A Comparative DFT Study for Ruthenium

Here, a comparative DFT study of a transition metal complex, (pentamethylcyclopentadienyl) (diisopropylmethylphosphine) (chloro) (trichlorosilyl) rutheniumhydride, is reported. The molecule contains a Ruthenium (Ru) atom, which is hard to be handled computationally, just like other transition metals...

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Bibliographic Details
Main Author: Nil ERTEKİN BİNBAY
Format: Article
Language:English
Published: Turkish Chemical Society 2020-06-01
Series:Journal of the Turkish Chemical Society, Section A: Chemistry
Subjects:
Online Access:https://dergipark.org.tr/tr/pub/jotcsa/issue/52506/568062