Study of Rutile TiO2 band structures and optical properties using Density functional theory (DFT)
In this article, a theoretical analysis to measure the band composition, optical properties and density of states (DOS) of rutile titanium dioxide was conducted via the castep simulation program. Calculations of the first principles were carried out using the super cell (1x1x1) process. The first c...
Saved in:
| Main Authors: | , , |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
Tikrit University
2021-07-01
|
| Series: | Tikrit Journal of Pure Science |
| Subjects: | |
| Online Access: | https://tjpsj.org/index.php/tjps/article/view/145 |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|