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Comparison of the influence of fluorocarbon and hydrocarbon surfactants on the adsorptions of SDS, DTAB and C _(12)E _8 at the air/water interface by MD simulation

机译:碳氢化合物和碳氢化合物表面活性剂对SDS,DTAB和C _(12)E _8在空气/水界面吸附的影响的MD模拟比较

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摘要

Adsorptions of sodium dodecylsulfate (SDS), dodecyltrimethylammonium bromide (DTAB) and octaethylene glycol monododecyl ether (C _(12)E _8) at the air/water interface in the presence of hydrocarbon and fluorocarbon surfactants (HCEP and FCEP) were investigated by molecular dynamics (MD) simulation. With the addition of HCEP or FCEP, the monolayer is more organized than in individual surfactant systems. Extremely expanded C _(12)E _8 chain in a smaller tilt angle is discovered in C _(12)E _8/HCEP system. In SDS or DTAB systems, relatively small tilt angle of surfactants is observed in the presence of FCEP. Their analog, a silicone surfactant DSEP shows a favorable effect on interfacial properties with DTAB.
机译:通过分子研究了十二烷基硫酸钠,十二烷基三甲基溴化铵(DTAB)和八甘醇单十二烷基醚(C _(12)E _8)在碳氢化合物和碳氟化合物表面活性剂(HCEP和FCEP)存在下在空气/水界面的吸附。动力学(MD)模拟。通过添加HCEP或FCEP,单层的结构比单独的表面活性剂系统更为有序。在C _(12)E _8 / HCEP系统中发现了以较小倾斜角极大扩展的C _(12)E -8链。在SDS或DTAB系统中,在FCEP存在下观察到相对较小的表面活性剂倾斜角。他们的类似物有机硅表面活性剂DSEP对与DTAB的界面性能显示出有利的影响。

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