Partitioning of butanol between a hydrophobic ionic liquid and aqueous phase: Insights from Liquid Liquid Equilibria measurements and Molecular Dynamics simulations

2016 ◽  
Vol 425 ◽  
pp. 421-431 ◽  
Author(s):  
Pyarimohan Dehury ◽  
Upasana Mahanta ◽  
Tamal Banerjee
Keyword(s):  
Molecular Dynamics ◽  
Ionic Liquid ◽  
Molecular Dynamics Simulations ◽  
Aqueous Phase ◽  
Hydrophobic Ionic Liquid ◽  
Dynamics Simulations

Microscopic properties of ionic liquid/organic semiconductor interfaces revealed by molecular dynamics simulations

2018 ◽  
Vol 20 (18) ◽  
pp. 13075-13083 ◽  
Author(s):  
Yasuyuki Yokota ◽  
Hiroo Miyamoto ◽  
Akihito Imanishi ◽  
Jun Takeya ◽  
Kouji Inagaki ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Ionic Liquid ◽  
Molecular Dynamics Simulations ◽  
Organic Semiconductors ◽  
Organic Semiconductor ◽  
Dynamic Properties ◽  
Semiconductor Interfaces ◽  
Dynamics Simulations

Structural and dynamic properties of an ionic liquid are compared on several organic semiconductors.

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