Behavior of molecular oxygen at the liquid–liquid interface: A molecular dynamics simulation study

2008 ◽  
Vol 457 (1-3) ◽  
pp. 78-81 ◽  
Author(s):  
Árpád Vincze ◽  
Pál Jedlovszky ◽  
Lívia B. Pártay ◽  
George Horvai
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Molecular Oxygen ◽  
Simulation Study ◽  
Liquid Interface ◽  
Dynamics Simulation

Liquid/liquid interface layering of 1-butanol and [bmim]PF6 ionic liquid: a nonlinear vibrational spectroscopy and molecular dynamics simulation study

2015 ◽  
Vol 17 (38) ◽  
pp. 24587-24597 ◽  
Author(s):  
Takashi Iwahashi ◽  
Tatsuya Ishiyama ◽  
Yasunari Sakai ◽  
Akihiro Morita ◽  
Doseok Kim ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Ionic Liquid ◽  
Molecular Dynamics Simulation ◽  
Vibrational Spectroscopy ◽  
Simulation Study ◽  
Md Simulation ◽  
Liquid Interface ◽  
Dynamics Simulation ◽  
Simulation Studies

IV-SFG vibrational spectroscopy and MD simulation studies reveal a local polar/nonpolar layering structure at the interface of 1-butanol-d9 and 1-butyl-3-methylimidazolium hexafluorophosphate ([bmim]PF6).

Sign in / Sign up

Export Citation Format

Share Document