Fe-doped SnO2: A Quantum-chemical Approach

Fe-doped SnO2: A Quantum-chemical Approach

We report first-principles results obtained on Fe impurity incorporation into the SnO2 material. Different impurity concentrations have been taken into consideration when computing structural, electronic and magnetic properties of the material. DFT + U methodology within the GGA approach applied to...

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Detaylı Bibliyografya
Yazar: Stashans, A. (author)
Diğer Yazarlar: Puchaicela Huaca, L. (author)
Materyal Türü: article
Baskı/Yayın Bilgisi: 2015
Konular:
DFT+U
Impurity doping
Magnetism
Microstructure
SnO2
Online Erişim:http://dspace.utpl.edu.ec/handle/123456789/19005
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http://dspace.utpl.edu.ec/handle/123456789/19005

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