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  Author Title Year Publication Volume Times cited Additional Links 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 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
Bercx, M.; Partoens, B.; Lamoen, D. Quantitative modeling of secondary electron emission from slow-ion bombardment on semiconductors 2019 Physical review B 99 5 UA library record; WoS full record; WoS citing articles pdf url doi
Saniz, R.; Sarmadian, N.; Partoens, B.; Batuk, M.; Hadermann, J.; Marikutsa, A.; Rumyantseva, M.; Gaskov, A.; Lamoen, D. First-principles study of CO and OH adsorption on in-doped ZnO surfaces 2019 The journal of physics and chemistry of solids 132 7 UA library record; WoS full record; WoS citing articles pdf url doi
Bercx, M.; Slap, L.; Partoens, B.; Lamoen, D. First-Principles Investigation of the Stability of the Oxygen Framework of Li-Rich Battery Cathodes 2019 MRS advances 4 3 UA library record; WoS full record; WoS citing articles pdf url doi
Choudhary, K.; Bercx, M.; Jiang, J.; Pachter, R.; Lamoen, D.; Tavazza, F. Accelerated Discovery of Efficient Solar Cell Materials Using Quantum and Machine-Learning Methods 2019 Chemistry of materials 31 6 UA library record; WoS full record; WoS citing articles pdf url doi
Callaert, C.; Bercx, M.; Lamoen, D.; Hadermann, J. Interstitial defects in the van der Waals gap of Bi2Se3 2019 Acta Crystallographica. Section B: Structural Science, Crystal Engineering and Materials (Online) 75 UA library record; WoS full record; WoS citing articles pdf url doi
Marchetti, A.; Saniz, R.; Krishnan, D.; Rabbachin, L.; Nuyts, G.; De Meyer, S.; Verbeeck, J.; Janssens, K.; Pelosi, C.; Lamoen, D.; Partoens, B.; De Wael, K. Unraveling the Role of Lattice Substitutions on the Stabilization of the Intrinsically Unstable Pb2Sb2O7Pyrochlore: Explaining the Lightfastness of Lead Pyroantimonate Artists’ Pigments 2020 Chemistry Of Materials 32 8 UA library record; WoS full record; WoS citing articles pdf url doi
Caglak, E.; Govers, K.; Lamoen, D.; Labeau, P.-E.; Verwerft, M. Atomic scale analysis of defect clustering and predictions of their concentrations in UO2+x 2020 Journal Of Nuclear Materials 541 UA library record; WoS full record; WoS citing articles pdf url doi
Saniz, R.; Bekaert, J.; Partoens, B.; Lamoen, D. First-principles study of defects at Σ3 grain boundaries in CuGaSe2 2021 Solid State Communications 1 UA library record; WoS full record; WoS citing articles pdf url doi
Leinders, G.; Baldinozzi, G.; Ritter, C.; Saniz, R.; Arts, I.; Lamoen, D.; Verwerft, M. Charge Localization and Magnetic Correlations in the Refined Structure of U3O7 2021 Inorganic Chemistry 60 UA library record; WoS full record; WoS citing articles pdf url doi
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 pdf url doi
Saniz, R.; Baldinozzi, G.; Arts, I.; Lamoen, D.; Leinders, G.; Verwerft, M. Charge order, frustration relief, and spin-orbit coupling in U3O8 2023 Physical review materials 7 UA library record; WoS full record pdf url doi
Paulus, A.; Hendrickx, M.; Mayda, S.; Batuk, M.; Reekmans, G.; von Holst, M.; Elen, K.; Abakumov, A.M.; Adriaensens, P.; Lamoen, D.; Partoens, B.; Hadermann, J.; Van Bael, M.K.; Hardy, A. Understanding the Activation of Anionic Redox Chemistry in Ti4+-Substituted Li2MnO3as a Cathode Material for Li-Ion Batteries 2023 ACS applied energy materials 6 UA library record; WoS full record; WoS citing articles pdf url doi
Bercx, M.; Mayda, S.; Depla, D.; Partoens, B.; Lamoen, D. Plasmonic effects in the neutralization of slow ions at a metallic surface 2023 Contributions to Plasma Physics UA library record; WoS full record pdf url doi
Claes, J.; Partoens, B.; Lamoen, D. Decoupled DFT-1/2 method for defect excitation energies 2023 Physical Review B 108 UA library record; WoS full record pdf url doi
