Pregled bibliografske jedinice broj: 941966
Molecular dynamics simulations and femtosecond optical Kerr effect spectroscopy of methanol/acetone mixtures
Molecular dynamics simulations and femtosecond optical Kerr effect spectroscopy of methanol/acetone mixtures // Journal of Molecular Liquids, 159 (2011), 1; 60-69 doi:10.1016/j.molliq.2010.10.005 (međunarodna recenzija, članak, znanstveni)
CROSBI ID: 941966 Za ispravke kontaktirajte CROSBI podršku putem web obrasca
Naslov
Molecular dynamics simulations and femtosecond optical Kerr effect spectroscopy of methanol/acetone mixtures
Autori
Polok, K. ; Gadomski, W. ; Sokolić, F. ; Zoranić, L.
Izvornik
Journal of Molecular Liquids (0167-7322) 159
(2011), 1;
60-69
Vrsta, podvrsta i kategorija rada
Radovi u časopisima, članak, znanstveni
Ključne riječi
Optical Kerr effect ; Molecular dynamics ; Methanol ; Acetone
Sažetak
Herewith we present the results of our studies on the dynamics of acetone/methanol binary mixtures by means of molecular dynamics simulations and femtosecond optical Kerr effect (OKE) spectroscopy. The OKE response exhibits the apparent dependence on a mole fraction of the mixture components, and thus carries the information about the influence of its composition on the intermolecular interactions and momentary local structures. The molecular dynamics simulations, which take into account the reorientational dynamics of the molecules, have been performed in order to explain the concentration dependence of the long time part of the experimental OKE response.
Izvorni jezik
Engleski
Znanstvena područja
Fizika
Citiraj ovu publikaciju:
Časopis indeksira:
- Current Contents Connect (CCC)
- Web of Science Core Collection (WoSCC)
- Science Citation Index Expanded (SCI-EXP)
- SCI-EXP, SSCI i/ili A&HCI
- Scopus
