Electronic structure of antiferromagnetic PbCrO3 (0 0 1) surfaces

Journal of Alloys and Compounds

Volumn 509, Issue 38, 2011, Pages 9284-9288

  Yildirim, Hasan ^a   Aduk, Savaş ^a   Gökolu, Gökhan ^a  

^a KARABUK UNIVERSITY   (Turkey)

Author keywords

Atomic scale structure; Computer simulations; Electronic properties; Oxide materials

Indexed keywords

ANTIFERROMAGNETICS; ATOMIC RELAXATION; ATOMIC SCALE STRUCTURES; CR ATOMS; DENSITY OF STATE; GENERALIZED GRADIENT APPROXIMATIONS; HUBBARD; INTERLAYER DISTANCE; METAL ATOMS; METALLIC BEHAVIORS; OXIDE MATERIALS; OXYGEN ATOM; PLANE-WAVE PSEUDOPOTENTIAL METHOD; RELATIVE MOVEMENT; SLAB GEOMETRY; SPIN ORIENTATIONS; SURFACE GEOMETRIES;

ANTIFERROMAGNETISM; ATOMS; CHROMIUM; COMPUTER SIMULATION; DENSITY FUNCTIONAL THEORY; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; GEOMETRY; LEAD; LEAD OXIDE; MATERIALS PROPERTIES; OXYGEN;

SURFACES;

EID: 80051901917     PISSN: 09258388     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jallcom.2011.06.096     Document Type: Article

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