Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5441596 | Journal of Science: Advanced Materials and Devices | 2016 | 4 Pages |
Abstract
A first-principles approach is used to study the structural, electronic and magnetic properties of the Co2TaAl Heusler compound with CuHg2Ti-type structure. The investigation was done using the (FP-LAPW) method where the exchange-correlation potential was calculated with the frame of GGA by Perdew et al. (Phys. Rev. Lett. 77 (1996) 3865). At ambient conditions our calculations predict that Co2TaAl is half-metallic ferromagnet (HMF) with a magnetic moment of 2 μB/fu and HM flip gap of 0.58 eV. In addition, the ferromagnetic phase is found to be energetically more favorable than paramagnetic phase. Therefore, the Co2TaAl Heusler compound is a candidate material for future spintronic applications.
Related Topics
Physical Sciences and Engineering
Materials Science
Ceramics and Composites
Authors
Saadi Berri,