Anti-ferrodistortive-Like Oxygen-Octahedron Rotation Induced by the Oxygen Vacancy in Cubic SrTiO3

Electronic and structural properties of the oxygen vacancy in BaTiO3

(2011) Minseok Choi et al.   APPLIED PHYSICS LETTERS

Mechanism of photocatalytic activities in Cr-doped SrTiO3 under visible-light irradiation: an insight from hybrid density-functional calculations

(2011) Pakpoom Reunchan et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Hybrid density functional study of oxygen vacancies in KTaO3and NaTaO3

(2011) Minseok Choi et al.   PHYSICAL REVIEW B

Vacant-Site Octahedral Tilings onSrTiO3(001), the(13×13)R33.7°Surface, and Related Structures

(2011) D. M. Kienzle et al.   PHYSICAL REVIEW LETTERS

GW calculation of Electronic Structure of cubic perovskite SrTiO3

(2010) Chul-Hong Park   JOURNAL OF THE KOREAN PHYSICAL SOCIETY

Defect States Induced by Oxygen Vacancies in Cubic SrTiO3: First-Principles Calculations

(2010) Zhufeng Hou et al.   JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN

Intrinsic defects in ZnO calculated by screened exchange and hybrid density functionals

(2010) S. J. Clark et al.   PHYSICAL REVIEW B

Ferroelectricity in Strain-FreeSrTiO3Thin Films

(2010) H. W. Jang et al.   PHYSICAL REVIEW LETTERS

Localized electronic states induced by defects and possible origin of ferroelectricity in strontium titanate thin films

(2009) Y. S. Kim et al.   APPLIED PHYSICS LETTERS

First-principles study of bulk and surface oxygen vacancies in SrTiO3 crystal

(2009) V. E. Alexandrov et al.   EUROPEAN PHYSICAL JOURNAL B

Role of Si and Ge as impurities in ZnO

(2009) J. L. Lyons et al.   PHYSICAL REVIEW B

Oxygen octahedron reconstruction in theSrTiO3/LaAlO3heterointerfaces investigated using aberration-corrected ultrahigh-resolution transmission electron microscopy

(2009) C. L. Jia et al.   PHYSICAL REVIEW B

Role of Ti Antisitelike Defects inSrTiO3

(2009) Minseok Choi et al.   PHYSICAL REVIEW LETTERS

Intrinsicn-Type Behavior in Transparent Conducting Oxides: A Comparative Hybrid-Functional Study ofIn2O3,SnO2, and ZnO

(2009) Péter Ágoston et al.   PHYSICAL REVIEW LETTERS

First-principles study of native defects and lanthanum impurities inNaTaO3

(2008) Minseok Choi et al.   PHYSICAL REVIEW B

SrTiO3andBaTiO3revisited using the projector augmented wave method: Performance of hybrid and semilocal functionals

(2008) Roman Wahl et al.   PHYSICAL REVIEW B

Defect energetics in ZnO: A hybrid Hartree-Fock density functional study

(2008) Fumiyasu Oba et al.   PHYSICAL REVIEW B

Assessment of correction methods for the band-gap problem and for finite-size effects in supercell defect calculations: Case studies for ZnO and GaAs

(2008) Stephan Lany et al.   PHYSICAL REVIEW B