe mass sepctrometry 2003 International journal of mass spectrometry 225 9 UA library record; WoS full record; WoS citing articles doi
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