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Results: 5

Authors: Pauwels, E Van Speybroeck, V Lahorte, P Waroquier, M
Citation: E. Pauwels et al., Density functional calculations on alanine-derived radicals: Influence of molecular environment on EPR hyperfine coupling constants, J PHYS CH A, 105(38), 2001, pp. 8794-8804

Authors: Van Speybroeck, V Borremans, Y Van Neck, D Waroquier, M Wauters, S Saeys, M Marin, GB
Citation: V. Van Speybroeck et al., Ab initio study of radical reactions: Cyclization pathways for the butylbenzene radical (II), J PHYS CH A, 105(32), 2001, pp. 7713-7723

Authors: Van Neck, D Waroquier, M Peirs, K Van Speybroeck, V Dewulf, Y
Citation: D. Van Neck et al., upsilon-representability of one-body density matrices - art. no. 042512, PHYS REV A, 6404(4), 2001, pp. 2512

Authors: Van Speybroeck, V Martele, Y Waroquier, M Schacht, E
Citation: V. Van Speybroeck et al., Ab initio and experimental study on thermally degradable polycarbonates: The effect of substituents on the reaction rates, J AM CHEM S, 123(43), 2001, pp. 10650-10657

Authors: Van Speybroeck, V Van Neck, D Waroquier, M Wauters, S Saeys, M Marin, GB
Citation: V. Van Speybroeck et al., Ab initio study of radical addition reactions: Addition of a primary ethylbenzene radical to ethene (I), J PHYS CH A, 104(46), 2000, pp. 10939-10950
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