DocumentCode :
2467353
Title :
Approaching charged polymer brushes
Author :
Chen, Long ; Merlitz, Holger ; He, Su-zhen ; Wu, Chen-xu ; Sommer, Jens-Uwe
Author_Institution :
Dept. of Phys., Xiamen Univ., Xiamen, China
fYear :
2011
fDate :
24-26 June 2011
Firstpage :
5749
Lastpage :
5751
Abstract :
Off-lattice MD-simulations of polyelectrolyte brushes in good solvent are compared with various different mean-field theories. We demonstrate the importance of excluded volume effects under the present solvent conditions, which had intentionally been left out in some of the classical mean-field approaches of Pincus or Zhuina et al. We evaluate the accuracy of the Debye-approximation in the simulations and of a recently introduced self-consistent-field theory by Biesheuvel et al. Finally, we discuss the significance of finite extensibility of the chains that is of particular importance for charged systems.
Keywords :
chemical engineering; polymers; solvents (industrial); Debye-approximation; charged polymer brushes; off-lattice MD-simulations; polyelectrolyte brushes; self-consistent-field theory; solvent; Approximation methods; Brushes; Equations; Ions; Mathematical model; Polymers; Solvents; Debye approximation; SCF; excluded volume; finite extensibility; mean-field; polyelectrolyte brushes;
fLanguage :
English
Publisher :
ieee
Conference_Titel :
Remote Sensing, Environment and Transportation Engineering (RSETE), 2011 International Conference on
Conference_Location :
Nanjing
Print_ISBN :
978-1-4244-9172-8
Type :
conf
DOI :
10.1109/RSETE.2011.5965659
Filename :
5965659
Link To Document :
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