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Corinne Lacaze-Dufaure

Centre national de la recherche scientifique

6

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79

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Density functional study of copper segregation in aluminum

2011 Surface Science
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First Computational Evidence of a Competitive Stepwise and Concerted Mechanism for the Reduction of Antimalarial Endoperoxides

2010 Journal of Physical Chemistry B
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Optimized intermolecular potential for nitriles based on Anisotropic United Atoms model

2008 Journal of Molecular Modeling
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Electrochemical reduction of G3-factor endoperoxide and its methyl ether : Evidence for a competition between concerted and stepwise dissociative electron transfer

2007 Chemistry: A European Journal
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A DFT study of the G3-Factor and derivatives

2007 Journal of Molecular Structure-theochem
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