Tilting and Distortion in Rutile-Related Mixed Metal Ternary Uranium Oxides: A Structural, Spectroscopic, and Theoretical Investigation.

Journal

Inorganic chemistry
ISSN: 1520-510X
Titre abrégé: Inorg Chem
Pays: United States
ID NLM: 0366543

Informations de publication

Date de publication:
15 Feb 2021
Historique:
pubmed: 30 1 2021
medline: 30 1 2021
entrez: 29 1 2021
Statut: ppublish

Résumé

A systematic investigation examining the origins of structural distortions in rutile-related ternary uranium

Identifiants

DOI: 10.1021/acs.inorgchem.0c03077 PMID: 33512140
pubmed: 33512140
doi: 10.1021/acs.inorgchem.0c03077
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

2246-2260

Auteurs

Gabriel L Murphy (GL)

School of Chemistry, The University of Sydney, Sydney, NSW 2006, Australia.
Australian Nuclear Science and Technology Organisation, Lucas Heights, NSW 2234, Australia.

Zhaoming Zhang (Z)

Australian Nuclear Science and Technology Organisation, Lucas Heights, NSW 2234, Australia.
ORCID: 0000-0003-3273-8889

Rebekka Tesch (R)

Institute of Energy and Climate Research (IEK-13), Forschungszentrum Jülich GmbH, 52428 Jülich, Germany.
JARA Energy and CSD (Center for Simulation and Data Science), 52425 Jülich, Germany.
Chair of Theory and Computation of Energy Materials, Faculty of Georesources and Materials Engineering, RWTH Aachen University, 52062 Aachen, Germany.

Piotr M Kowalski (PM)

Institute of Energy and Climate Research (IEK-13), Forschungszentrum Jülich GmbH, 52428 Jülich, Germany.
JARA Energy and CSD (Center for Simulation and Data Science), 52425 Jülich, Germany.

Maxim Avdeev (M)

School of Chemistry, The University of Sydney, Sydney, NSW 2006, Australia.
Australian Nuclear Science and Technology Organisation, Lucas Heights, NSW 2234, Australia.
ORCID: 0000-0003-2366-5809

Eugenia Y Kuo (EY)

Australian Nuclear Science and Technology Organisation, Lucas Heights, NSW 2234, Australia.
ORCID: 0000-0003-2793-0569

Daniel J Gregg (DJ)

Australian Nuclear Science and Technology Organisation, Lucas Heights, NSW 2234, Australia.

Philip Kegler (P)

Institute of Energy and Climate Research (IEK-6), Forschungszentrum Jülich GmbH, 52428 Jülich, Germany.

Evgeny V Alekseev (EV)

Institute of Energy and Climate Research (IEK-9), Forschungszentrum Jülich GmbH, 52428 Jülich, Germany.
ORCID: 0000-0002-4919-5211

Brendan J Kennedy (BJ)

School of Chemistry, The University of Sydney, Sydney, NSW 2006, Australia.
ORCID: 0000-0002-7187-4579

Classifications MeSH