首页|基于分子模拟的单体表面活性剂对岩尘润湿机制研究

基于分子模拟的单体表面活性剂对岩尘润湿机制研究

扫码查看
优选4种表面活性剂SDS、SDBS、AEO—7和DTAB,采用分子模拟的方法研究表面活性剂在岩尘润湿过程中的作用机制.结果表明:部分表面活性剂吸附在岩尘表面,部分在水相中聚集形成胶束表面活性剂,其极性头基指向水相,而疏水碳链高度缠绕在一起,极性基团与非极性碳链更靠近水相方向,有利于增强岩尘表面的亲水性.润湿过程以静电能为主导,并且亲水头基在界面排列地越疏松,极性头基周围可吸附的水分子越多,即润湿性越强.SDS、DTAB和AEO—7溶液均在高岭石体系中表现出较高的润湿性能,仅SDBS溶液对于提高白云母体系的润湿性较有优势,单体表面活性剂作用于高岭石的润湿效果最好.
Research on Wetting Mechanism of Monomeric Surfactants on Rock Dust Based on Molecular Simulation
The four surfactants of SDS,SDBS,AEO—7,and DTAB were selected,and the molecular simulation was used to study the mechanism of surfactant action in the wetting process of rock dust.The results show that some surfactants adsorb on the surface of rock dust,while others aggregate in the water phase to form micellar surfactants.Their polar head groups point towards the water phase,while hydrophobic carbon chains are highly intertwined.The polar and non-polar carbon chains are closer to the water phase direction,which is conducive to enhancing the hydrophilicity of the rock dust surface.The wetting process is dominated by electrostatic energy,and the looser the arrangement of hydrophilic head groups at the interface,the more water molecules can be adsorbed around the polar head groups,indicating stronger wettability.SDS,DTAB and AEO—7 solutions all show high wettability in Kaolinite system.Only SDBS solution has advantages in improving the wettability of Muscovite system,and the wetting effect of monomer surfactant on Kaolinite is the best.

SurfactantsHumidity performanceMolecular simulationRock dust

张兴润

展开 >

潞安化工集团 余吾煤业有限公司,山西 长治 046100

表面活性剂 湿润性能 分子模拟 岩尘

2024

晋控科学技术
大同煤矿集团有限责任公司

晋控科学技术

影响因子:0.228
ISSN:2097-2156
年,卷(期):2024.(2)
  • 4