Density Functional Theory Study of Iron-Oxygen Divacancies in Magnetite (Fe3O4) and Hematite (Fe2O3).

J Phys Chem C Nanomater Interfaces · 2025 · PMC12415821 · PMID 40927501

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an interesting trendno p-value reported

The divacancies involving a tetrahedral iron vacancy (denoted by * in Figure ) exhibit an interesting trend in divacancy core charge for all four classes of divacancies.

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Quoted from the open-access full text in Europe PMC under the licence the publisher applied. The sentence is reproduced exactly as published; the emphasis is ours.

Density Functional Theory Study of Iron-Oxygen Divacancies in Magnetite (Fe&lt;sub&gt;3&lt;/sub&gt;O&lt;sub&gt;4&lt;/sub&gt;) and Hematite (Fe&lt;sub&gt;2&lt;/sub&gt;O&lt;sub&gt;3&lt;/sub&gt;).

The sentences

Density Functional Theory Study of Iron-Oxygen Divacancies in Magnetite (Fe<sub>3</sub>O<sub>4</sub>) and Hematite (Fe<sub>2</sub>O<sub>3</sub>).