Stefaan Cottenier
Stefaan Cottenier
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Cited by
Cited by
Reproducibility in density functional theory calculations of solids
K Lejaeghere, G Bihlmayer, T Björkman, P Blaha, S Blügel, V Blum, ...
Science 351 (6280), 2016
Density Functional Theory and the family of (L) APW-methods: a step-by-step introduction
S Cottenier
Instituut voor Kern-en Stralingsfysica, KU Leuven, Belgium 4 (0), 41, 2002
Error estimates for solid-state density-functional theory predictions: an overview by means of the ground-state elemental crystals
K Lejaeghere, V Van Speybroeck, G Van Oost, S Cottenier
Critical Reviews in Solid State and Materials Sciences 39 (1), 1-24, 2014
Electronic structure of transparent oxides with the Tran–Blaha modified Becke–Johnson potential
H Dixit, R Saniz, S Cottenier, D Lamoen, B Partoens
Journal of Physics: Condensed Matter 24 (20), 205503, 2012
Electronic structure and band gap of zinc spinel oxides beyond LDA: ZnAl2O4, ZnGa2O4 and ZnIn2O4
H Dixit, N Tandon, S Cottenier, R Saniz, D Lamoen, B Partoens, ...
New Journal of Physics 13 (6), 063002, 2011
What density-functional theory can tell us about the spin-density wave in Cr
S Cottenier, B De Vries, J Meersschaut, M Rots
Journal of Physics: Condensed Matter 14 (12), 3275, 2002
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
The magnetization of γ′‐Fe4N: theory vs. experiment
ELP Blancá, J Desimoni, NE Christensen, H Emmerich, S Cottenier
physica status solidi (b) 246 (5), 909-928, 2009
The abinit project: Impact, environment and recent developments
X Gonze, B Amadon, G Antonius, F Arnardi, L Baguet, JM Beuken, ...
Computer Physics Communications 248, 107042, 2020
Error estimates for density-functional theory predictions of surface energy and work function
S De Waele, K Lejaeghere, M Sluydts, S Cottenier
Physical Review B 94 (23), 235418, 2016
Valency of rare earths in and Ab initio analysis of electric-field gradients
SJ Asadabadi, S Cottenier, H Akbarzadeh, R Saki, M Rots
Physical Review B 66 (19), 195103, 2002
Hyperfine fields and local lattice relaxation at and impurities in bcc iron
S Cottenier, H Haas
Physical Review B 62 (1), 461, 2000
Temperature dependence of the electric-field gradient in hcp-Cd from first principles
D Torumba, K Parlinski, M Rots, S Cottenier
Physical Review B 74 (14), 144304, 2006
First-principles study of possible shallow donors in ZnAlO spinel
H Dixit, N Tandon, S Cottenier, R Saniz, D Lamoen, B Partoens
Physical Review B 87 (17), 174101, 2013
Hyperfine interactions at lanthanide impurities in Fe
D Torumba, V Vanhoof, M Rots, S Cottenier
Physical Review B 74 (1), 014409, 2006
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
Transition metal impurities on the bond-centered site in germanium
S Decoster, S Cottenier, B De Vries, H Emmerich, U Wahl, JG Correia, ...
Physical review letters 102 (6), 065502, 2009
Solving the Christoffel equation: Phase and group velocities
JW Jaeken, S Cottenier
Computer Physics Communications 207, 445-451, 2016
Is the Isomer State of Spherical?
R Chevrier, JM Daugas, L Gaudefroy, Y Ichikawa, H Ueno, M Hass, ...
Physical review letters 108 (16), 162501, 2012
Reactivity of CO on carbon-covered cobalt surfaces in Fischer–Tropsch synthesis
L Joos, IAW Filot, S Cottenier, EJM Hensen, M Waroquier, ...
The Journal of Physical Chemistry C 118 (10), 5317-5327, 2014
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