First-principles investigation of Fe-doped MgSiO 3-ilmenite

First-principles investigation of Fe-doped MgSiO 3-ilmenite

First principles density functional theory and generalised gradient approximation (GGA) have been exploited to investigate Fe-doped ilmenite-type MgSiO 3 mineral. Strong electron correlation effects not included in a density-functional formalism are described by a Hubbard-type on-site Coulomb repuls...

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Λεπτομέρειες βιβλιογραφικής εγγραφής
Κύριος συγγραφέας:	Stashans, A. (author)
Άλλοι συγγραφείς:	Pinto, H. (author), Rivera, K. (author)
Μορφή:	article
Έκδοση:	2012
Θέματα:	Electronic and optical properties
Διαθέσιμο Online:	http://dspace.utpl.edu.ec/handle/123456789/19243
Ετικέτες:	Προσθήκη ετικέτας Δεν υπάρχουν, Καταχωρήστε ετικέτα πρώτοι!

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