Simulations of REBaCo 2O 5.5 (REGd, La, Y) cathode materials through energy minimisation and molecular dynamics

Solid State Ionics

Volumn 216, Issue , 2012, Pages 50-53

  Hermet, J ^a   Dupe B ^a   Dezanneau, G ^a  

^a ECOLE CENTRALE PARIS   (France)

Author keywords

Cathode; Diffusion; Molecular dynamics; SOFC

Indexed keywords

A-SITE CATIONS; ATOMIC SCALE; CATHODE MATERIALS; DOUBLE PEROVSKITES; ENERGY MINIMISATION; MATERIAL STABILITY; MOLECULAR DYNAMICS SIMULATIONS; OXYGEN DIFFUSION; OXYGEN EXCHANGE; RARE EARTH IONS;

ACTIVATION ENERGY; DIFFUSION; DIFFUSION IN GASES; GADOLINIUM; LANTHANUM; MOLECULAR DYNAMICS; OXYGEN; OXYGEN VACANCIES; PEROVSKITE; POSITIVE IONS; SOLID OXIDE FUEL CELLS (SOFC);

CATHODES;

EID: 84861097856     PISSN: 01672738     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ssi.2011.11.006     Document Type: Conference Paper

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