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Volumn , Issue 17, 2009, Pages 3153-3161

Density functional studies on the exchange interaction of a dinuclear Gd(iii)-Cu(ii) complex: Method assessment, magnetic coupling mechanism and magneto-structural correlations

Author keywords

[No Author keywords available]

Indexed keywords

3D INTERACTIONS; COUPLING MECHANISMS; CU COMPLEXES; D ORBITALS; DENSITY-FUNCTIONAL CALCULATIONS; DENSITY-FUNCTIONAL STUDIES; DIHEDRAL ANGLES; DINUCLEAR; DOUGLAS-KROLL; EFFECTIVE CORE POTENTIALS; ELECTRON BASIS SETS; EXPERIMENTAL VALUES; EXPONENTIAL RELATIONS; J-VALUES; MAGNETO-STRUCTURAL CORRELATIONS; METHOD ASSESSMENTS; MODEL COMPLEXES; NBO ANALYSIS; ORBITALS; RELATIVISTIC EFFECTS; ZEROTH-ORDER REGULAR APPROXIMATIONS;

EID: 64549095246     PISSN: 14779226     EISSN: 14779234     Source Type: Journal    
DOI: 10.1039/b817540c     Document Type: Article
Times cited : (143)

References (70)


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.