Formation of a Cmcm phase in SnS at high pressure; an ab initio constant pressure study

Solid State Communications

Volumn 150, Issue 17-18, 2010, Pages 870-874

  Alptekin, Sebahaddin ^a   Durandurdu, Murat ^b,c  

^a CANKIRI KARATEKIN UNIVERSITY   (Turkey)

^b UNIVERSITY OF TEXAS AT EL PASO   (United States)

^c AHI EVRAN UNIVERSITY   (Turkey)

Author keywords

A. Semiconductors; C. Phase transformation

Indexed keywords

AB INITIO; AB INITIO TECHNIQUES; BI-LAYER; CONSTANT PRESSURES; HIGH PRESSURE; HIGH TEMPERATURE; LAYERED STRUCTURES; PHASE CHANGE; PHASE TRANSFORMATION; PRESSURE-INDUCED PHASE TRANSFORMATIONS; ROCK SALT; TOTAL ENERGY CALCULATION;

SEMICONDUCTOR QUANTUM DOTS;

EID: 77949489947     PISSN: 00381098     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ssc.2010.02.002     Document Type: Article

References (21)

1. Bhatia K.L., Parthasarathy G., Gosain D.P., and Gopal E.S.R. Phys. Rev. B 33 (1986) 1492
2. Hsueh H.C., Vass H., Clark S.J., Ackland G.J., and Crain J. Phys. Rev. B 51 (1995) 16750
3. Hsueh H.C., Warren W.C., Vass H., Ackland G.J., Clark S.J., and Crain J. Phys. Rev. B 53 (1996) 14806
4. Onodera A., Sakamoto I., Fujii Y., Mori N., and Sugai S. Phys. Rev. B 56 (1997) 7935
5. T. Chattopadhyay, A. Werner, H.G. von Schnering, in: C. Homan, R.K. MacCrone, E. Whalley (Eds.), High Pressure in Science and Technology, MRS Symposia Proceedings No. 22, (Materials Research Society, Pittsburgh, 1984), p. 83.
6. Khvostantzev K.G., and Sidorov V.A. Phys. Status Solidi B 116 (1983) 83
7. Redon A.M., and Leger J.M. High Press. Res. 4 (1990) 315
8. Durandurdu M. Phys. Rev. B 72 (2005) 144106
9. Wiedemeir H., and Csillag F.J. Z. Kristollogry. 149 (1979) 17
10. von Schnering H.G., and Wiedemeir H.Z. Z. Kristollogry. 156 (1981) 143
11. Ehm L. L., Knorr K., Dera P., Krimmel A., Bouvier P., and Mezouar M. J. Phys. Condens. Matter 16 (2004) 3545 2004
12. Perdew J.P., Burke K., and Ernzerhof M. Phys. Rev. Lett. 77 (1996) 3865
13. Ordejòn P., Artacho E., and Soler J.M. Phys. Rev. B 53 (1996) 10441
14. Troullier N., and Martins J.M. Phys. Rev. B 43 (1991) 1993
15. Monkhorst H.J., and Pack J.D. Phys. Rev. B 13 (1976) 5188
16. Hundt R., Schön J.C., Hannemann A., and Jansen M. J. Appl. Crystallogr. 32 (1999) 413
17. Harris J. Phys. Rev. B 31 (1985) 1770
18. Knorr K., Ehm L., Hytha M., Winkler B., and Depmeier W. Phys. Status Solidi B 223 (2001) 435
19. Allan D.R., Kelsey A.A., Clark S.J., Angel R.J., and Ackland G.J. Phys. Rev. B 57 (1998) 5106
20. Rajagopalan M., Kalpana G., and Priyamvadha V. Bull. Mater. Sci. 29 (2006) 25
21. Fuentes-Cabrera M., Wang H., and Sankey O.F. J. Phys.: Condens. Matter 14 (2002) 9589