Ab Initio Calculations of the Structural and Electronics Properties of Double Tungstates NaY(WO4)2

Authors

Hanane Arioumlil
Department of physic, LASICOM Laboratory, University of Blida 1
Faiza Bouamra
Department of physic, LASICOM Laboratory, University of Blida 1
Michel Rérat
E2S UPPA, CNRS, IPREM, Université de Pau et des Pays de l’Adour, France

Synopsis

The tetragonal crystal structure of double tungstates NaY(WO4)2 has been determined. Our calculations confirm the insulating character of NaY(WO4)2, the obtained results were justified and discussed from the diagrams of band structures and density of states DOS and LDOS.

ICCAP2021
Publication
Abstracts of 1st International Conference on Computational & Applied Physics
PDF
Published
March 8, 2022
Series
AIJR Abstracts
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