First principles calculations of mechanical properties of the YV O4 single crystal

Journal of Applied Physics

Volumn 102, Issue 2, 2007, Pages

  Zhang, Jian ^a   Wang, Jiyang ^a   Zhang, Huaijin ^a   Wang, Chunlei ^a   Cong, Hengjiang ^a   Deng, Longjiang ^b  

^a SHANDONG UNIVERSITY   (China)

^b UNIVERSITY OF ELECTRONIC SCIENCE AND TECHNOLOGY OF CHINA   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ANISOTROPY; CHARGE DENSITY; CRYSTAL LATTICES; GEOMETRY; MECHANICAL PROPERTIES; OPTIMIZATION;

ELASTIC STIFFNESS CONSTANTS; FIRST PRINCIPLES;

SINGLE CRYSTALS;

EID: 34547605004     PISSN: 00218979     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2757003     Document Type: Article

References (17)

1. J. D. Kinsleg and G. W. Luduig, J. Appl. Phys. 41, 370 (1970).
2. K. Chow and H. G. Mcknight, Mater. Res. Bull. 8, 1343 (1973).
3. J. R. O'Connor, Appl. Phys. Lett. 9, 407 (1966).
4. P. P. Yaney and L. G. de Shazer, J. Opt. Soc. Am. 66, 1405 (1976).
5. R. A. Fields, M. Birnbaum, and C. L. Fincher, Appl. Phys. Lett. 51, 188 (1987).
6. S. Frdei and F. W. Ainger, J. Cryst. Growth 128, 1025 (1993).
7. W. Koechner, Solid-State Laser Engineering, 4th ed. (Springer-Verlag, Heidelberg, 1996), pp. 393-426.
8. W. Ruju, L. Fengying, W. Xing, and Y. Huaguang, Chin. J. Lasers 27, 449 (2000).
9. X. Peng, A. Asundi, Y. Chen, and Z. Xiong, Appl. Opt. 40, 1396 (2001).
10. M. D. Segall, P. J. D. Lindan, M. J. Probert, C. J. Pickard, P. J. Hasnip, S. J. Clark, and M. C. Payne, J. Phys.: Condens. Matter 14 (11), 2717 (2002).
11. P. Hohenberg and W. Kohn, Phys. Rev. 136, B864 (1964).
12. M. Levy, Proc. Natl. Acad. Sci. U.S.A. 76, 6062 (1979).
13. D. M. Ceperley and B. J. Alder, Phys. Rev. Lett. 45, 566 (1980).
14. J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 77, 3865 (1996).
15. M. C. Payne, M. P. Teter, D. C. Allan, T. A. Arias, and J. D. Joannopoulos, Rev. Mod. Phys. 64, 1045 (1992).
16. B. C. Chakoumakos, M. M. Abraham, and L. A. Boatner, J. Solid State Chem. 109, 197 (1994).
17. H. Zhang, J. Liu, J. Wang, C. Wang, L. Zhu, Z. Shao, X. Meng, X. Hu, and M. Jiang, J. Opt. Soc. Am. B 19 (1), 18 (2002).