Modelling of neutral vacancies in forsterite mineral
Density functional theory and generalized gradient approximation have been employed to study Mg, Si and O vacancies in the Mg2SiO4 forsterite mineral. Microstructure of defect equilibrium geometries, electronic properties as well as chemical bonding in the region surrounding each one of the vacancie...
Salvato in:
| Autore principale: | |
|---|---|
| Natura: | article |
| Pubblicazione: |
2013
|
| Soggetti: | |
| Accesso online: | http://dspace.utpl.edu.ec/handle/123456789/19164 |
| Tags: |
Aggiungi Tag
Nessun Tag, puoi essere il primo ad aggiungerne!!
|
Aggiungi Tag