Michele Ceotto

Quantum instanton approximation for thermal rate constants of chemical reactions

William H. Miller, Yi Zhao, Michele Ceotto et al. · The Journal of Chemical Physics · 2003 · 181 citations

Quantum Dynamic, Engineering, Instanton Picture +22

A Close Look at the Structure of the TiO₂-APTES Interface in Hybrid Nanomaterials and Its Degradation Pathway: An Experimental and Theoretical Study

Daniela Meroni, Leonardo Lo Presti, Giovanni Di Liberto et al. · The Journal of Physical Chemistry C · 2016 · 153 citations · Full text

Electronic Structure of Pure and N-Doped TiO₂ Nanocrystals by Electrochemical Experiments and First Principles Calculations

Francesca Spadavecchia, G. Cappelletti, S. Ardizzone et al. · The Journal of Physical Chemistry C · 2011 · 130 citations

Engineering, Inorganic Photochemistry, Solid-state Chemistry +19

Multiple coherent states for first-principles semiclassical initial value representation molecular dynamics

Michele Ceotto, Sule Atahan, Gian Franco Tantardini et al. · The Journal of Chemical Physics · 2009 · 98 citations · Full text

Multiple Coherent States, Quantum Dynamic, Vibronic Interaction +15

Wettability of bare and fluorinated silanes: A combined approach based on surface free energy evaluations and dipole moment calculations

G. Cappelletti, S. Ardizzone, Daniela Meroni et al. · Journal of Colloid and Interface Science · 2012 · 91 citations

Materials Science, Materials Engineering, Surface Characterization +10