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Theoretical Investigations of Electronic Structure and Magnetic and Optical Properties of Transition-Metal Dinuclear Molecules

[Image: see text] In this work, we have reported the electronic structure, spin state, and optical properties of a new class of transition-metal (TM) dinuclear molecules (TM = Cr, Mn, Fe, Co, and Ni). The stability of these molecules has been analyzed from the vibration spectra obtained by using den...

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Veröffentlicht in:ACS Omega
Hauptverfasser: Reddy, Indukuru Ramesh, Tarafder, Kartick
Format: Artigo
Sprache:Inglês
Veröffentlicht: American Chemical Society 2020
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7528315/
https://ncbi.nlm.nih.gov/pubmed/33015469
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.0c02992
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