The affection of spin-orbit coupling on the electronic and optical properties of AlB2-like transition metal diborides: A first principle study
Based on the density functional theory and using GGA and GGA + so approximations, the electronic and optical properties of bulk TMB2 (TM = Cr, Mn, and Fe) are calculated. We calculate the electronic properties of these compounds in the presence of spin-orbit interaction. The highest and lowest spin-...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2018-12-01
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| Series: | Results in Physics |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2211379718310064 |