Antistructure defects in transition-metal aluminides
- 1 March 1987
- journal article
- research article
- Published by Taylor & Francis in Philosophical Magazine Part B
- Vol. 55 (3) , 359-375
- https://doi.org/10.1080/13642818708208620
Abstract
The electronic structure of antisite defects in NiAl, CoAl and FeAl, as well as in CoGa is calculated self-consistently by the linear muffin-tin orbitals method using a single-site perturbation model. Good qualitative agreement with experimental results is obtained, particularly concerning the occurrence of magnetism in these compounds.Keywords
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