First-principle study on electronic structure and magnetic properties of molecular-based antiferromagnet: (2-amino-5-chloropyridinium)2CuBr4

Journal of Physics and Chemistry of Solids

Volumn 68, Issue 12, 2007, Pages 2411-2415

  Yu, L H ^a   Yao, K L ^a,b   Liu, Z L ^a   Zhang, Y S ^a   Xiang, L C ^a  

^a HUAZHONG UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

^b INSTITUTE OF GEOLOGY AND GEOPHYSICS   (China)

Author keywords

A. Magnetic materials; A. Organic compounds; C. Ab initio calculations; D. Magnetic properties

Indexed keywords

DENSITY FUNCTIONAL THEORY; ELECTRONIC STRUCTURE; MAGNETIC MOMENTS; MAGNETIC PROPERTIES; ORGANIC COMPOUNDS;

ANTIFERROMAGNETIC INTERACTIONS; INTERPLANAR MAGNETIC EXCHANGE; MAGNETIC CENTERS;

ANTIFERROMAGNETIC MATERIALS;

EID: 36248955546     PISSN: 00223697     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jpcs.2007.06.020     Document Type: Article

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