大分子固液界面吸附行为的数字模拟研究方法

Random Computer Simulation of Macromolecules Adsorption

介绍了随机数字模拟方法在研究链状大分子吸附行为的一般原理,以立方格子模型的自避行走为例,分析了模型的建立、初始位形的产生以及分子链运动的处理方法.回顾了随机数字模拟方法在研究大分子界面吸附行为方面的发展状况.预测了随机数字模拟方法在大分子吸附行为研究方面的应用前景.

The general principles of studying the macromolecules adsorption behaviors by means of random compute simulation are introduced. The simulations are focused on the method of building the selfavoiding walk model and the means of dealing with the motion of macromolecule chains. The statues of studying the macromolecules adsorption behaviors by means of random compute simulation are reviewed and the development trend in future is predicted. 