Self-assembled structure of sulfonic gemini surfactant solution

被引:17
作者
Deng, Xuejian [1 ]
Yang, Yu [1 ,2 ]
Ma, Yue [1 ]
Sun, Xiaoliang [1 ]
Zhou, Guanggang [1 ]
Wu, Haicheng [1 ]
Lu, Guiwu [1 ]
机构
[1] China Univ Petr, Coll Sci, Beijing 102249, Peoples R China
[2] Beijing Optoelect Technol Co Ltd, Beijing 100015, Peoples R China
关键词
DISSIPATIVE PARTICLE DYNAMICS; DODECYL-SULFATE MICELLE; AGGREGATION BEHAVIOR; AQUEOUS-SOLUTION; MESOSCOPIC SIMULATION; CHEMISTRY; WATER;
D O I
10.1063/1.5040684
中图分类号
TB3 [工程材料学];
学科分类号
0805 ; 080502 ;
摘要
Sulfonate gemini surfactant is a new type of anionic gemini surfactant. The unique structure of double sulfonate endows the sulfonate gemini surfactant with superior surfactant properties, including lower critical micelle concentration (CMC), unusual decontamination ability, excellent stability in strong acid/alkali solution. In this paper, the self-assembled structure of gemini dodecyl sulfonate sodium, abbreviated as 12-2-12(SO3Na)(2), is studied by using of dissipative particle dynamics (DPD) method. We have constructed a spring structure model of surfactant molecules, and the effect of length hydrophobic chain, the concentration of surfactants, ethanol addictive on the self-assembly behavior and critical micelle concentration (CMC) was investigated. The results show that with the increase of the concentration of surfactants in aqueous solution, spherical, wormlike and layered micelles appear in turn. With the increase of the length of the hydrophobic chain, the clusters of the surfactants become tighter and the larger clusters are presented at the lower concentration. It was found that the addition of ethanol molecule can enhance the solubility of hydrophobic group and thus inhibit the formation of the micelles. (C) 2018 Author(s).
引用
收藏
页数:9
相关论文
共 27 条
[1]   Molecular dynamics simulation of sodium dodecyl sulfate micelle in water: Micellar structural characteristics and counterion distribution [J].
Bruce, CD ;
Berkowitz, ML ;
Perera, L ;
Forbes, MDE .
JOURNAL OF PHYSICAL CHEMISTRY B, 2002, 106 (15) :3788-3793
[2]   Multilayered Polymersome Formed by Amphiphilic Asymmetric Macromolecular Brushes [J].
Chang, Hung-Yu ;
Lin, Yung-Lung ;
Sheng, Yu-Jane .
MACROMOLECULES, 2012, 45 (11) :4778-4789
[3]   Dissipative particle dynamics (DPD) simulations with fragment molecular orbital (FMO) based effective parameters for 1-Palmitoyl-2-oleoyl phosphatidyl choline (POPC) membrane [J].
Doi, Hideo ;
Okuwaki, Koji ;
Mochizuki, Yuji ;
Ozawa, Taku ;
Yasuoka, Kenji .
CHEMICAL PHYSICS LETTERS, 2017, 684 :427-432
[4]  
El-Said W. A., 2018, MAT CHEM PHYS
[5]   Dependence of thermodynamic properties of model systems on some dissipative particle dynamics parameters [J].
Goicochea, A. Gama ;
Romero-Bastida, M. ;
Lopez-Rendon, R. .
MOLECULAR PHYSICS, 2007, 105 (17-18) :2375-2381
[6]   Dissipative particle dynamics: Bridging the gap between atomistic and mesoscopic simulation [J].
Groot, RD ;
Warren, PB .
JOURNAL OF CHEMICAL PHYSICS, 1997, 107 (11) :4423-4435
[7]  
Guo H., 2013, J CHEM PHYS, V139, P423
[8]  
Heermann D.W., 1986, COMPUTER SIMULATION
[9]   SIMULATING MICROSCOPIC HYDRODYNAMIC PHENOMENA WITH DISSIPATIVE PARTICLE DYNAMICS [J].
HOOGERBRUGGE, PJ ;
KOELMAN, JMVA .
EUROPHYSICS LETTERS, 1992, 19 (03) :155-160
[10]   Surface Properties of Gemini Surfactants in Ethanol-Water Mixtures [J].
Hu Shang-Lin ;
Lu Ting ;
Lan Yu-Ru ;
Huang Jian-Bin .
ACTA PHYSICO-CHIMICA SINICA, 2008, 24 (12) :2309-2313