Mn ions' site and valence in PbTiO3 based on the native vacancy defects
Mn ions' doping site and valence were studied in PbTiO3 (PT) with the native vacancy defects by the first-principles calculations. Firstly, the native vacancy defects of Pb, O and Ti in PT were investigated and it was found that Pb vacancy is preferred to others. And then the growth of Mn doped...
| Main Authors: | , , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Institute for Condensed Matter Physics
2021-06-01
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| Series: | Condensed Matter Physics |
| Subjects: | |
| Online Access: | http://www.icmp.lviv.ua/journal/zbirnyk.106/23705/abstract.html |