Oxidation Effect for the Carbon Related Defect Formation in SiC/SiO2 Interface by First Principles Calculation

Article Preview

Abstract:

We used first principles molecular dynamics calculations to study the formation of defects at the 4H-SiC(0001)/SiO2 interface by thermal oxidation. O2 molecules introduced at the interface easily form the C-C-C defect structure along with the Si-O-Si structure. The central carbon atom in the C-C-C defect is three-fold coordinated and it induces mid-gap states, which correspond to the energy level of the (C2)Si defect structure, known as the dumb-bell structure.

You might also be interested in these eBooks

Info:

Periodical:

Pages:

131-134

Citation:

Online since:

May 2017

Export:

Price:

Permissions CCC:

Permissions PLS:

Сopyright:

© 2017 Trans Tech Publications Ltd. All Rights Reserved

Share:

Citation:

* - Corresponding Author

[1] H. Yano, F. Katafuchi, T. Kimoto, H. Matsunami, IEEE Trans. Electron Device. Vol. 45, no. 3 (1999).

Google Scholar

[2] S. Dimirijev, and P. Jamet, Microelectron. Rel. 43, 225 (2003).

Google Scholar

[3] V. V. Afanasev, M. Bassler, G. Pensl, M. Schulz, Phys. Stat. Sol. 162, 321 (1997).

DOI: 10.1002/1521-396x(199707)162:1<321::aid-pssa321>3.0.co;2-f

Google Scholar

[4] J. Rozen, A. C. Ahyi, X. Zhu, L. C. Feldman, IEEE Trans. Electron Devices. Vol. 58, no. 11, pp.3808-3811, Nov. (2011).

DOI: 10.1109/ted.2011.2164800

Google Scholar

[5] F. Yan, R. P. Devaty, W. J. Choyke, A. Gali, T. Kimoto, T. Oshima, G. Pensl, Appl. Phys. Lett. 100, 132107 (2012).

Google Scholar

[6] A. Fissel, W. Richter, J. Furthmüller, F. Bechstedt, Appl. Phys. Lett. 78, 2512 (2012).

Google Scholar

[7] A. Gali, N. T. Son, E. Janzen, Phys. Rev. B 73, 033204 (2006).

Google Scholar

[8] A. Zywietz, J. Furthmüller, F. Bechstedt, Phys. Rev. B 59, 23 (1999).

Google Scholar

[9] K. Chokawa, K. Kato, K. Kamiya, K. Shiraishi, Mater. Sci. Forum 740-742, pp.469-472 (2013).

Google Scholar

[10] G. Kresse, J. Furthmüller, Phys. Rev. B 54, 11169 (1996).

Google Scholar

[11] G. Kresse, D. Joubert, Phys. Rev. B 59, 1758 (1999).

Google Scholar

[12] J. P. Perdew, K. Burke, M. Ernzerhof, Phys. Rev. Lett. 77, 3865 (1996).

Google Scholar

[13] P. E. Blöchl, Phys. Rev. B 50, 17953 (1994).

Google Scholar

[14] K. Momma, F. Izumi, J. Appl. Crystallorg, 44, 1272 (2011).

Google Scholar