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Understanding the effects of Cr doping in rutile TiO(2) by DFT calculations and X-ray spectroscopy
The effects of Cr on local environment and electronic structure of rutile TiO(2) are studied combining theoretical and experimental approaches. Neutral and negatively charged substitutional Cr impurities Cr(Ti)(0) and Cr(Ti)(1−) as well as Cr-oxygen vacancy complex 2Cr(Ti) + V(O) are studied by the...
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| Publicado no: | Sci Rep |
|---|---|
| Main Authors: | , , , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Nature Publishing Group UK
2018
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5992178/ https://ncbi.nlm.nih.gov/pubmed/29880895 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-018-26728-3 |
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