First-principles calculations of Ca/F co-doped anatase TiO2
In order to understand the improved photocatalytic activity of Ca/F co-doped TiO2,the lattice parameters, energy band structures, density of states and absorption spectraof pure, Ca doped, F doped and Ca/F co-doped anatase TiO2 were calculated by firstprinciples based on the density functional theo...
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2016-05-01
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| Series: | Kuwait Journal of Science |
| Subjects: | |
| Online Access: | https://journalskuwait.org/kjs/index.php/KJS/article/view/1167 |
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