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Advanced Materials

Volumn 25, Issue 1, 2013, Pages 86-90

Anti-ferrodistortive-like oxygen-octahedron rotation induced by the oxygen vacancy in cubic SrTiO3

(4) Choi, Minseok a Oba, Fumiyasu a Kumagai, Yu a Tanaka, Isao a,b

a KYOTO UNIVERSITY (Japan)

b JAPAN FINE CERAMICS CENTER (Japan)

Author keywords

first principles calculations; hybrid functionals; oxygen vacancies; oxygen octahedron rotation

Indexed keywords

CALCULATIONS; ELECTRONIC STRUCTURE; STRONTIUM TITANATES; TITANIUM COMPOUNDS; VACANCIES;

CUBIC PHASE; FIRST-PRINCIPLES CALCULATION; HYBRID FUNCTIONALS; LOCALIZED ELECTRONIC STATE; OXYGEN OCTAHEDRA; THERMAL IONIZATION;

OXYGEN VACANCIES;

EID: 84872010743 PISSN: 09359648 EISSN: 15214095 Source Type: Journal
DOI: 10.1002/adma.201203580 Document Type: Article

Times cited : (111)

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