Identifying of charge-transfer transitio
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Christiana A. Mitsopoulou
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Article
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2010
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Elsevier Science
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English
β 649 KB
This review is focused on theoretical aspects of mixed diimine-dithiolate complexes by means of DFT and TD-DFT methods. Thus, the geometry, the character of charge-transfer transitions and excited states in a series of M(diimine)(dithiolate), where M = Ni, Pd and Pt, is examined by DFT and TD-DFT te