Study of the diffusion properties of oxygen in TiO2
The formation energies of oxygen vacancies and the migration barriers of oxygen in TiO2 with a rutile structure have been calculated by the projector augmented-wave method within the electron density functional theory. We have derived analytical expressions for the temperature-dependent diffusion co...
| Published in: | Journal of experimental and theoretical physics Vol. 133, № 2. P. 169-174 |
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| Main Author: | |
| Other Authors: | , |
| Format: | Article |
| Language: | English |
| Subjects: | |
| Online Access: | http://vital.lib.tsu.ru/vital/access/manager/Repository/koha:000925257 Перейти в каталог НБ ТГУ |