An ab initio study of the magnetic ground states of organic molecules of di-resp. tetramethyl types as examples with a non-collinear density functional method

Chemical Physics Letters

Volumn 388, Issue 4-6, 2004, Pages 248-252

  Anton, J ^a,b   Ishii, T ^a   Fricke, B ^b  

^a KAGAWA UNIVERSITY   (Japan)

^b UNIVERSITY OF KASSEL   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CYCLOPENTANE DERIVATIVE; TETRAHYDROFURAN DERIVATIVE; THIOPHENE DERIVATIVE;

AB INITIO CALCULATION; ARTICLE; DENSITY FUNCTIONAL THEORY; ELECTRON; MAGNETISM; MATHEMATICAL COMPUTING; MOLECULE;

EID: 1842637746     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2004.03.014     Document Type: Article

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