Quantum chemical study of point defects in tin dioxide
First-principles calculations based on the density functional theory (DFT) within the generalized gradient approximation (GGA), and the introduction of intra-atomic interaction term for strongly correlated-electrons (DFT+, have been utilized to study defective crystals. Introduction of some impuriti...
Saved in:
| Main Author: | |
|---|---|
| Other Authors: | , |
| Format: | article |
| Published: |
2014
|
| Subjects: | |
| Online Access: | http://dspace.utpl.edu.ec/handle/123456789/19147 |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
Add Tag 
