| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1592870 | Solid State Communications | 2012 | 5 Pages |
Abstract
⺠For the first time, the energy band structure of CaZrTi2O7 crystal is elucidated on the basis of DFT-GGA calculation. ⺠For CaZrTi2O7 crystal, the characters of valence and conduction bands, and the band-gap energy are theoretically determined. ⺠Photocatalytic ability of CaZrTi2O7 is explained on the basis of the potentials of the conduction. ⺠The valence bands and effective masses of electrons and holes.
Related Topics
Physical Sciences and Engineering
Materials Science
Materials Science (General)
Authors
Jianjun Liu, Shifu Chen, Yongfa Zhu,