Elastic, electronic and optical properties of ZnS, ZnSe and ZnTe under pressure
The results of first-principles theoretical study of the structural, electronic and optical
properties of zinc monochacogenides ZnS, ZnSe and ZnTe, have been performed using the …
properties of zinc monochacogenides ZnS, ZnSe and ZnTe, have been performed using the …
Probing of Ferromagnetism and Electronic transport characteristics of Rare‐earth‐based CdEr2X4 (X= S, Se) Spinels for Spintronic and Energy Harvesting …
HA Alburaih - Journal of Alloys and Compounds, 2021 - Elsevier
In order to investigate the source of ferromagnetic semiconducting behavior of the materials,
CdEr 2 X 4 (X= S, Se), full potential methods have been employed for their elastic, structural …
CdEr 2 X 4 (X= S, Se), full potential methods have been employed for their elastic, structural …
Theoretical investigation of mechanical, optoelectronic and thermoelectric properties of BiGaO3 and BiInO3 compounds
RB Behram, MA Iqbal, SM Alay-e-Abbas… - Materials Science in …, 2016 - Elsevier
Abstract The cubic BiGaO 3 and BiInO 3 perovskite oxides have been investigated for their
structural stability, mechanical and opto-electronic properties by employing the density …
structural stability, mechanical and opto-electronic properties by employing the density …
Elastic and optical properties of BeS, BeSe and BeTe under pressure
We have performed the first principles full-potential linearized augmented plane wave
calculations (FP-LAPW) with density functional theory in local density approximations (LDA) …
calculations (FP-LAPW) with density functional theory in local density approximations (LDA) …
Shift of indirect to direct bandgap and thermoelectric response of the cubic BiScO3 via DFT-mBJ studies
NA Noor, M Rashid, SM Alay-e-Abbas, M Raza… - Materials Science in …, 2016 - Elsevier
The mechanical, electronic, optical and thermoelectric properties of cubic perovskite BiScO
3 are studied by using density functional theory. The lattice parameter of BiScO 3 calculated …
3 are studied by using density functional theory. The lattice parameter of BiScO 3 calculated …
Full-potential investigation of the electronic and optical properties of stressed CdTe and ZnTe
A new first principles method was performed in order to study systematically and more
accurately the electronic and optical properties of stressed CdTe and ZnTe. Our calculations …
accurately the electronic and optical properties of stressed CdTe and ZnTe. Our calculations …
Structural, thermal, elastic, electronic and magnetic properties of cubic lanthanide based perovskites type oxides PrXO3 (X = V, Cr, Mn, Fe): insights from ab initio …
M El Amine Monir, FZ Dahou - SN Applied Sciences, 2020 - Springer
Different properties such as the structural, elastic, thermal, electronic, magnetic as well as
the Curie temperature and the formation energy of the cubic perovskites PrXO 3 compounds …
the Curie temperature and the formation energy of the cubic perovskites PrXO 3 compounds …
Zinc-blende AlN and GaN under pressure: structural, electronic, elastic and piezoelectric properties
In this paper we report a theoretical study of the structural, elastic, electronic and
piezoelectric properties of zinc-blende AlN and GaN under the pressure effect. The study is …
piezoelectric properties of zinc-blende AlN and GaN under the pressure effect. The study is …
Prediction study of elastic properties under pressure effect for zincblende BN, AlN, GaN and InN
We have performed a first-principles full-potential augmented-plane wave plus local orbitals
(FP-APW+ lo) calculations with density functional theory in local density approximation, in …
(FP-APW+ lo) calculations with density functional theory in local density approximation, in …
Study of the Zn0. 75M0. 25Te (M= Fe, Co, Ni) diluted magnetic semiconductor system by first principles approach
Abstract Structure, mechanical and electronic properties of ternary Zn 0.75 M 0.25 Te (M=
Fe, Co and Ni) diluted magnetic semiconductor system has been studied by first principles …
Fe, Co and Ni) diluted magnetic semiconductor system has been studied by first principles …