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Results: 1-13 |
Results: 13

Authors: Loffreda, D Delbecq, F Simon, D Sautet, P
Citation: D. Loffreda et al., Alloying effects on N-O stretching frequency: A density functional theory study of the adsorption of NO on Pd3Mn (100) and (111) surfaces, J PHYS CH B, 105(15), 2001, pp. 3027-3033

Authors: Bernard, M Delbecq, F Fache, F Sautet, P Lemaire, M
Citation: M. Bernard et al., Dithiourea ligands in the rhodium-catalyzed hydride-transfer reduction of ketones - A theoretical and experimental approach, EUR J ORG C, (8), 2001, pp. 1589-1596

Authors: Guiral, V Delbecq, F Sautet, P
Citation: V. Guiral et al., Origin of the enantioselectivity in the hydrogen transfer reduction of carbonyls by a rhodium(I) complex: A theoretical study, ORGANOMETAL, 20(11), 2001, pp. 2207-2214

Authors: Loffreda, D Delbecq, F Simon, D Sautet, P
Citation: D. Loffreda et al., Breaking the NO bond on Rh, Pd, and Pd3Mn alloy (100) surfaces: A quantum chemical comparison of reaction paths, J CHEM PHYS, 115(17), 2001, pp. 8101-8111

Authors: Renouprez, AJ Trillat, JF Bergeret, G Delichere, P Rousset, JL Massardier, J Loffreda, D Simon, D Delbecq, F Sautet, P
Citation: Aj. Renouprez et al., Pd-Mn silica-supported catalysts 2. Description of the catalytic sites andsurface properties for CO and NO chemisorption, J CATALYSIS, 198(2), 2001, pp. 243-255

Authors: Robert, F Delbecq, F Nguefack, C Sinou, D
Citation: F. Robert et al., Chiral 4-(diphenylphosphanyl)-1-(dialkylamino)butane ligands - Synthesis, applications in asymmetric alkylation and theoretical study, EUR J INORG, (2), 2000, pp. 351-358

Authors: Besson, M Delbecq, F Gallezot, P Neto, S Pinel, C
Citation: M. Besson et al., Asymmetric synthesis of 2-methyl cyclohexane carboxylic acids by heterogeneous catalysis: Mechanistic aspects, CHEM-EUR J, 6(6), 2000, pp. 949-958

Authors: Guiral, V Delbecq, F Sautet, P
Citation: V. Guiral et al., Hydride transfer reduction of carbonyls by a rhodium(I) complex: A theoretical study. 1. The two-step mechanism, ORGANOMETAL, 19(8), 2000, pp. 1589-1598

Authors: Bernard, M Delbecq, F Sautet, P Fache, F Lemaire, M
Citation: M. Bernard et al., Catalytic asymmetric hydride transfer reduction of ketones with rhodium and chiral diamine ligands: Approach of the active species structure by DFT calculations, ORGANOMETAL, 19(26), 2000, pp. 5715-5722

Authors: Delbecq, F Lapouge, C
Citation: F. Delbecq et C. Lapouge, Regioselectivity of the nucleophilic addition to (eta(3)-allyl) palladium complexes. A theoretical study, ORGANOMETAL, 19(14), 2000, pp. 2716-2723

Authors: Delbecq, F Sautet, P
Citation: F. Delbecq et P. Sautet, Density functional periodic study of CO adsorption on the Pd3Mn(100) alloysurface: Comparison with Pd(100), PHYS REV B, 59(7), 1999, pp. 5142-5153

Authors: Delbecq, F Sautet, P
Citation: F. Delbecq et P. Sautet, NO chemisorption on a magnetic alloy surface: a density-functional periodic study of Pd3Mn(100) compared with Pd(100), SURF SCI, 442(3), 1999, pp. 338-348

Authors: Delbecq, F Sautet, P
Citation: F. Delbecq et P. Sautet, Interplay between magnetism and chemisorption: a theoretical study of CO and NO adsorption on a Pd3Mn alloy surface, CHEM P LETT, 302(1-2), 1999, pp. 91-97
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