NDLI: Computational insight into magnetic behavior and properties of the transition metal complexes with redox-active ligands: a DFT approach

Content Provider	Scilit
Author	Minkin, Vladimir I. Starikov, Andrey G. Starikova, Alyona
Copyright Year	2018
Abstract	Various aspects related to the use of DFT method for the study of magnetic, geometry and energetic properties of transition metal complexes with redox-active ligands are considered. Particular attention is given to the correct choice of model compounds and methodology of the calculations.
Related Links	http://www.degruyter.com/downloadpdf/j/pac.ahead-of-print/pac-2017-0803/pac-2017-0803.xml
Ending Page	824
Page Count	14
Starting Page	811
ISSN	00334545
e-ISSN	13653075
DOI	10.1515/pac-2017-0803
Journal	Pure and Applied Chemistry
Issue Number	5
Volume Number	90
Language	English
Publisher	Walter de Gruyter GmbH
Publisher Date	2018-04-25
Access Restriction	Open
Subject Keyword	Pure and Applied Chemistry Inorganic Chemistry Dft Calculations Magnetic Properties Mam-17 Redox-active Ligands Spin States Transition Metal Complexes Journal: Pure and Applied Chemistry, Issue- 1-2
Content Type	Text
Resource Type	Article
Subject	Chemistry Chemical Engineering

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Computational insight into magnetic behavior and properties of the transition metal complexes with redox-active ligands: a DFT approach