Theoretical reinvestigation of the electronic structure of CuNCN: The influence of packing on the magnetic properties

Journal of Physical Chemistry C

Volumn 113, Issue 43, 2009, Pages 18891-18896

  Xiang, Hongping ^a   Liu, Xiaohui ^a   Dronskowski, Richard ^a  

^a RWTH AACHEN UNIVERSITY   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ANTIFERROMAGNETIC STRUCTURES; BAND GAPS; CARBODIIMIDES; COUPLING CONSTANTS; DIHEDRAL ANGLES; ELECTRONIC CORRELATION; EXPERIMENTAL VALUES; INTRA-LAYER; LOCAL MAGNETIC MOMENTS; NEAREST-NEIGHBORS; QUANTITATIVE AGREEMENT;

ANTIFERROMAGNETIC MATERIALS; ANTIFERROMAGNETISM; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; MAGNETIC MOMENTS; MAGNETIC PROPERTIES; RADAR ANTENNAS; WAVE FUNCTIONS;

DENSITY FUNCTIONAL THEORY;

EID: 70449580868     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp907458f     Document Type: Article

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