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δ-Bonding Modulates the Electronic Structure of Formally Divalent nd¹ Rare Earth Arene Complexes

Version 2 2024-09-02, 14:02

Version 1 2024-03-18, 16:38

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posted on 2024-09-02, 14:02 authored by Conrad GoodwinConrad Goodwin

Accompanies manuscript: Chem. Sci. 2024, Accepted Article. DOI: 10.1039/D4SC03005B.

Raw data for the XRD, NMR, UV-Vis-NIR, and ATR-IR characterization. Raw input and output files from computational work.

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Rare earth Divalent Lanthanide Arene Delta-bonding DFT CASSCF TD-DFT Valence Electron Configuration

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