Lanean...
Influence of Oxygen Vacancy Density on the Polaronic Configuration in Rutile
Polaronic configurations that were introduced by oxygen vacancy in rutile TiO(2) crystal have been studied by the DFT + U method. It is found that the building block of TiO(6) will expand when extra electron is trapped in the central Ti atom as polaron. With manually adjusting the initial geometry o...
Gorde:
| Argitaratua izan da: | Materials (Basel) |
|---|---|
| Egile Nagusiak: | , , , |
| Formatua: | Artigo |
| Hizkuntza: | Inglês |
| Argitaratua: |
MDPI
2018
|
| Gaiak: | |
| Sarrera elektronikoa: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6267301/ https://ncbi.nlm.nih.gov/pubmed/30388831 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ma11112156 |
| Etiketak: |
Etiketa erantsi
Etiketarik gabe, Izan zaitez lehena erregistro honi etiketa jartzen!
|