Turner, S.; Shenderova, O.; da Pieve, F.; Lu, Y.-G.; Yücelen, E.; Verbeeck, J.; Lamoen, D.; Van Tendeloo, G. Aberration-corrected microscopy and spectroscopy analysis of pristine, nitrogen containing detonation nanodiamond 2013 Physica status solidi : A : applications and materials science 210 37 UA library record; WoS full record; WoS citing articles pdf doi
Matsubara, M.; Amini, M.N.; Saniz, R.; Lamoen, D.; Partoens, B. Attracting shallow donors : hydrogen passivation in (Al,Ga,In)-doped ZnO 2012 Physical review : B : condensed matter and materials physics 86 7 UA library record; WoS full record; WoS citing articles url doi
Nivesanond, K.; Peeters, A.; Lamoen, D.; van Alsenoy, C. Conformational analysis of TMC114, a novel HIV-1 protease inhibitor 2008 Journal of Chemical Information and Modeling 48 13 UA library record; WoS full record; WoS citing articles doi
Kruse, P.; Schowalter, M.; Lamoen, D.; Rosenauer, A.; Gerthsen, D. Determination of the mean inner potential in III-V semiconductors, Si and Ge by density functional theory and electron holography 2006 Ultramicroscopy 106 50 UA library record; WoS full record; WoS citing articles doi
Govaerts, K.; Park, K.; De Beule, C.; Partoens, B.; Lamoen, D. Effect of Bi bilayers on the topological states of Bi2Se3 : a first-principles study 2014 Physical review : B : condensed matter and materials physics 90 30 UA library record; WoS full record; WoS citing articles url doi
Zeng, Y.-J.; Schouteden, K.; Amini, M.N.; Ruan, S.-C.; Lu, Y.-F.; Ye, Z.-Z.; Partoens, B.; Lamoen, D.; Van Haesendonck, C. Electronic band structures and native point defects of ultrafine ZnO nanocrystals 2015 ACS applied materials and interfaces 7 15 UA library record; WoS full record; WoS citing articles pdf url doi
Verbeeck, J.; Bals, S.; Lamoen, D.; Luysberg, M.; Huijben, M.; Rijnders, G.; Brinkman, A.; Hilgenkamp, H.; Blank, D.H.A.; Van Tendeloo, G. Electronic reconstruction at n-type SrTiO3/LaAlO3 interfaces 2010 Physical review : B : condensed matter and materials physics 81 25 UA library record; WoS full record; WoS citing articles url doi
Leys, F.E.; March, N.H.; Lamoen, D.; van Doren, V.E. Equations of state of tantalum and plutonium in a spherical cell approximation and at extremely high pressures 2002 22 UA library record; WoS full record; WoS citing articles doi
Dixit, H.; Tandon, N.; Cottenier, S.; Saniz, R.; Lamoen, D.; Partoens, B. Erratum : First-principles study of possible shallow donors in ZnAl2O4 spinel [Phys. Rev. B 87, 174101 (2013)] 2013 Physical review : B : condensed matter and materials physics 88 1 UA library record; WoS full record; WoS citing articles url doi
Dixit, H.; Tandon, N.; Cottenier, S.; Saniz, R.; Lamoen, D.; Partoens, B. First-principles study of possible shallow donors in ZnAl2O4 spinel 2013 Physical review : B : condensed matter and materials physics 87 50 UA library record; WoS full record; WoS citing articles url doi
Govaerts, K.; Sluiter, M.H.F.; Partoens, B.; Lamoen, D. Homologous series of layered structures in binary and ternary Bi-Sb-Te-Se systems : ab initio study 2014 Physical review : B : condensed matter and materials physics 89 5 UA library record; WoS full record; WoS citing articles url doi
Sarmadian, N.; Saniz, R.; Lamoen, D.; Partoens, B. Influence of Al concentration on the optoelectronic properties of Al-doped MgO 2012 Physical review : B : condensed matter and materials physics 86 5 UA library record; WoS full record; WoS citing articles url doi
Govaerts, K.; Sluiter, M.H.F.; Partoens, B.; Lamoen, D. Stability of Sb-Te layered structures : first-principles study 2012 Physical review : B : condensed matter and materials physics 85 14 UA library record; WoS full record; WoS citing articles url doi
Govaerts, K.; Saniz, R.; Partoens, B.; Lamoen, D. van der Waals bonding and the quasiparticle band structure of SnO from first principles 2013 Physical review : B : condensed matter and materials physics 87 50 UA library record; WoS full record; WoS citing articles url doi
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