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Influence of Molecular Orbitals on Magnetic Properties of FeO2Hx

Influence of Molecular Orbitals on Magnetic Properties of FeO2Hx

https://devfeature-collection.sl.nsw.gov.au/record/TN_cdi_doaj_primary_oai_doaj_org_article_20dd7f4f54ac4ac98b46dd1ff5701fc0

Influence of Molecular Orbitals on Magnetic Properties of FeO2Hx

About this item

Full title

Influence of Molecular Orbitals on Magnetic Properties of FeO2Hx

Publisher

Basel: MDPI AG

Journal title

Molecules (Basel, Switzerland), 2020-05, Vol.25 (9), p.2211

Language

English

Formats

Publication information

Publisher

Basel: MDPI AG

More information

Scope and Contents

Contents

Recent discoveries of various novel iron oxides and hydrides, which become stable at very high pressure and temperature, are extremely important for geoscience. In this paper, we report the results of an investigation on the electronic structure and magnetic properties of the hydride FeO 2 H x , using density functional theory plus dynamical mean-f...

Alternative Titles

Full title

Influence of Molecular Orbitals on Magnetic Properties of FeO2Hx

Identifiers

Primary Identifiers

Record Identifier

TN_cdi_doaj_primary_oai_doaj_org_article_20dd7f4f54ac4ac98b46dd1ff5701fc0

Permalink

https://devfeature-collection.sl.nsw.gov.au/record/TN_cdi_doaj_primary_oai_doaj_org_article_20dd7f4f54ac4ac98b46dd1ff5701fc0

Other Identifiers

ISSN

1420-3049

E-ISSN

1420-3049

DOI

10.3390/molecules25092211

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