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© Jean-Claude MOSCHETTI / IRCER / CNRS Images



Simulation numérique par la théorie de la fonctionnelle de la densité (DFT) de nanoclusters modèles

Digital simulation of model nanoclusters using density functional theory (DFT). The aim is to study the structural stability of metal oxide nanoparticles and determine the effect of size and local structural disorder on their electronic properties.

CNRS Institute(s)

Scientific topics

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