ATOMISTIC COMPUTER-SIMULATIONS OF YTTRIUM-IRON-GARNET AS AN APPROACH TO STUDYING ITS DEFECT CHEMISTRY - EXTRINSIC DEFECTS

Authors
DONNERBERG H CATLOW CRA
Citation
H. Donnerberg et Cra. Catlow, ATOMISTIC COMPUTER-SIMULATIONS OF YTTRIUM-IRON-GARNET AS AN APPROACH TO STUDYING ITS DEFECT CHEMISTRY - EXTRINSIC DEFECTS, Physical review. B, Condensed matter, 50(2), 1994, pp. 744-750
Citations number
19
Categorie Soggetti
Physics, Condensed Matter
Journal title
Physical review. B, Condensed matter → ACNP
ISSN journal
01631829
Volume
50
Issue
2
Year of publication
1994
Pages
744 - 750
Database
ISI
SICI code
0163-1829(1994)50:2<744:ACOYAA>2.0.ZU;2-G
Abstract
We report results of atomistic simulation studies concerning the incor poration of extrinsic defects in yttrium iron garnet crystals. We calc ulate defect formation energies in order to determine the most favorab le impurity incorporation mechanisms in yttrium iron garnet.