First-principles studies of various crystallographic phases and neutral atomic vacancies in KNbO3 and KTaO3

Physica Status Solidi (C) Current Topics in Solid State Physics

Volumn 3, Issue 8, 2006, Pages 2862-2866

  Shigemi, A ^a   Koyama, T ^a   Wada, T ^a  

^a RYUKOKU UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

CRYSTALLOGRAPHIC PHASES; FORMATION ENERGY; NEUTRAL ATOMIC VACANCIES; PLANE WAVE PSEUDOPOTENTIAL METHOD;

ATOMIC PHYSICS; CRYSTALLOGRAPHY; ENTHALPY; PEROVSKITE; PHASE EQUILIBRIA; PROBABILITY DENSITY FUNCTION;

POTASSIUM COMPOUNDS;

EID: 33750282537     PISSN: 18626351     EISSN: None     Source Type: Journal    
DOI: 10.1002/pssc.200669541     Document Type: Conference Paper

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