Molecular dynamics simulations of side chain pendants of perfluorosulfonic acidpolymer electrolyte membranes

2013 ◽  
Vol 1 (3) ◽  
pp. 557-569 ◽  
Author(s):  
Anurag Prakash Sunda ◽  
Arun Venkatnathan
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Side Chain ◽  
Electrolyte Membranes ◽  
Dynamics Simulations

scholarly journals Molecular dynamics simulations of the self-organization of side-chain decorated polyaromatic conjugation molecules: phase separated lamellar and columnar structures and dispersion behaviors in toluene solvent

RSC Advances ◽  
2018 ◽  
Vol 8 (20) ◽  
pp. 11134-11144 ◽  
Author(s):  
Lanyan He ◽  
Pingmei Wang ◽  
Lipeng He ◽  
Zhou Qu ◽  
Jianhui Luo ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Molecular Dynamic ◽  
Md Simulations ◽  
The Self ◽  
Self Organization ◽  
Side Chain ◽  
Dynamics Simulations

The self-organization of five model side-chain decorated polyaromatic asphaltene molecules with or without toluene solvent was investigated by means of molecular dynamic (MD) simulations.

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