<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...
Main Authors: | , , , |
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Format: | Article |
Language: | English |
Published: |
MDPI AG
2021-10-01
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Series: | Crystals |
Subjects: | |
Online Access: | https://www.mdpi.com/2073-4352/11/10/1257 |