Hostname: page-component-5c6d5d7d68-pkt8n Total loading time: 0 Render date: 2024-08-16T17:26:01.449Z Has data issue: false hasContentIssue false
  • English
  • Français

Full Potential Lmto Study of Tial Alloy

Published online by Cambridge University Press:  28 February 2011

Pradeep K. Khowash ,
David L. Price  and
Bernard R. Cooper
Pradeep K. Khowash
Affiliation:
Department of Physics, West Virginia University, Morgantown, WV, 26506
David L. Price
Affiliation:
Department of Physics, Memphis State University, TN, 38152
Bernard R. Cooper
Affiliation:
Department of Physics, West Virginia University, Morgantown, WV, 26506
Get access

Abstract

We have used a full potential all electron LMTO total energy calculation with a true interstitial to establish a baseline understanding of pure γ-TiAl. The c and a lattice parameters, Bulk modulus and the Young's modulus are calculated and found to be in excellent agreement with reported experimental values.

Type
Research Article
Information
MRS Online Proceedings Library (OPL) , Volume 186: Symposium I – Alloy Phase Stability and Design , 1990 , 47
Copyright
Copyright © Materials Research Society 1991

Access options

Get access to the full version of this content by using one of the access options below. (Log in options will check for institutional or personal access. Content may require purchase if you do not have access.)

References

1. Price, D. L. and Cooper, B. R., Phys. Rev. B 39, 4959 (1988)Google Scholar
2. Price, D. L. and Cooper, B. R., J. Vac. Sci. Technol. A 7, 2049, (1989).Google Scholar
3. Price, D. L. and Cooper, B. R., Mat. Res. Soc, 141, 393, (1989).Google Scholar
4. Ceperly, D. M. and Alder, B. J., Phys Rev. Lett, 45, 566, (1980).Google Scholar
5. Perdew, J.P. and Zunger, A., Phys. Rev. B. 23, 5048, (1981).Google Scholar
6. Srivastava, G.P., J. Phys. A 17 L317 (1984).Google Scholar
7. Weinert, M., Wimmer, E., and Freeman, A.J., Phys. Rev. B 26 4571 (1982).Google Scholar
8. Chubb, S. R., Papaconstantopoulos, D. A. and Klein, B. M., Phy. Rev B 38, 12120, (1988).Google Scholar
9. Bumps, E. S., Kessler, H. D., and Hansen, M., Trans AIME 194, 609, (1952).Google Scholar