J. Mater. Sci. Technol. ›› 1992, Vol. 8 ›› Issue (6): 443-447.
Molecular Dynamics Simulation of Liquid Noble Metals Au and Ag
LI Qingchun CHEN Kuiying ** Dept.of Metals and Technology,Harbin Institute of Technology,Harbin,150006,China+ To whom correspondence should be addressed
- Dept.ofMetalsandTechnology,HarbinInstituteofTechnology,Harbin,150006,China;Dept.ofMetalsandTechnology,HarbinInstituteofTechnology,Harbin,150006,China
Molecular Dynamics Simulation of Liquid Noble Metals Au and Ag
LI Qingchun CHEN Kuiying ** Dept.of Metals and Technology,Harbin Institute of Technology,Harbin,150006,China+ To whom correspondence should be addressed
摘要： <正> 1.IntroductionRecently Daw and Baskes[1,2]proposed the embedded atom model(EAM)on the basisof quasi-atom concept[3]and density-function theory.It is applicable to the transition met-als as well as the simple metals.It has been widely used in point defect[4],surface[5]andthermal expansion[6].Foiles[7]made the application of the EAM to liquid transition metalsand showed that the EAM also provided a realistic description of the energetics and structure