Promising anchoring groups for ZnO-based hybrid materials: A periodic density functional theory investigation

Tangui Le Bahers (1) , Thierry Pauporte (1) , Fabrice Odobel (2) , Frédéric Labat (1) , Ilaria Ciofini

1 LECIME - Laboratoire d'Electrochimie, Chimie des Interfaces et Modélisation pour l'Energie (LECIME - UMR 7575)
2 LSO - Laboratoire de Synthèse Organique

Domaines: Chimie

Tangui Le Bahers, Thierry Pauporte, Fabrice Odobel, Frédéric Labat, Ilaria Ciofini. Promising anchoring groups for ZnO-based hybrid materials: A periodic density functional theory investigation. International Journal of Quantum Chemistry, 2012, 112 (9), pp.2062 - 2071. ⟨10.1002/qua.23134⟩. ⟨hal-01899205⟩