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Ab initio Insight of the Electronic,Structural, Mechanical and Optical Properties of X $$_3$$ 3 P $$_2$$ 2 (X= Mg,Ca) from GGA and Hybrid Functional (HSE06)
Authors:Bougherara  K.  Al-Qaisi  Samah  Laref  Amel  Vu  Tuan V.  Rai  D. P.
Affiliation:1.Centre de Developpement des Technologies Avancees, CDTA-Laser Material Processing Team, Algiers, 16303, Algeria
;2.Palestinian Ministry of Education and Higher Education, Nablus, Palestine
;3.Department of Physics and Astronomy, College of Science, King Saud University, Riyadh, 11451, Saudi Arabia
;4.Division of Computational Physics, Institute for Computational Science, Ton Duc Thang University, Ho Chi Minh City, Vietnam
;5.Faculty of Electrical and Electronics Engineering, Ton Duc Thang University, Ho Chi Minh City, Vietnam
;
Abstract:Journal of Superconductivity and Novel Magnetism - In this paper, the structural, mechanical and optoelectronic properties of X $$_3$$ P $$_2$$ (X= Mg, Ca) have been investigated by using the...
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