Effect of semicore orbitals on the electronic band gaps of Si, Ge, and GaAs within the GW approximation

Physical Review B - Condensed Matter and Materials Physics

Volumn 69, Issue 12, 2004, Pages

  Tiago, Murilo L ^a,b   Ismail Beigi, Sohrab ^a,b,c   Louie, Steven G ^a,b  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b LAWRENCE BERKELEY NATIONAL LABORATORY   (United States)

^c Yale University   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ARSENIC; GALLIUM; GERMANIUM; SILICON;

ARTICLE; ATOM; CALCULATION; ELECTRIC POTENTIAL; ELECTRON; ELECTRONICS; ENERGY; MATERIALS; MATHEMATICAL ANALYSIS; STANDARD;

EID: 2342418884     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.69.125212     Document Type: Article

References (26)

1. M.S. Hybertsen and S.G. Louie: Phys. Rev. B: 34, 5390 (1986).
2. W.G. Aulbur, L. Jönsson, and J.W. Wilkins, Solid State Physics, edited by F. Seitz, D. Turnbull, and H. Ehrenreich (Academic, New York, 2000), Vol. 54, p. 1.
3. F. Aryasetiawan and O. Gunnarsson: Rep. Prog. Phys.: 61, 237 (1998).
4. P.E. Blöchl: Phys. Rev. B: 50, 17 953 (1994).
5. N. Hamada, M. Hwang, and A.J. Freeman: Phys. Rev. B: 41, 3620 (1990).
6. T. Kotani and M. van Schilfgaarde: Solid State Commun.: 121, 461 (2002).
7. W. Ku and A.G. Eguiluz: Phys. Rev. Lett.: 89, 126401 (2002).
8. S. Lebègue, B. Arnaud, M. Alouani, and P.E. Blöchl: Phys. Rev. B: 67, 155208 (2003).
9. E.L. Shirley, X. Zhu, and S.G. Louie: Phys. Rev. B: 56, 6648 (1997).
10. R.M. Dreizler and E.K.U Gross, Density Functional Theory: An Approach to the Quantum Many-body Problem (Springer-Verlag, Berlin, 1990).
11. J.P. Perdew and A. Zunger: Phys. Rev. B: 23, 5048 (1981).
12. N. Troullier and J.L. Martins: Phys. Rev. B: 43, 1993 (1990).
13. G.P. Kerker: J. Phys. C: 13, L189 (1980).
14. M. Rohlfing, P. Krüger, and J. Pollmann: Phys. Rev. B: 57, 6485 (1998).
15. L. Hedin and S. Lundqvist, Solid State Physics (Academic, New York, 2000), Vol. 23, p. 1.
16. L. Kleinman and D.M. Bylander: Phys. Rev. Lett.: 48, 1425 (1982).
17. H.J. Monkhorst and J.D. Pack: Phys. Rev. B: 13, 5188 (1976).
18. M.S. Hybertsen and S.G. Louie: Phys. Rev. B: 34, 2920 (1986).
19. F. Aryasetiawan and O. Gunnarsson: Phys. Rev. B: 54, 17 564 (1996).
20. A. Fleszar and W. Hanke: Phys. Rev. B: 56, 10 228 (1997).
21. U. von Barth and B. Holm: Phys. Rev. B: 54, 8411 (1996);
22. U. von Barth and B. Holm: Phys. Rev. B: 55, 10 120 (1997);
23. B. Holm and U. von Barth, Phys. Rev. B 57, 2108 (1998).
24. W-D. Schöne and A.G. Eguiluz: Phys. Rev. Lett.: 81, 1662 (1998).
25. Landolt-Börnstein, Numerical Data and Functional Relationships in Science and Technology, edited by K.-H. Hellwege, O. Madelung, M. Schulz, and H. Weiss, New Series Vol. III, Pt. 22a (Springer-Verlag, New York, 1987).
26. P. Lautenschlager, M. Garriga, S. Logothetidis, and M. Cardona: Phys. Rev. B: 35, 9174 (1987).