Structuration and Dynamics of Interfacial Liquid Water at Hydrated gamma-Alumina Determined by Ab Initio Molecular Simulations: Implications for Nanoparticle Stability

Romain Réocreux (1) , Tao Jiang, (1) , Marcella Iannuzzi , Carine Michel (1) , Philippe Sautet (2)

1 LC - Laboratoire de Chimie - UMR5182
2 UCLA - University of California [Los Angeles]

Domaines: Chimie théorique et/ou physique; Catalyse; Matériaux

Romain Réocreux, Tao Jiang,, Marcella Iannuzzi, Carine Michel, Philippe Sautet. Structuration and Dynamics of Interfacial Liquid Water at Hydrated gamma-Alumina Determined by Ab Initio Molecular Simulations: Implications for Nanoparticle Stability. ACS Applied Nano Materials, 2018, 1, pp.191-199. ⟨10.1021/acsanm.7b00100⟩. ⟨hal-01817161⟩