Comparative studies of the ground state properties for Nb 25Mo25Ta25W25and V 20Nb20Mo20Ta20W20

Authors

Oleg N. Starovoytov, Southern University and A&M College
Michael Gao, National Energy Technology Laboratory, Albany
Shengmin Guo, Louisiana State University
Ebrahim Khosravi, Southern University and A&M College
Jialin Lei, Southern University and A&M College
Liuxi Tan, Southern University and A&M College
Shizhong Yang, Southern University and A&M College

Document Type

Conference Proceeding

Publication Date

4-25-2013

Abstract

Refractory metal high entropy alloys are potential candidates for industrial applications in high temperature and corrosive environment. Comparative studies of Nb25Mo25Ta25W 25 and V20Nb20Mo20Ta 20W20 alloys are performed using first-principles calculations. Ground state structures, bulk modulus, and charge density are calculated using first principles density functional theory method. The results from ab initio calculations were compared with available experimental data. The effect of alloying on structural and elastic properties of HEAs was discussed.

Publication Source (Journal or Book title)

TMS Annual Meeting

First Page

1139

Last Page

1145

Recommended Citation

Starovoytov, O., Gao, M., Guo, S., Khosravi, E., Lei, J., Tan, L., & Yang, S. (2013). Comparative studies of the ground state properties for Nb 25Mo25Ta25W25and V 20Nb20Mo20Ta20W20. TMS Annual Meeting, 1139-1145. Retrieved from https://repository.lsu.edu/mechanical_engineering_pubs/994