Electronic structure of NiAl

descriptionPublicationkeyboard_double_arrow_right Article 01 Jul 1987 English Publisher:Springer Science and Business Media LLCJournal:Soviet Physics Journal, volume 30, pages 599-603 (issn: 0038-5697, eissn: 1573-9228,

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Authors: A. Yu. Lozovoi; S. V. Vlasov; O. V. Farberovich;

doi: 10.1007/bf00895226

Electronic structure of NiAl

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Abstract

Using the local approximation for exchange-correlation effects we employ the linearized augmented-plane-wave method (LAPW) to compute self-consistently the band structure, equilibrium lattice constant, and x-ray spectra of the B2-phase of the NiAl intermetallic alloy. The results are compared to other theoretical and experimental data.

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