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Influence of Ni-Ni separation on the optoelectronic and magnetic properties of Ni-doped cubic cadmium sulphide

Identifieur interne : 000108 ( Main/Exploration ); précédent : 000107; suivant : 000109

Influence of Ni-Ni separation on the optoelectronic and magnetic properties of Ni-doped cubic cadmium sulphide

Auteurs : W. Benstaali [Algérie] ; S. Bentata [Algérie] ; H. A. Bentounes [Algérie] ; A. Abbad [Algérie] ; B. Bouadjemi [Algérie]

Source :

RBID : Pascal:14-0035838

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Abstract

The full-potential linearized augmented plane wave method (FP-LAPW) within the local spin density approximation (LSDA) is used to calculate the electronic, magnetic and optical properties of Ni-doped CdS. The results show that NiCdS for a concentration of 6.25% behaves as a semiconductor and becomes half-metallic and ferromagnetic when Ni concentration is increased to 12.5%. Furthermore, the magnetic coupling between the Ni atoms is sensitive to the Ni-Ni distance. The rising of the separation of the two Ni atoms leads to a significant decrease in magnetic coupling between them and an amelioration of optical properties.


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<div type="abstract" xml:lang="en">The full-potential linearized augmented plane wave method (FP-LAPW) within the local spin density approximation (LSDA) is used to calculate the electronic, magnetic and optical properties of Ni-doped CdS. The results show that NiCdS for a concentration of 6.25% behaves as a semiconductor and becomes half-metallic and ferromagnetic when Ni concentration is increased to 12.5%. Furthermore, the magnetic coupling between the Ni atoms is sensitive to the Ni-Ni distance. The rising of the separation of the two Ni atoms leads to a significant decrease in magnetic coupling between them and an amelioration of optical properties.</div>
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