Ab initio study of La-doped BaSnO3 proton conductor

Ionics

Volumn 14, Issue 4, 2008, Pages 293-301

  Bévillon, Émile ^a   Geneste, Grégory ^a   Chesnaud, Anthony ^a   Wang, Yanzhong ^a   Dezanneau, Guilhem ^a  

^a ECOLE CENTRALE PARIS   (France)

Author keywords

Aliovalent substitution; Barium stannate; Density functional calculation; Hydration

Indexed keywords

BARIUM; HYDRATION; MATHEMATICAL MODELS; OXYGEN; OXYGEN VACANCIES; PROBABILITY DENSITY FUNCTION; THEOREM PROVING;

(I ,J) CONDITIONS; AB INITIO STUDIES; BARIUM STANNATE; CHARGED STATES; DENSITY FUNCTIONAL CALCULATIONS; ELECTRONIC DENSITIES; GEOMETRIC DISTORTIONS; HYDRATION PROPERTIES; HYDRATION REACTIONS; INTERACTION ENERGIES; RELATIVE POSITIONING; SIMPLE MODELING; SPRINGER (CO);

TELEMETERING SYSTEMS;

EID: 45249099522     PISSN: 09477047     EISSN: 18620760     Source Type: Journal    
DOI: 10.1007/s11581-008-0218-z     Document Type: Article

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