Structural and electronic properties of
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M. Sahnoun; J.C. Parlebas; M. Driz; C. Daul
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Article
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2010
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Elsevier Science
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English
โ 706 KB
The structural and electronic properties of three isostructural transition metal nitrides VN, NbN and TaN have been calculated using the full-potential linearized augmented plane-wave method within a generalized gradient approximation scheme for the exchange-correlation potential. Perfect NaCl struc