Electronic Effect of V, Ti, and Sc Impurities on the Hyperfine Interactions of Fe Atoms in α-Fe: A First Principles Study
The Linearized Augmented Plane Wave method, as implemented in the Wien2k computational code, was used to investigate the effects of the 3d transition metals (TM) Sc, Ti, and V impurities on the hyperfine interaction of iron atoms in α-Fe. The calculation results of this study suggest that the introd...
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
| Published: |
Associação Brasileira de Metalurgia e Materiais (ABM); Associação Brasileira de Cerâmica (ABC); Associação Brasileira de Polímeros (ABPol)
2017-03-01
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| Series: | Materials Research |
| Subjects: | |
| Online Access: | http://www.scielo.br/scielo.php?script=sci_arttext&pid=S1516-14392017000200523&tlng=en |