Study the optical properties of Cs3CeI6: First-principles calculations
The band structure, density of states, and optical properties of a novel material, Cs3CeI6 are calculated for the first time using the density functional theory method in first-principles calculations. It is found that Cs3CeI6 possesses a direct bandgap with an energy value of 3.05 eV. Examination o...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
AIP Publishing LLC
2024-01-01
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| Series: | AIP Advances |
| Online Access: | http://dx.doi.org/10.1063/5.0187100 |