Density functional studies of PbZrO3, KTaO3 and KNbO3

Ferroelectrics

Volumn 194, Issue 1-4, 1997, Pages 299-322

  Singh, David J ^a  

^a NAVAL RESEARCH LABORATORY   (United States)

Author keywords

Electronic structure; GGA; KTN; LDA; PZT; Weighted density approximation

Indexed keywords

APPROXIMATION THEORY; ELECTRONIC STRUCTURE; LEAD COMPOUNDS; POTASSIUM COMPOUNDS; PROBABILITY DENSITY FUNCTION; CRYSTAL STRUCTURE; OXIDES; ZIRCONIUM COMPOUNDS;

WEIGHTED DENSITY APPROXIMATION; DENSITY FUNCTIONAL CALCULATIONS; PEROVSKITES;

FERROELECTRIC MATERIALS;

EID: 0030609253     PISSN: 00150193     EISSN: None     Source Type: Journal    
DOI: 10.1080/00150199708016101     Document Type: Article

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