First-principles study on stability, energy gaps, optical phonon and related parameters of In 1-x-yAl xGa yAs alloys

Journal of Solid State Chemistry

Volumn 192, Issue , 2012, Pages 161-167

  Ghebouli, M A ^a   Choutri, H ^a   Bouarissa, N ^b   Ghebouli, B ^c  

^a UNIVERSITY OF BORDJ BOU ARRERIDJ   (Algeria)

^b KING KHALID UNIVERSITY   (Saudi Arabia)

^c FERHAT ABBAS UNIVERSITY   (Algeria)

Author keywords

Band structure; DFT calculation; Effective masses; Structural properties

Indexed keywords

ACOUSTICAL PHONONS; BORN EFFECTIVE CHARGE; COUPLING PARAMETERS; DEFORMATION ENERGY; DFT CALCULATION; EFFECTIVE MASS; ELECTRON EFFECTIVE MASS; FIRST-PRINCIPLES STUDY; GA CONTENT; GAP ENERGY; OPTICAL PHONONS; VIRTUAL CRYSTAL APPROXIMATION;

BAND STRUCTURE; CALCULATIONS; CERIUM ALLOYS; DENSITY FUNCTIONAL THEORY; STRUCTURAL PROPERTIES;

GALLIUM;

EID: 84864152997     PISSN: 00224596     EISSN: 1095726X     Source Type: Journal    
DOI: 10.1016/j.jssc.2012.03.052     Document Type: Article

References (33)

1. S. Adachi J. Appl. Phys. 58 1985 R1-R21
2. G.H. Olsen, T.Z. Zamerowski, R.T. Smith, and E.P. Bertin J. Electron. Mater. 9 1980 977
3. The ABINIT computer code is a common project of the University Catholique of Louvain, Corning Incorporated and other contributors. Available online at: 〈http://www.abinit.org〉.
4. J.P. Perdew, K. Burke, and M. Ernzerhof Phys. Rev. Lett. 77 1996 3865
5. S. Goedecker, M. Teter, and J. Hutter Phys. Rev. B 54 1703 1996
6. C. Hartwigsen, S. Goedecker, and J. Hutter Phys. Rev. B 58 1998 3641
7. D. Vanderbilt Phys. Rev. B 41 1990 7892
8. H.J. Monkhorst, and J.D. Pack Phys. Rev. B 13 1976 5189
9. Nacir Tit J. Alloys Compd. 503 2010 529
10. A. Hafaiedh, and N. Bouarissa Mater. Chem. Phys. 2009 122
11. J. Whitaker Solid State Electron. 8 1965 649
12. K.-H. Hellwege, and O. Madelung Semi-Conductor, Intrinsic Properties of Group IV Elements and III-V, II-VI and I-VII Compounds, Landolt-Bornstein New Series, Group III 22 1982 Pt Springer Berlin
13. M. Briki, M. Abdelouhab, A. Zaoui, and M. Ferhat Superlattices Microstruct. 45 2009 80
14. M. Krieger, H. Sigg, N. Herres, K. Bachem, and K. Kohler Appl. Phys. Lett. 66 1995 682
15. K. Daoud, Kh. Bouamama, P. Djemia, and S.M. Chérif High Pressure Res. 31 2 2011 310
16. G.V. Sin'ko, and N.A. Smimov J. Phys. Condens. Matter 14 2002 6989
17. S.F. Pugh Philos. Mag. 45 1954 823
18. R. Hill, and Proc. Phys. Soc. London A 65 1952 349
19. W. Voigt Lehrbuch der Kristallphysik 1928 Teubner Leipzig
20. A. Reuss, and A. Angew Math. Mech. 9 1929 49
21. S.Q. Wang, and H.Q. Ye Phys. Status Solidi B 240 1 2003 45 54 10.1002/pssb.200301861 (Pubitemid 37417606)
22. F. Annane, H. Meradji, S. Ghemid, and F. El Haj Hassan Comput. Mater. Sci. 50 2010 274
23. B. Amrani Superlattices Microstruct. 40 2006 65
24. B. Monemar Phys. Rev. B 8 1973 5711
25. W. Nakwaski Physica B 210 1995 1 and references therein
26. A.N. Chantis, Mark van Schilfgaarde, and Takao Kotani Phys. Rev. Lett. 96 2006 0868405
27. S. Perkowitz, R. Sudharsanan, S.S. Yon, and T.J. Drummond Solid State Commun. 62 1987 645
28. R.E. Fern, and A. Onton J. Appl. Phys. 42 1971 3499
29. Stefano Gironcoli Paolo Giannozzi, P. Pavone, and Stefano Baroni Phys. Rev. B 43 1991 7231
30. N.E. Christensen, S. Satpathy, and Z. Pawlowska Phys. Rev. B 36 1987 1032
31. N. Bouarissa, and R. Bachiri Mater. Chem. Phys. 78 2003 271
32. D.J. Lockwood, Guolin Yu, and N.L. Rowell Solid State Commun. 136 2005 404
33. Halah Al Shhri, Nadir Bouarissa, and M. Ajmal Khan J. Lumin. 131 2011 2153