Heavy-Mass Behavior of Ordered Perovskites ACu3Ru4O12 (A = Na, Ca, La)

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Abstract Octahedral Tilting in ACu3Ru4O12 (A=Na,Ca,Sr,La,Nd)

The perovskite-like compounds ACu 3 Ru 4 O 12 (A=Na,Ca,Sr,La,Nd) are studied by means of density functional theory based electronic structure calculations using the augmented spherical wave (ASW) method. The electronic properties are strongly influenced by covalent type bonding between transition metal d and oxygen p states. The characteristic tilting of the RuO 6 octahedra arises mainly from t...

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ژورنال

عنوان ژورنال: Journal of the Physical Society of Japan

سال: 2009

ISSN: 0031-9015,1347-4073

DOI: 10.1143/jpsj.78.024706