高岭石插层过程的理论计算进展

Progress on Theoretical Calculation of Kaolinite Intercalation Process

高岭石插层是实现高岭石高值化的一个重要调控手段。从理论计算的角度研究高岭石插层过程的原子、分子尺度的微观机制,是目前黏土矿物改性的一个重要研究手段和发展趋势。针对高岭石无机小分子、有机小分子和有机大分子插层3个研究方向的理论计算研究进展,进行了总结和归纳,并对高岭石插层的理论计算未来发展方向进行了展望。

Intercalation is a significant control method to achieve high value of kaolinite.It is important to investigate the intercalation process of kaolinite for the perspective of atomic and molecular scale and energy.This review represented recent work on theoretical calculation of intercalated kaolinite,i.e.,the intercalation of inorganic and organic small molecules as well as organic macromolecular.In addition,the future development direction of intercalation of kaolinite was also prospected.