Natural orbitals for chemical valence as descriptors of chemical bonding in transition metal complexes

Journal of Molecular Modeling

Volumn 13, Issue 2, 2007, Pages 347-355

  Mitoraj, Mariusz ^a   Michalak, Artur ^a  

^a JAGIELLONIAN UNIVERSITY   (Poland)

Author keywords

donation back donation; Chemical bond bonding in transition; Dewar Chatt Duncanson model; Metal complexes; Natural orbitals for chemical valence

Indexed keywords

ORGANOMETALLIC COMPOUND; TRANSITION ELEMENT;

ARTICLE; BINDING KINETICS; CHEMICAL BINDING; COMPLEX FORMATION; CONTROLLED STUDY; DENSITY FUNCTIONAL THEORY; INTERMETHOD COMPARISON; MOLECULAR MODEL; PRIORITY JOURNAL;

METALS; MODELS, MOLECULAR; TRANSITION ELEMENTS;

EID: 33846684233     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-006-0149-4     Document Type: Article

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