DocumentCode
2276295
Title
First principles study on oxygen vacancies in SrTiO3
Author
Cuong, Do Duc ; Han, Seungwu ; Lee, Jaichan
Author_Institution
SungKyunKwan Univ., Suwon
fYear
2007
fDate
27-31 May 2007
Firstpage
247
Lastpage
248
Abstract
Oxygen vacancy in SrTiO3 is studied using the first principles calculation with the correction of onsite Coulomb interaction. In this paper, we performed the calculations on the multi oxygen vacancies in typical perovskite SrTiO3. We found that the oxygen vacancies tend to cluster in a linear way which makes the reduction of electron carrier concentration.
Keywords
ab initio calculations; defect states; electron density; strontium compounds; vacancies (crystal); Coulomb interaction; SrTiO3; cluster; electron carrier concentration; electron localization; first principles study; oxygen vacancies; perovskite oxide; Charge carrier processes; Doping; Electrons; Lattices; Linear discriminant analysis; Materials science and technology; Oxygen; Packaging; Photonic band gap; Strontium;
fLanguage
English
Publisher
ieee
Conference_Titel
Applications of Ferroelectrics, 2007. ISAF 2007. Sixteenth IEEE International Symposium on
Conference_Location
Nara
ISSN
1099-4734
Print_ISBN
978-1-4244-1334-8
Electronic_ISBN
1099-4734
Type
conf
DOI
10.1109/ISAF.2007.4393229
Filename
4393229
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