ATOMISTIC COMPUTER-SIMULATIONS OF YTTRIUM-IRON-GARNET (YIG) AS AN APPROACH TO MATERIALS DEFECT CHEMISTRY .1. INTRINSIC DEFECTS

Autor(en): DONNERBERG, H
CATLOW, CRA
Stichwörter: ENERGY; FILMS; LA2CUO4; LINBO3 CRYSTALS; OXIDES; Physics; Physics, Condensed Matter; Y3FE5O12
Erscheinungsdatum: 1993
Herausgeber: IOP PUBLISHING LTD
Journal: JOURNAL OF PHYSICS-CONDENSED MATTER
Volumen: 5
Ausgabe: 18
Startseite: 2947
Seitenende: 2960
Zusammenfassung: 
In this paper we report results of atomistic simulation studies of the formation of intrinsic defect structures in YIG. Using calculated defect formation energies we obtain energies for defect reactions, from which we determine the most favourable defect processes in yttrium iron garnet. Finally, we comment on some electronic properties of YIG crystals.
ISSN: 09538984
DOI: 10.1088/0953-8984/5/18/017

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