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Electronic structures and optic properties of Fe2TiO5 using LSDA+U approach

โœ Scribed by Jin, Lei; Zhou, Chungen

Book ID
122122577
Publisher
Elsevier Science
Year
2013
Tongue
English
Weight
669 KB
Volume
23
Category
Article
ISSN
1002-0071

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Electronic structure calculations were performed for substitutional erbium rare-earth impurity in cubic GaN using density-functional theory calculations within the LSDA+U approach (local spin-density approximation with Hubbard-U corrections). The LSDA+U method is applied to the rare-earth 4f states.