Surfactant chain length and concentration influence on the interfacial tension of two immiscible model liquids: a coarse-grained approach

被引:16
作者
Catarino Centeno, R. [1 ,2 ]
Bustamante-Rendon, R. A. [2 ]
Hernandez-Fragoso, J. S. [3 ]
Arroyo-Ordonez, I. [2 ]
Perez, E. [3 ,4 ]
Alas, S. J. [3 ]
Gama Goicochea, A. [2 ]
机构
[1] Univ Autonoma San Luis Potosi, Fac Ciencias, Posgrad Ciencias Aplicadas, Lateral Av Salvador Nava S-N, San Luis Potosi 78290, San Luis Potosi, Mexico
[2] Tecnol Estudios Super Ecatepec, Div Ingn Quim & Bioquim, Posgrad Ingn Quim, Av Tecnol, Mexico City 55210, DF, Mexico
[3] Univ Autonoma Metropolitana, Unidad Cuajimalpa, Dept Ciencias Nat, Posgrad Ciencias Nat & Ingn, Av Vasco Quiroga 4871, Mexico City 05300, DF, Mexico
[4] Univ Autonoma San Luis Potosi, Inst Fis, Alvaro Obregon 64, San Luis Potosi 78000, San Luis Potosi, Mexico
关键词
Interfacial tension; Surfactant chain length; Adsorption; Critical micelle concentration; Dissipative particle dynamics; DISSIPATIVE PARTICLE DYNAMICS; MONTE-CARLO-SIMULATION; MESOSCOPIC SIMULATION; MICELLE FORMATION; AQUEOUS-SOLUTION; ADSORPTION; MICELLIZATION; SYSTEMS; AGGREGATION; DEPENDENCE;
D O I
10.1007/s00894-017-3474-x
中图分类号
Q5 [生物化学]; Q7 [分子生物学];
学科分类号
071010 ; 081704 ;
摘要
The interfacial tension between immiscible liquids is studied as a function of a model linear surfactant length and concentration using coarse-grained, dissipative particle dynamics numerical simulations. The adsorption isotherms obtained from the simulations are found to be in agreement with Langmuir's model. The reduction of the interfacial tension with increasing surfactant concentration is found to display some common characteristics for all the values of chain length modeled, with our predictions being in agreement with Szyszkowski's equation. Lastly, the critical micelle concentration is predicted for all surfactant lengths, finding exponentially decaying behavior, in agreement with Kleven'smodel. It is argued that these findings can be helpful guiding tools in the interpretation of available experiments and in the design of new ones with new surfactants and polymers.
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页数:8
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