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Author Title Year Publication Volume Times cited Additional Links
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
Amini, M.N.; Saniz, R.; Lamoen, D.; Partoens, B. Hydrogen impurities and native defects in CdO 2011 Journal of applied physics 110 13 UA library record; WoS full record; WoS citing articles
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
Bekaert, J.; Saniz, R.; Partoens, B.; Lamoen, D. Native point defects in CuIn1-xGaxSe2 : hybrid density functional calculations predict the origin of p- and n-type conductivity 2014 Physical chemistry, chemical physics 16 43 UA library record; WoS full record; WoS citing articles
Amini, M.N.; Dixit, H.; Saniz, R.; Lamoen, D.; Partoens, B. The origin of p-type conductivity in ZnM2O4 (M = Co, Rh, Ir) spinels 2014 Physical chemistry, chemical physics 16 47 UA library record; WoS full record; WoS citing articles
Dixit, H.; Lamoen, D.; Partoens, B. Quasiparticle band structure of rocksalt-CdO determined using maximally localized Wannier functions 2013 Journal of physics : condensed matter 25 7 UA library record; WoS full record; WoS citing articles
Dixit, H.; Saniz, R.; Lamoen, D.; Partoens, B. The quasiparticle band structure of zincblende and rocksalt ZnO 2010 Journal of physics : condensed matter 22 53 UA library record; WoS full record; WoS citing articles
Saniz, R.; Dixit, H.; Lamoen, D.; Partoens, B. Quasiparticle energies and uniaxial pressure effects on the properties of SnO2 2010 Applied physics letters 97 23 UA library record; WoS full record; WoS citing articles
Saniz, R.; Xu, Y.; Matsubara, M.; Amini, M.N.; Dixit, H.; Lamoen, D.; Partoens, B. A simplified approach to the band gap correction of defect formation energies : Al, Ga, and In-doped ZnO 2013 The journal of physics and chemistry of solids 74 36 UA library record; WoS full record; WoS citing articles
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
Amini, M.N.; Saniz, R.; Lamoen, D.; Partoens, B. The role of the VZn-NO-H complex in the p-type conductivity in ZnO 2015 Physical chemistry, chemical physics 17 20 UA library record; WoS full record; WoS citing articles
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
Govaerts, K.; Partoens, B.; Lamoen, D. Extended homologous series of Sn–O layered systems: A first-principles study 2016 Solid state communications 243 10 UA library record; WoS full record; WoS citing articles
Nikolaev, A.V.; Lamoen, D.; Partoens, B. Extension of the basis set of linearized augmented plane wave (LAPW) method by using supplemented tight binding basis functions 2016 The journal of chemical physics 145 11 UA library record; WoS full record; WoS citing articles
Bercx, M.; Sarmadian, N.; Saniz, R.; Partoens, B.; Lamoen, D. First-principles analysis of the spectroscopic limited maximum efficiency of photovoltaic absorber layers for CuAu-like chalcogenides and silicon 2016 Physical chemistry, chemical physics 18 34 UA library record; WoS full record; WoS citing articles
Sarmadian, N.; Saniz, R.; Partoens, B.; Lamoen, D. First-principles study of the optoelectronic properties and photovoltaic absorber layer efficiency of Cu-based chalcogenides 2016 Journal of applied physics 120 29 UA library record; WoS full record; WoS citing articles
Matsubara, M.; Saniz, R.; Partoens, B.; Lamoen, D. Doping anatase TiO2with group V-b and VI-b transition metal atoms: a hybrid functional first-principles study 2017 Physical chemistry, chemical physics 19 19 UA library record; WoS full record; WoS citing articles
Schouteden, K.; Govaerts, K.; Debehets, J.; Thupakula, U.; Chen, T.; Li, Z.; Netsou, A.; Song, F.; Lamoen, D.; Van Haesendonck, C.; Partoens, B.; Park, K. Annealing-Induced Bi Bilayer on Bi2Te3 Investigated via Quasi-Particle-Interference Mapping 2016 ACS nano 10 15 UA library record; WoS full record; WoS citing articles
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
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
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
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
Marikutsa, A.; Rumyantseva, M.; Gaskov, A.; Batuk, M.; Hadermann, J.; Sarmadian, N.; Saniz, R.; Partoens, B.; Lamoen, D. Effect of zinc oxide modification by indium oxide on microstructure, adsorbed surface species, and sensitivity to CO 2019 Frontiers in materials 6 11 UA library record; WoS full record; WoS citing articles
Mayda, S.; Monico, L.; Krishnan, D.; De Meyer, S.; Cotte, M.; Garrevoet, J.; Falkenberg, G.; Sandu, I.C.A.; Partoens, B.; Lamoen, D.; Romani, A.; Miliani, C.; Verbeeck, J.; Janssens, K. A combined experimental and computational approach to understanding CdS pigment oxidation in a renowned early 20th century painting 2023 Chemistry of materials 35 UA library record; WoS full record
Rahemi, V.; Sarmadian, N.; Anaf, W.; Janssens, K.; Lamoen, D.; Partoens, B.; De Wael, K. Unique opto-electronic structure and photo reduction properties of sulfur doped lead chromates explaining their instability in paintings 2017 Analytical chemistry 89 7 UA library record; WoS full record; WoS citing articles
Dabaghmanesh, S.; Saniz, R.; Amini, M.N.; Lamoen, D.; Partoens, B. Perovskite transparent conducting oxides : an ab initio study 2013 Journal of physics : condensed matter 25 17 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
Titantah, J.T.; Lamoen, D.; Neyts, E.; Bogaerts, A. The effect of hydrogen on the electronic and bonding properties of amorphous carbon 2006 Journal of physics : condensed matter 18 13 UA library record; WoS full record; WoS citing articles
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
Müller, E.; Kruse, P.; Gerthsen, D.; Schowalter, M.; Rosenauer, A.; Lamoen, D.; Kling, R. Measurement of the mean inner potential of ZnO nanorods by transmission electron holography 2005 Microscopy of Semiconducting Materials 107 UA library record; WoS full record;