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Title: Theory of point-defects, non-stoichiometry, and solute additions in SmCo{sub 5+x}-Sm{sub 2}Co{sub 17{minus}y} and related compounds

Conference ·
OSTI ID:639793

There is considerable interest in the possibility of producing Sm-Co-based nanocomposite magnets by rapid solidification and other far-from-equilibrium processing methods. Thermodynamic and kinetic models are quite valuable in understanding and optimizing such methods. This paper describes a method of estimation, utilizing tight-binding-based bond-order interatomic interaction potentials, of the thermodynamic properties of point defects such as vacancies, interstitials, antisite defects, and solute additions in the SmCo{sub 5+x} and Sm{sub 2}Co{sub 17{minus}y} phases and related rare-earth-transition metal compounds. Illustrative calculations for point defects in SmCo{sub 5} will be presented. The results suggest a unified model of the thermodynamic properties of the SmCo{sub 5+x}-Sm{sub 2}Co{sub 17{minus}y} region of the phase diagram, based on the 1-5 structure and the replacement of Sm by interacting dumb-bell interstitials to form the 2-17 structure; the model is similar in nature to theories of the thermodynamics of metal hydrides.

Research Organization:
Brookhaven National Lab. (BNL), Upton, NY (United States)
Sponsoring Organization:
USDOE Office of Energy Research, Washington, DC (United States)
DOE Contract Number:
AC02-98CH10886
OSTI ID:
639793
Report Number(s):
BNL-65210; CONF-980802-; ON: DE98007304; BR: KC0201030; TRN: AHC29816%%101
Resource Relation:
Conference: 15. international workshop on rare-earth magnets and their applications and 10th international symposium on magnetic anisotropy and coercivity in rare-earth transition metal alloys, Dresden (Germany), 30 Aug - 4 Sep 1998; Other Information: PBD: [1998]
Country of Publication:
United States
Language:
English