화학공학소재연구정보센터
Chemical Physics Letters, Vol.408, No.4-6, 348-353, 2005
Structural and electronic properties of liquid InSb alloy: An ab initio molecular-dynamics simulation
The structural and electronic properties of liquid InSb have been simulated by using ab initio molecular dynamics. The calculated results indicate that the covalent bonds of In-Sb similar to those of c-InSb are preserved in liquid state, and the Sb clusters have open structure while the In clusters have close-packed structure. (c) 2005 Elsevier B.V. All rights reserved.