X-ray absorption spectra of f-element complexes: insight from relativistic multiconfigurational wavefunction theory-Reference-Cited by-同舟云学术

X-ray absorption spectra of f-element complexes: insight from relativistic multiconfigurational wavefunction theory

Published:2022 Issue:5 Volume:51 Page:1754-1764
ISSN:1477-9226
Container-title:Dalton Transactions
language:en
Short-container-title:Dalton Trans.

Author:

Sergentu Dumitru-Claudiu¹^ORCID,Autschbach Jochen¹^ORCID

Affiliation:

1. Department of Chemistry, University at Buffalo, State University of New York, Buffalo, NY 14260-3000, USA

Abstract

The calculation of X-ray absorption structures with relativistic multiconfiguration ab-initio wavefunction approaches helps elucidating metal-ligand bonding in lanthanide and actinide complexes.

Funder

U.S. Department of Energy

Publisher

Royal Society of Chemistry (RSC)

Subject

Inorganic Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2022/DT/D1DT04075H

Reference174 articles.

1. Metallacyclic actinide catalysts for dinitrogen conversion to ammonia and secondary amines

2. Correlating Electronic Structure and Magnetic Anisotropy in Actinide Complexes [An(COT)2], AnIII/IV = U, Np, and Pu

3. Development of Single‐Molecule Magnets †

4. A diuranium carbide cluster stabilized inside a C80 fullerene cage

5. Diuranium(IV) Carbide Cluster U2C2 Stabilized Inside Fullerene Cages

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