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 TitleAuthors / EditorsDate
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Diastereoselectivity of octahedral cobalt(II) pybox complexes Provent, Christophe; Bernardinelli, Gérald Hugues; Williams, Alan Francis; Vulliermet, Nathalie 2001
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Extended Rodlike Polyaromatic Receptors with Bent Tridentate Units Complexed to Lanthanide Metal Ions Nozary, Homayoun; Piguet, Claude; Rivera, Jean-Pierre; Tissot, Paul; ... Bünzli, Jean-Claude G. 2000
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Investigation théorique du mécanisme de physisorption : application d'une méthode de partition fondée sur la fonctionnelle de la densité Vulliermet, Nathalie 2000
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Theoretical study of the physisorption of CO on metal oxide surfaces using the KSCED-DFT approach Vulliermet, Nathalie; Wesolowski, Tomasz Adam; Weber, Jacques 1998
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Numerical evalutation of the internal orbitally resolved chemical hardness tensor : second order chemical reactivity through thermal density functional theory Grigorov, Martin G.; Weber, Jacques; Vulliermet, Nathalie; Chermette, Henry; Tronchet, Jean M.J. 1998
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Study of the physisorption of CO on the MgO(110) surface using the approach of Kohn-Sham equations with constrained electron density Wesolowski, Tomasz Adam; Vulliermet, Nathalie; Weber, Jacques 1998