Laddar...

Structural and Spectroscopic Properties of Water Around Small Hydrophobic Solutes

We investigated the structural, dynamical and spectroscopic properties of water molecules around a solvated methane by means of Car-Parrinello molecular dynamics simulations. Despite their mobility, in the first-shell water molecules are dynamically displaced in a clathrate-like cage around the hydr...

Full beskrivning

Sparad:
Bibliografiska uppgifter
Huvudupphovsmän: Montagna, Maria, Sterpone, Fabio, Guidoni, Leonardo
Materialtyp: Artigo
Språk:Inglês
Publicerad: 2012
Ämnen:
Länkar:https://ncbi.nlm.nih.gov/pmc/articles/PMC3789940/
https://ncbi.nlm.nih.gov/pubmed/22946539
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp303213m
Taggar: Lägg till en tagg
Inga taggar, Lägg till första taggen!