Onderzoeker
Reinout Declerck
- Disciplines:Astronomie en ruimtewetenschappen, Andere fysica, Klassieke fysica, Elementaire deeltjesfysica en hoge-energie fysica
Affiliaties
- Vakgroep Fysica en Sterrenkunde (Departement)
Lid
Vanaf1 okt 2005 → 30 sep 2008
Publicaties
1 - 8 van 8
- Influence of protein environment on the EPR properties of flavoprotein radicals: a QM/MM study(2010)
Auteurs: Ewald Pauwels, Reinout Declerck, Toon Verstraelen, Bart De Sterck, CWM Kay
Aantal pagina's: 1 - Influence of protein environment on the electron paramagnetic resonance properties of flavoprotein radicals: a QM/MM study(2010)
Auteurs: Ewald Pauwels, Reinout Declerck, Toon Verstraelen, Bart De Sterck, Christopher WM Kay
Pagina's: 16655 - 16665 - Multi-level modeling of silica-template interactions during initial stages of zeolite synthesis(2009)
Auteurs: Toon Verstraelen, Bartomiej M Szyja, Reinout Declerck, Antonius PJ Jansen, Alexander Aerts, Lana RA Follens, Johan A Martens, Christine EA Kirschhock, Rutger A van Santen
Pagina's: 1261 - 1271 - Insight into the solvation and isomerization of 3-halo-1-azaallylic anions from ab initio metadynamics calculations and NMR experiments(2009)
Auteurs: Reinout Declerck, Bart De Sterck, Toon Verstraelen, Guido Verniest, Jan Jacobs, Norbert De Kimpe
Pagina's: 580 - 584 - Development and Implementation of Theoretical Methods for the Calculation of EPR Parameters in Periodic Simulations(2008)
Auteurs: Reinout Declerck
- Molecular environment and temperature dependence of hyperfine interactions in sugar crystal radicals from first principles(2008)
Auteurs: Reinout Declerck, Ewald Pauwels, Veronique Van Speybroeck, Michel Waroquier
Pagina's: 1508 - 1514 - Evidence for a Grotthuss-like mechanism in the formation of the rhamnose alkoxy radical based on periodic DFT calculations(2008)
Auteurs: Ewald Pauwels, Reinout Declerck, Veronique Van Speybroeck, Michel Waroquier
Pagina's: 8 - 18 - Magnetic linear response properties calculations with Gaussian and augmented-plane-wave method
Auteurs: Valery Weber, Marcella Iannuzzi, Samuele Giani, Juerg Hutter, Reinout Declerck