Pauline Delcroix, Marco Pagliai, Gianni Cardini, Didier Bégué, Benjamin Hanoune. Structural and Spectroscopic Properties of Methanediol in Aqueous Solutions from Quantum Chemistry Calculations and Ab Initio Molecular Dynamics Simulations.
The Journal of Physical Chemistry A, 2015, The Journal of Physical Chemistry A, 119 (2), pp.290-298.
⟨10.1021/jp510759r⟩.
⟨hal-02958159⟩