金属纳米粒子在新材料研究领域中有着广泛的应用。人们对金属纳米粒子的氧化行为通过理论和实验进行了深入的研究,其中计算机模拟研究是非常重要的方法。本文简要介绍了微观尺度层次上的计算机模拟方法,在此基础上综述了国内外金属纳米粒子氧化行为的计算机模拟研究进展。
Metallic nanoparticles are widely used in the study of new material fields. The oxidation of metallic nanoparticles has been studied deeply and computer simulation is a useful method in the studies. The present paper briefly introduces current simulation methods in microcosmic scales ,and reviews the computer simulation studies in the last 20 years on Oxidation of metallic nanoparticles.