Diffusion of e centers in germanium predicted using GGAU approach

Applied Physics Letters

Volumn 99, Issue 7, 2011, Pages

  Tahini, H ^a   Chroneos, A ^b   Grimes, R W ^a   Schwingenschlogl U ^c   Bracht, H ^d  

^a IMPERIAL COLLEGE LONDON   (United Kingdom)

^b UNIVERSITY OF CAMBRIDGE   (United Kingdom)

^c KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY   (Saudi Arabia)

^d UNIVERSITY OF MÜNSTER   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CHARGED STATE; DENSITY FUNCTIONAL THEORY CALCULATIONS; DIFFUSION ACTIVATION ENERGY; DONOR ATOMS; E-CENTER;

ACTIVATION ENERGY; ARSENIC; DENSITY FUNCTIONAL THEORY; GERMANIUM; PHOSPHORUS;

DIFFUSION;

EID: 80052097964     PISSN: 00036951     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3625939     Document Type: Article

References (19)

1. Germanium-Based Technologies-From Materials to Devices, edited by, C. Claeys, and, E. Simoen, (Elsevier, Amsterdam, 2007).
2. S. Brotzmann and H. Bracht, J. Appl. Phys. 103, 033508 (2008). 10.1063/1.2837103 (Pubitemid 351263917)
3. A. Chroneos, R. W. Grimes, B. P. Uberuaga, and H. Bracht, Phys. Rev. B 77, 235208 (2008). 10.1103/PhysRevB.77.235208
4. A. Chroneos, H. Bracht, R. W. Grimes, and B. P. Uberuaga, Appl. Phys. Lett. 92, 172103 (2008). 10.1063/1.2918842 (Pubitemid 351624897)
5. G. Kresse and D. Joubert, Phys. Rev. B 59, 1758 (1999). 10.1103/PhysRevB.59.1758
6. P. E. Blchel, Phys. Rev. B 50, 17953 (1994). 10.1103/PhysRevB.50.17953
7. J. P. Perdew, M. Ernzerhof, and K. Burke, J. Chem. Phys. 105, 9982 (1996). 10.1063/1.472933
8. H. J. Monkhorst and J. D. Pack, Phys. Rev. B 13, 5188 (1976). 10.1103/PhysRevB.13.5188
9. M. I. J. Probert and M. C. Payne, Phys. Rev. B 67, 75204 (2003). 10.1103/PhysRevB.67.075204
10. A. Chroneos and C. A. Londos, J. Appl. Phys. Lett. 107, 093518 (2010).
11. R. M. Nieminen, Modell. Simul. Mater. Sci. Eng. 17, 084001 (2009). 10.1088/0965-0393/17/8/084001
12. A. Krukau, O. Vydrov, A. Izmaylov, and G. Scuseria, J. Chem. Phys. 125, 224106 (2006). 10.1063/1.2404663 (Pubitemid 44927407)
13. G. Henkelman, B. P. Uberuaga, and H. Jonsson, J. Chem. Phys. 113, 9901 (2000). 10.1063/1.1329672 (Pubitemid 32076883)
14. S. Lany and A. Zunger, Modell. Simul. Mater. Sci. Eng. 17, 084002 (2009). 10.1088/0965-0393/17/8/084002
15. S. Lany and A. Zunger, Phys. Rev. B 78, 235104 (2008). 10.1103/PhysRevB.78.235104
16. S. M. Sze, The Physics of Semiconductor Devices (Wiley, New York, 2006).
17. H. P. Singh, Acta Crystallogr. A 24, 469 (1968). 10.1107/ S056773946800094X
18. H. Hhler, N. Atodiresei, K. Schroeder, R. Zeller, and P. Dederichs, Phys. Rev. B 71, 35212 (2005). 10.1103/PhysRevB.71.035212 (Pubitemid 40396408)
19. S. M. Hu, Phys. Status Solidi B 60, 595 (1973). 10.1002/pssb.v60:2