Van Speybroeck V - Search Results

1

Regio- and stereospecific ring opening of 1,1-dialkyl-2-(aryloxymethyl)aziridinium salts by bromide.

D'hooghe M, Van Speybroeck V, Waroquier M, De Kimpe N. D'hooghe M, et al. Among authors: van speybroeck v. Chem Commun (Camb). 2006 Apr 14;(14):1554-6. doi: 10.1039/b518298k. Epub 2006 Mar 2. Chem Commun (Camb). 2006. PMID: 16575458

2

Ab initio and experimental study on thermally degradable polycarbonates: the effect of substituents on the reaction rates.

Van Speybroeck V, Martelé Y, Waroquier M, Schacht E. Van Speybroeck V, et al. J Am Chem Soc. 2001 Oct 31;123(43):10650-7. doi: 10.1021/ja004075e. J Am Chem Soc. 2001. PMID: 11673996

3

The kinetics of cyclization reactions on polyaromatics from first principles.

Van Speybroeck V, Reyniers MF, Marin GB, Waroquier M. Van Speybroeck V, et al. Chemphyschem. 2002 Oct 18;3(10):863-70. doi: 10.1002/1439-7641(20021018)3:10<863::AID-CPHC863>3.0.CO;2-P. Chemphyschem. 2002. PMID: 12465185

4

Efficient use of bifunctional acid-base properties for alkylammonium formation in amine-substituted zeolites.

Lesthaeghe D, Van Speybroeck V, Waroquier M. Lesthaeghe D, et al. Among authors: van speybroeck v. J Am Chem Soc. 2004 Aug 4;126(30):9162-3. doi: 10.1021/ja048305r. J Am Chem Soc. 2004. PMID: 15281788

5

Density functional theory as a tool for the structure determination of radiation-induced bioradicals.

De Proft F, Pauwels E, Lahorte P, Van Speybroeck V, Waroquier M, Geerlings P. De Proft F, et al. Among authors: van speybroeck v. Magn Reson Chem. 2004 Oct;42 Spec no:S3-S19. doi: 10.1002/mrc.1444. Magn Reson Chem. 2004. PMID: 15366036

6

Ab initio study of free-radical polymerizations: cost-effective methods to determine the reaction rates.

Van Speybroeck V, Van Cauter JK, Coussens B, Waroquier M. Van Speybroeck V, et al. Among authors: van cauter jk. Chemphyschem. 2005 Jan;6(1):180-9. doi: 10.1002/cphc.200400277. Chemphyschem. 2005. PMID: 15688662

7

N-Alkenyl-2-aziridinylmethyl radicals and N-alkenylaminyl radicals in cascade cyclizations to pyrrolizidines and indolizidines.

Van Speybroeck V, De Kimpe N, Waroquier M. Van Speybroeck V, et al. J Org Chem. 2005 Apr 29;70(9):3674-81. doi: 10.1021/jo050067a. J Org Chem. 2005. PMID: 15845006

8

Ab initio group contribution method for activation energies of hydrogen abstraction reactions.

Saeys M, Reyniers MF, Van Speybroeck V, Waroquier M, Marin GB. Saeys M, et al. Among authors: van speybroeck v. Chemphyschem. 2006 Jan 16;7(1):188-99. doi: 10.1002/cphc.200500206. Chemphyschem. 2006. PMID: 16323223

9

Ab initio study of free-radical polymerization: polyethylene propagation kinetics.

Van Cauter K, Van Speybroeck V, Vansteenkiste P, Reyniers MF, Waroquier M. Van Cauter K, et al. Among authors: van speybroeck v. Chemphyschem. 2006 Jan 16;7(1):131-40. doi: 10.1002/cphc.200500249. Chemphyschem. 2006. PMID: 16404764

10

An extended hindered-rotor model with incorporation of Coriolis and vibrational-rotational coupling for calculating partition functions and derived quantities.

Vansteenkiste P, Van Neck D, Van Speybroeck V, Waroquier M. Vansteenkiste P, et al. Among authors: van neck d, van speybroeck v. J Chem Phys. 2006 Jan 28;124(4):044314. doi: 10.1063/1.2161218. J Chem Phys. 2006. PMID: 16460169

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