Quantum Theory of Atom in Molecules Investigation Trinuclear Ruthenium: DFT Approach

The topological indices of the "[(µ3-2, 5-dioxyocyclohexylidene)-bis ((2-hydrido)-nonacarbonyltriruthenium]” were studied within the quantum theory of atoms in the molecule (QTAIM), clusters are analyzed using the density functional theory (DFT). The estimated topological variables accord wit...

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Bibliographic Details
Main Author: Manal Abed Mohammed
Format: Article
Language:English
Published: University of Baghdad, College of Science for Women 2023-10-01
Series:مجلة بغداد للعلوم
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Online Access:https://bsj.uobaghdad.edu.iq/index.php/BSJ/article/view/7428
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