FP-LAPW calculations of electronic band structure of NbC and NbN

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DC Field	Value	Language
dc.contributor.author	Gurung, Shivraj	-
dc.date.accessioned	2024-06-19T05:47:11Z	-
dc.date.available	2024-06-19T05:47:11Z	-
dc.date.issued	2012-06-02	-
dc.identifier.issn	2229-6026	-
dc.identifier.uri	http://pucir.inflibnet.ac.in:8080/jspui/handle/123456789/852	-
dc.description.abstract	We have studied the equilibrium lattice constants and energy band structures of NbC and NbN using the full-potential linearized augmented-plane-wave (FP-LAPW) method within the framework of the density functional theory (DFT). The calculation has been performed by using the generalized gradient approximation (GGA) for the exchange and correlation potential. Computations have been performed using the WIEN2k codes. The result obtained is reasonable and compares well with the experimental data and other calculations	en_US
dc.language.iso	en_US	en_US
dc.subject	Linearized augmented plane wave; lattice constant; density functional theory	en_US
dc.title	FP-LAPW calculations of electronic band structure of NbC and NbN	en_US
dc.type	Other	en_US
Appears in Collections:	Research Paper

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