Thermal degradable polycarbonates
Invited talk
Agfa Gevaert, Belgium
Thursday, 29 November, 2001
V. Van Speybroeck
Ab initio study of some elementary radical reactions in the coke formation: Influence of internal rotations on the reaction rates
Talk
Conference / event / venue
DFT2001
Vienna, Italy
Sunday, 14 January, 2001 to Wednesday, 17 January, 2001
Ab initio study of some elementary radical reactions in the coke formation: Influence of internal rotations on the reaction rates
Talk
Conference / event / venue
Spectroscopie en Theorie
Lunteren, The Netherlands
Monday, 29 January, 2001 to Tuesday, 30 January, 2001
Ab initio and experimental study on thermally degradable polycarbonates: the effect of substituents on the reaction rates
Talk
Conference / event / venue
POLYMER '01 The New Polymers: Design, Development and Applications
Bath, UK
Monday, 9 April, 2001 to Wednesday, 11 April, 2001
Ab-initio static and dynamic molecular simulations on elementary radical reactions in the coke formation
Talk
Conference / event / venue
9th International Conference on the Applications of the Density Functional Theory in Chemistry and Physics
Madrid, Spain
Monday, 10 September, 2001 to Friday, 14 September, 2001
Reactivity and kinetics of polyaromatic hydrocarbons in elementary radical reactions
Talk
Conference / event / venue
EUCO-CC4, 4th European Conference on Computational Chemistry
Assisi, Italy
Sunday, 1 September, 2002 to Friday, 6 September, 2002
Kinetics of 1-hexene isomerization with methane sulphonic acid from first principles
Invited talk
Conference / event / venue
Eurokin meeting
Terneuzen, The Netherlands
Monday, 25 November, 2002
Free radical polymerizations: kinetic parameters in terms of the length of the polymer chain (Invited)
Talk
Conference / event / venue
Symposium 'Simulation approaches for investigating the reaction mechanisms and properties of polymers'
Namur, Belgium
Monday, 16 June, 2003
Study of radical defects in crystalline lattices from first principles molecular dynamics simulations
Talk
Conference / event / venue
DFT2003 conference: "The applications of Density Functional Theory in Chemistry and Physics
Brussels (Belgium)
Sunday, 7 September, 2003 to Friday, 12 September, 2003
The Car-Parrinello molecular dynamics method and its ability to discover new reaction pathways
Talk
Conference / event / venue
Graduate Course on Theoretical Chemistry and Spectroscopy
Han-sur-Lesse, Belgium
Monday, 8 December, 2003 to Friday, 12 December, 2003
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