The study of correlations between hydrogen bonding characteristics in liquid, sub- and supercritical methanol. Molecular dynamics simulations and Raman spectroscopy analysisElectronic supplementary information (ESI) available. See DOI: 10.1039/c3fd00103b

Molecular dynamics (MD) studies of hydrogen bonding (H-bonding) in liquid, sub- and supercritical methanol have been performed in a wide range of thermodynamic parameters of state, using various potential models and two H-bond criteria. It was shown that there is the universal correlation between th...

Ausführliche Beschreibung

Bibliographische Detailangaben

Hauptverfasser:	Idrissi, Abdenacer, Oparin, Roman D, Krishtal, Sergey P, Krupin, Sergey V, Vorobiev, Evgeny A, Frolov, Andrey I, Dubois, Leo, Kiselev, Mikhail G
Format:	Artikel
Sprache:	eng
Online-Zugang:	Volltext
Tags:	Tag hinzufügen Keine Tags, Fügen Sie den ersten Tag hinzu!