DFT Investigation on the Electronic, Magnetic, Mechanical Properties and Strain Effects of the Quaternary Compound Cu<sub>2</sub>FeSnS<sub>4</sub>

DFT Investigation on the Electronic, Magnetic, Mechanical Properties and Strain Effects of the Quaternary Compound Cu<sub>2</sub>FeSnS<sub>4</sub>

The electronic, magnetic and mechanical properties of the quaternary compound Cu<sub>2</sub>FeSnS<sub>4</sub> have been investigated with first principle calculations. Its half-metallicity has been identified with spin polarized band structures and its magnetic origination is...

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Bibliographic Details
Main Authors: Jing Bai, Jiaying Ji, Liyu Hao, Tie Yang, Xingwen Tan
Format: Article
Language:English
Published: MDPI AG 2020-06-01
Series:Crystals
Subjects:
first principles calculation
electronic band structure
half-metallicity
strain condition
quaternary compounds
Online Access:https://www.mdpi.com/2073-4352/10/6/509

Internet

https://www.mdpi.com/2073-4352/10/6/509

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