× Warning! Note that elemental potentials taken from alloy descriptions may not work well for the pure species. This is particularly true if the elements were fit for compounds instead of being optimized separately. As with all interatomic potentials, please check to make sure that the performance is adequate for your problem.

× Updated! Potentials that share interactions are now listed as related models.

2009--Kang-K-H-Sa-I-Lee-J-C-et-al--Cu-Ag

Citation: K.-H. Kang, I. Sa, J.-C. Lee, E. Fleury, and B.-J. Lee (2009), "Atomistic modeling of the Cu–Zr–Ag bulk metallic glass system", Scripta Materialia, 61(8), 801-804. DOI: 10.1016/j.scriptamat.2009.07.002.

Abstract: In order to investigate the phase separation behavior in Cu–Zr–Ag bulk metallic glasses (BMGs) on an atomic level, a modified embedded-atom interatomic method potential for the Cu–Zr–Ag system has been newly developed. A clear tendency of phase separation of Ag-rich phases could be observed in the supercooled liquid, in reasonable agreement with experimental information. The potential can be used for atomistic investigations of the effects of alloying element Ag on a wide range of amorphous properties of Cu–Zr BMG.

LAMMPS pair_style meam (2009--Kang-K-H--Cu-Ag--LAMMPS--ipr1)

See Computed Properties
Notes: These files are based on files obtained from http://cmse.postech.ac.kr/home_2nnmeam.
File(s):

library.meam
AgCu.meam