Quantum-chemical study of nitrogen and magnesium co-doping in ?-Cr2O3

Quantum-chemical study of nitrogen and magnesium co-doping in ?-Cr2O3

© 2016 World Scientific Publishing Company.Study of corundum-type chromium oxide (?-Cr2O3) crystal doped with the nitrogen and magnesium impurities has been carried out through the use of first-principles calculations based on the density functional theory (DFT) and generalized gradient approximatio...

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Bibliográfalaš dieđut
Váldodahkki:	Stashans, A. (author)
Eará dahkkit:	Jácome, S. (author)
Materiálatiipa:	article
Almmustuhtton:	2016
Fáttát:	DFT+U
Liŋkkat:	http://dspace.utpl.edu.ec/handle/123456789/18783
Fáddágilkorat:	Lasit fáddágilkoriid Eai fáddágilkorat, Lasit vuosttaš fáddágilkora!

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