On combining quantum chemistry and molecular mechanics. The potential energy surface of complexes of transition metals exemplified by spin transition in cis-[Fe(bipy)2(CNS)2]

Chemical Physics Reports

Volumn 18, Issue 1, 1999, Pages 149-161

  Darkhovskii, M B ^a   Tchougreeff A L ^a  

^a KARPOV INSTITUTE OF PHYSICAL CHEMISTRY   (Russian Federation)

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EID: 0346977517     PISSN: 10741550     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

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