Thermal stability and thermal expansion studies of cubic fluorite-type MgF2 up to 135 GPa

Materials Research Bulletin

Volumn 52, Issue , 2014, Pages 151-157

  Sun, X W ^a   Song, T ^a   Wei, X P ^a   Quan, W L ^a,b   Liu, X B ^c   Su, W F ^a  

^a LANZHOU JIAOTONG UNIVERSITY   (China)

^b RESEARCH CENTER OF LASER FUSION   (China)

^c TIANSHUI NORMAL UNIVERSITY   (China)

Author keywords

A. Fluorides; D. Phase transitions; D. Thermal expansion

Indexed keywords

A. FLUORIDES; CLASSICAL MOLECULAR DYNAMICS; DIFFERENT PRESSURES; EQUATION OF STATE; EXTENDED PRESSURES; FLUORITE STRUCTURE; QUASI-HARMONIC DEBYE MODEL; VOLUMETRIC THERMAL EXPANSION;

EQUATIONS OF STATE; FLUORSPAR; LOCAL DENSITY APPROXIMATION; MOLECULAR DYNAMICS; THERMAL EXPANSION; THERMODYNAMIC STABILITY;

TEMPERATURE;

EID: 84893716076     PISSN: 00255408     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.materresbull.2014.01.020     Document Type: Article

References (31)

1. X. Xia, and J.K. Xiao J. Phys. Chem. Solids 54 1993 629
2. J. Shanker, S.S. Kushwah, and P. Kumar Physica B 233 1997 78
3. L.M. Thomas, and J. Shanker Phys. Stat. Sol. (b) 195 1996 361
4. K.S. Singh, and R.S. Chauhan Physica B 315 2002 74
5. P. Patnaik Handbook of Inorganic Chemicals 2002 McGraw-Hill New York
6. L.C. Ming, and M.H. Manghnani Geophys. Res. Lett. 6 1979 13
7. Y.A. Nga, and C.K. Ong J. Chem. Phys. 98 1993 3240
8. M. Catti, A. Pavese, R. Dovesi, C. Roetti, and M. Causà Phys. Rev. B 44 1991 3509
9. V. Kanchana, G. Vaitheeswaran, and M. Rajagopalan J. Alloys Compd. 352 2003 60
10. J. Chen, L.L. Boyer, H. Krakauer, and M.J. Mehl Phys. Rev. B 37 1988 3295
11. E. Fransico, J.M. Recio, M.A. Blanco, A. Martn Pends, and A. Costales J. Phys. Chem. A 102 9 1998 1595
12. K. Ramesh Babu, C. Bheema Lingam, S. Auluck, S.P. Tewari, and G. Vaitheeswaran J. Solid State Chem. 184 2011 343
13. M.A. Blanco, E. Francisco, and V. Luaña Comput. Phys. Commun. 158 2004 57
14. D. Vanderbilt Phys. Rev. B 41 1990 7892
15. D.M. Ceperley, and B.J. Alder Phys. Rev. Lett. 45 1980 566
16. J.P. Perdew, and A. Zunger Phys. Rev. B 23 1981 5048
17. H.J. Monkhorst, and J.D. Pack Phys. Rev. B 13 1976 5188
18. R.A. Robie, and J.L. Edwards J. Appl. Phys. 37 1966 2659
19. X.L. Yuan, M.A. Xue, W. Chen, and T.Q. An Comput. Mater. Sci. 82 2014 76
20. B. Kong, B. Zhu, Y. Cheng, L. Zhang, Q.X. Zeng, and X.W. Sun Physica B 406 2011 3003
21. T. Song, X.W. Sun, Z.J. Liu, B. Kong, W.L. Quan, Z.J. Fu, J.F. Li, and J.H. Tian Phys. Scr. 85 2012 045702
22. M. Catti, A. Pavese, R. Dovesi, C. Roetti, and M. Causa Phys. Rev. B 44 1991 3509
23. S. Neelamraju, A. Bach, J.C. Schön, D. Fischer, and M. Jansen J. Chem. Phys. 137 2012 194319
24. D. Fincham Mol. Simul. 8 1992 165
25. D.E. Williams Acta Crystallogr. A 27 1971 452
26. F. Birch Phys. Rev. 71 1947 809
27. G.D. Barrera, M.B. Taylor, N.L. Allan, T.H.K. Barron, L.N. Kantorovich, and W.C. Mackrodt J. Chem. Phys. 107 1997 4337
28. J. Haines, J.M. Leger, F. Gorelli, D.D. Klug, J.S. Tse, and Z.Q. Li Phys. Rev. B 64 2001 134110
29. R. Boehler, M. Ross, and D.B. Boercker Phys. Rev. Lett. 78 1997 4589
30. J.H. Tian, T. Song, X.W. Sun, Z.J. Liu, W.L. Quan, and P. Guo Physica B 407 2012 551
31. M. Liu, C. Lee, M. Kaneko, K. Nakahira, and Y. Takano Appl. Opt. 45 2006 1368