运用EAM(embed atom method)作用势,采用非平衡分子动力学模拟获得Al熔体的偶分布函数与黏度数值随温度的变化曲线,偶分布函数的计算结果与实验值符合得较好.对模拟所得到的黏度数据编程实现黏度的Arrhenius公式拟合,得到激活能E.并利用模拟所得到的黏度值及激活能对Lennard-Jones(L-J)作用势进行修正,获得黏度与偶分布函数及原子间相互作用势之间的关系式,两条黏度拟合曲线与分子动力模拟结果符合得比较好,说明拟合程序的编写是比较成功的,实现了对L-J作用势的修正.该研究为金属及合金原子间相互作用势的建立提供了新的思路.
The SiC gradiently coated carbon fiber/carbon （Cf/C） composites were prepared by a two-step rapid chemical liquid deposition （RCLD） method. The microstructure and properties of the composites were investigated using X-ray diffraction, scanning electron microscopy together with energy dispersive X-ray analysis, bending tests, and oxidation tests. The experimental results show that the surface layer of the composites is composed of SiC, pyrocarbon, and carbon fibers. Their inner area consists of pyrocarbon and carbon fibers. The SiC content gradiently decreases with increasing distance from the outer surface to the center of the composites. Furthermore, the thickness of the SiC layer increases with increasing tetraethylorthosilicate content and deposition time. SiC coatings have no significant influence on the bending strength of the composites. However, the oxidation resistance of the composites increases with increasing thickness of the SiC layer.
