<i>Ab initio</i> Investigation of Impurity Ferromagnetism in the Pd<sub>1−<i>x</i></sub>Fe<sub><i>x</i></sub> Alloys: Concentration and Position Dependences

<i>Ab initio</i> Investigation of Impurity Ferromagnetism in the Pd<sub>1−<i>x</i></sub>Fe<sub><i>x</i></sub> Alloys: Concentration and Position Dependences

We present the results of <i>ab initio</i> studies of the structural and magnetic properties of the Pd host matrix doped by Fe atoms at various concentrations. By means of the density functional theory, we deduce that iron impurities are able to initialize significant magnetization of th...

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Bibliographic Details
Main Authors: Irina Piyanzina, Amir Gumarov, Rustam Khaibullin, Lenar Tagirov
Format: Article
Language:English
Published: MDPI AG 2021-10-01
Series:Crystals
Subjects:
Pd–Fe alloy
impurity ferromagnetism
DFT
Online Access:https://www.mdpi.com/2073-4352/11/10/1257

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