Self-Diffusion Coefficients in Liquid Ag Using the Embedded Atom Model Based Effective Pair Potentials

Authors : Seyfettin DALGIÇ, Mutlu ÇOLAKOĞULLARI

Pages : 303-310

Doi:10.3906/zoo-1205-10

View : 22 | Download : 7

Publication Date : 0000-00-00

Article Type : Research Paper

Abstract :We present the dynamical properties of liquid Ag at different temperatures, using the Mishin and Doyoma-Kagure version of the Embedded Atom Model insert ignore into journalissuearticles values(EAM); potentials. They have been evaluated within the framework of the mode-coupling theory, using a self-consistent scheme that uses as input data only the static structure functions and the interatomic pair potentials of the liquid Ag. We have computed single-particle and collective time dependent properties of liquid Ag, and thereby calculated its self-diffusion constants. We have also discussed our results comparing with both experimental data and results of molecular dynamic simulation.
Keywords : Dynamic Properties, Self diffusion