The ground state elemental crystals as a benchmark set for solid state DFT properties
P21
Poster
Conference / event / venue
DFTM2012
Ghent, Belgium
Sunday, 1 April, 2012 to Friday, 6 April, 2012
S. Cottenier
Computational materials design for electricity generation in the 22nd century
Invited talk
Conference / event / venue
(presenting author S. Cottenier) 4th Workshop on novel methods for electronic structure calculations, and 1st southamerican congress on materials
La Plata (Argentina)
Wednesday, 2 November, 2011 to Friday, 4 November, 2011
Reactivity of CO on clean and carbon covered cobalt surfaces in Fischer-Tropsch synthesis
p. 230
Poster
Conference / event / venue
XIIIth Netherlands' Catalysis and Chemistry Conference (NCCC XIII)
Noordwijkerhout, The Netherlands
Monday, 5 March, 2012 to Wednesday, 7 March, 2012
Reactivity of CO on clean and carbon covered cobalt surfaces in Fischer-Tropsch synthesis
http://www.cecam.org/workshop-3-699.html?poster_id=7746
Poster
Conference / event / venue
MolSim2012
Amsterdam
Monday, 9 January, 2012 to Friday, 20 January, 2012
The ground state elemental crystals as a benchmark set for solid state DFT: intrinsic accuracy and code comparison
Poster
Conference / event / venue
QCB10
Brussels, Belgium
Friday, 10 February, 2012
Modelling of the enthalpy of mixing for the development of new 'bulk metallic glasses' (BMG)
Poster
Conference / event / venue
OCAS PhD Day
Zelzate, Belgium
Thursday, 10 June, 2010
Ab initio calculations on the enthalpy of formation in the FeCr-system
Poster
Conference / event / venue
CAMD Summer School 2010
Lyngby, Denmark
Saturday, 14 August, 2010 to Friday, 20 August, 2010
Modelling of the enthalpy of mixing for the development of new 'bulk metallic glasses' (BMG)
Poster
Conference / event / venue
CAMD Summer School 2010
Lyngby, Denmark
Saturday, 14 August, 2010 to Friday, 20 August, 2010
A new challenge to molecular spectroscopy: The quadrupole shift as a second order correction to the isomer shift
Poster
Conference / event / venue
High Resolution Molecular Spectroscopy 2009
Castellamare di Stabia, Italy
Tuesday, 31 August, 2010 to Saturday, 4 September, 2010
Crystalline Fe under TPa pressures: simple or complex?
Poster
Conference / event / venue
Psi-k Conference
Berlin, Germany
Sunday, 12 September, 2010 to Thursday, 16 September, 2010
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