First-principles study on the electronic structure of n-type magnetic semiconductor Ba(Zn Co )2As2
We perform systematic first-principles calculations on the electronic structure of n -type magnetic semiconductor Ba(Zn $_{1-x}$ Co _x ) _2 As _2 with the facilitation of HSE06 hybrid functional. Supercells are used to consider the doping of Co atoms, and the first-principles band structures are unf...
Main Authors: | , , , , , , , , , , , , |
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Format: | Article |
Language: | English |
Published: |
IOP Publishing
2024-01-01
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Series: | New Journal of Physics |
Subjects: | |
Online Access: | https://doi.org/10.1088/1367-2630/ad309f |