Thermodynamic modeling of the sc-zn system coupled with first-principles calculation

Journal of Mining and Metallurgy, Section B: Metallurgy

Volumn 48, Issue 1, 2012, Pages 123-130

  Tang, C ^a   Zhou, P ^a   Zhao, D D ^a   Yuan, X M ^a   Tang, Y ^a   Wang, P S ^a   Hu, B ^a   Du, Y ^a   Xu, H H ^a  

^a CENTRAL SOUTH UNIVERSITY   (China)

Author keywords

Calphad; First principles calculation; Sc Zn system; Thermodynamic calculation

Indexed keywords

EID: 84862957243     PISSN: 14505339     EISSN: None     Source Type: Journal    
DOI: 10.2298/JMMB110909017T     Document Type: Article

References (33)

1. Zhiqiang Yang, Zhimin Yin, Light Alloy Fabrication Technology, 31(11)(2003) 34
2. L.L. Rokhlin, T.V. Dobatkina, I.G.. Korol'Kova, Russ. Metall., 1(2008)89.
3. S. Dev, A.A. Stuart, R.C.R.D Kumaar, B.S. Murty, K.P. Rao, Mater. Sci. Eng., A, 467(1-2)(2007) 132.
4. A. Palenzona, P. Manfrinetti, J. Alloy. Compd.¬, 247 (1997) 195.
5. P.I. Kripyakevich, V.S. Potasov, and Yu.B. Kuzma, Vis. L'viv Derzh. Univ. Ser. Khim., 8(1965)80.
6. E. Laune, H. Nowotny, Monatsh Chem, 94 (1963) 162.
7. Xiaoyang Liu, F. Rau, J. Breu, K.J. Range, J. Alloys compd., 243 (1996) 5
8. P.I. Kripyakevich, V.S. Protasov, Yu.B. Kuzma, Inorg. Mater. (Engl. Transl.) 2 (1966)1351
9. B. Predel, Sc-Zn (Scandium-Zinc). Madelung, O. (ed.). SpringerMaterials - The Landolt-Börnstein Database. DOI: 10.1007/10551312_2709
10. H. Okamoto, J. Phase Equilibria, 6(1998)602.
11. V. Raghavan, J. Phase Equilib. Diffus, 2(2009)197.
12. Qisheng Lin, John D. Corbetty, Philos. Mag. Lett., 12(2003)755
13. G. Kresse, J. Furthmiiller, Comp. Mater. Sci., 6 (1996) 15.
14. G. Kresse, J. Furthmiiller, Phys. Rev. B, 54 (1996) 11169.
15. P.E. Blöchl, Phys. Rev. B, 50 (1994) 17953.
16. G. Kresse, D. Joubert, Phys. Rev. B, 59 (1999) 1758.
17. J.P. Perdew, K. Burke, M. Ernzerhof, Phys. Rev. Lett., 77 (1996) 3865.
18. H.J. Monkhorst, J.D. Pack, Phys. Rev. B, 13 (1976) 5188.
19. P.E. Blöchl, O. Jepsen, O.K. Andersen, Phys. Rev. B, 49 (1994) 16223.
20. A.T. Dinsdale, CALPHAD, 15 (1991) 317.
21. O. Redlich, A.T. Kister, Industrial and Eng. Chem., 40 (1948) 345.
22. C.K. Saw, B.J. Beaudry, C. Stassis, Z. MetaIlkd., 50 (1968) 377.
23. J. Haglund, F.F. Guillermet, G. Grimvall, M. Korling, Phys. Rev. B: Condens. Matter, 48 (1993) 11685.
24. J.R. Brown, J. Phys. Chem. Solids, 26 (1965) 63.
25. B. Sundman, B. Jansson, J.-O. Andersson, CALPHAD, 9 (1985) 153.
26. Y. Du, R. Schmid-Fetzer, H. Ohtani, Z. Metallkd., 88 (1997) 545.
27. D. Zivkovic, D. Minic, D. Manasijevic, A. Kostov, N.Talijan, Lj. Balanovic, A. Mitovski, Z. Zivkovic, J. Min. Metall. Sect. B., 46 (1) (2010) 105.
28. M. Kopyto, G. Garzel and L. A. Zabdyr, J. Min. Metall. Sect. B, 45 (1) (2009) 95
29. Y. Du, X.Yuan, W. Sun, B. Hu, J. Min.Metall. Sect. B., 45(1) (2009)89.
30. B. Hu, Y. Du, H. Xu, W. Sun, W.W. Zhang, D. Zhao, J. Min.Metall. Sect. B., 46(1) (2010) 97.
31. L. Zhang, J. Wang, Y. Du, R. Hu, P. Nash, X.G. Lu, C. Jiang, Acta Mater., 57 (2009) 5324.
32. M.J. Bu, P.S. Wang, H.H. Xu, S.H. Liu, C.S. Sha, Y. Du, F.S. Pan, A.T. Tang, J. Min.Metall. Sect. B., 46(2) (2010) 181.
33. Y. Du, S. Liu, L. Zhang, H. Xu, D. Zhao, A. Wang, L. Zhou, CALPHAD, 35(2011) 427