Understanding intrinsic light absorption properties of UiO-66 frameworks: a combined theoretical and experimental study K Hendrickx, DEP Vanpoucke, K Leus, K Lejaeghere, ... Inorganic chemistry 54 (22), 10701-10710, 2015 | 179 | 2015 |
Formation of Pt-induced Ge atomic nanowires on Pt/Ge (001): A density functional theory study DEP Vanpoucke, G Brocks Physical Review B—Condensed Matter and Materials Physics 77 (24), 241308, 2008 | 174 | 2008 |
A Flexible Photoactive Titanium Metal–Organic Framework Based on a [TiIV3(μ3‐O)(O)2(COO)6] Cluster B Bueken, F Vermoortele, DEP Vanpoucke, H Reinsch, CC Tsou, ... Angewandte Chemie International Edition 54 (47), 13912-13917, 2015 | 116 | 2015 |
First-Principles Study of Antisite Defect Configurations in ZnGa2O4:Cr Persistent Phosphors A De Vos, K Lejaeghere, DEP Vanpoucke, JJ Joos, PF Smet, ... Inorganic chemistry 55 (5), 2402-2412, 2016 | 115 | 2016 |
Aliovalent doping of CeO 2: DFT study of oxidation state and vacancy effects DEP Vanpoucke, P Bultinck, S Cottenier, V Van Speybroeck, ... Journal of Materials Chemistry A 2 (33), 13723-13737, 2014 | 108 | 2014 |
Extending Hirshfeld‐I to bulk and periodic materials DEP Vanpoucke, P Bultinck, I Van Driessche Journal of Computational Chemistry 34 (5), 405-417, 2013 | 95 | 2013 |
New Functionalized Metal–Organic Frameworks MIL-47-X (X = −Cl, −Br, −CH3, −CF3, −OH, −OCH3): Synthesis, Characterization, and CO2 Adsorption Properties S Biswas, DEP Vanpoucke, T Verstraelen, M Vandichel, S Couck, K Leus, ... The Journal of Physical Chemistry C 117 (44), 22784-22796, 2013 | 94 | 2013 |
Density functional theory study of LaCeO: Disordered fluorite versus pyrochlore structure DEP Vanpoucke, P Bultinck, S Cottenier, V Van Speybroeck, ... Physical Review B—Condensed Matter and Materials Physics 84 (5), 054110, 2011 | 53 | 2011 |
Mechanical properties from periodic plane wave quantum mechanical codes: the challenge of the flexible nanoporous MIL-47 (V) framework DEP Vanpoucke, K Lejaeghere, V Van Speybroeck, M Waroquier, ... The Journal of Physical Chemistry C 119 (41), 23752-23766, 2015 | 49 | 2015 |
Tetravalent Doping of CeO2: The Impact of Valence Electron Character on Group IV Dopant Influence DEP Vanpoucke, S Cottenier, V Van Speybroeck, I Van Driessche, ... Journal of the American Ceramic Society 97 (1), 258-266, 2014 | 47 | 2014 |
Pt-induced nanowires on Ge (001): A density functional theory study DEP Vanpoucke, G Brocks Physical Review B—Condensed Matter and Materials Physics 81 (8), 085410, 2010 | 46 | 2010 |
Rationality: A social-epistemology perspective S Wenmackers, DEP Vanpoucke, I Douven Frontiers in psychology 5, 581, 2014 | 42 | 2014 |
Probability of inconsistencies in theory revision: a multi-agent model for updating logically interconnected beliefs under bounded confidence S Wenmackers, DEP Vanpoucke, I Douven The European Physical Journal B 85, 1-15, 2012 | 41 | 2012 |
Mechanochemical route to the synthesis of nanostructured Aluminium nitride SA Rounaghi, H Eshghi, S Scudino, A Vyalikh, DEP Vanpoucke, ... Scientific reports 6 (1), 33375, 2016 | 36 | 2016 |
Reply to ‘comment on “extending Hirshfeld‐I to bulk and periodic materials”’ DEP Vanpoucke, I Van Driessche, P Bultinck Journal of Computational Chemistry 34 (5), 422-427, 2013 | 36 | 2013 |
Aqueous CSD approach for the growth of novel, lattice-tuned La x Ce 1− x O δ epitaxial layers V Narayanan, P Lommens, K De Buysser, DEP Vanpoucke, R Huehne, ... Journal of Materials Chemistry 22 (17), 8476-8483, 2012 | 35 | 2012 |
Can europium atoms form luminescent centres in diamond: A combined theoretical–experimental study DEP Vanpoucke, SS Nicley, J Raymakers, W Maes, K Haenen Diamond and Related Materials 94, 233-241, 2019 | 32 | 2019 |
Tuning of CeO2 buffer layers for coated superconductors through doping DEP Vanpoucke, S Cottenier, V Van Speybroeck, P Bultinck, ... Applied surface science 260, 32-35, 2012 | 31 | 2012 |
Modeling 1D structures on semiconductor surfaces: synergy of theory and experiment DEP Vanpoucke Journal of Physics: Condensed Matter 26 (13), 133001, 2014 | 28 | 2014 |
Convergence of atomic charges with the size of the enzymatic environment DEP Vanpoucke, J Oláh, F De Proft, V Van Speybroeck, G Roos Journal of chemical information and modeling 55 (3), 564-571, 2015 | 27 | 2015 |