Search Results - Springer

Article

Structural electronic and optical properties of chalcopyrite compounds AuMTe₂ (M = Ga, In) from first-principles calculation

This research explored the physical properties of AuMTe₂ (M = Ga, In) chalcopyrite compound. We employ the full-potential linearized augmented plane wave (FP-LAPW) method in combination with the Tran-Blaha modifi...

K. Beggas, N. Boucerredj, S. Ghemid, Z. Chouahda, H. Meradji… in Indian Journal of Physics (2024)

Article

Exploring structural phase transition, electronic and optical characteristics of optoelectronic phosphides XSiP₂ (X = Mg, Cd, and Zn) through First principle computation

The present study reports the properties of pressure-induced phase transition, electronic and optical of phosphides XSiP₂ under pressure in chalcopyrite, sodium chloride (rock salt), and Wurtzite phases. The stud...

O. Drici, F. Semari, H. Meradji, S. Ghemid, R. Khenata… in Journal of Molecular Modeling (2024)

Article

Theoretical investigations of Zr-concentration influence on the thermodynamic, elastic, electronic, and structural stability of D0₂₂/L1₂-Al₃Ti

A theoretical study was conducted to analyze electronic, elastic, and thermodynamic properties and the structural stability of the intermetallic materials Al₃Ti_1−xZr_x for tetragonal-D0₂₂ and cubic-L1₂ structures ...

R. Boulechfar, D. Sayad, Y. Khenioui, H. Meradji… in The European Physical Journal B (2024)

Article

Structural, Electronic, and Magnetic Characteristics of Co_1-xFe_xMnSb: Insight from DFT Computation

Both electronic as well as magnetic characteristics of Co_1-xFe_xMnSb (x = 0, 0.25, 0.50, 0.75, 1) composite have been studied by employing the first principle (FP) study. The FP calculation was attained using the ...

L. Boumia, F. Semari, M. Mokhtari… in Journal of Superconductivity and Novel Mag… (2024)

Article

Aluminium do** effects on physical properties of semiconductors InSb for optoelectronic devices: a computational insight

In this study, first-principles numerical computations for zinc-blende ternary alloys (In_1−xAl_xSb) are performed concerning elastic, structural, electronic, thermal, and optical properties. This study is carried ...

S. Gagui, S. Ghemid, H. Meradji, Muhammad Anjum Javed… in Optical and Quantum Electronics (2023)

Article

First-principles investigations of physical properties of CdXP₂ (X = Si, Ge, and Sn) ternary chalcopyrite

In the present work, we present a theoretical study of the physical properties of ternary CdXP₂ (X: Si, Ge, and Sn) chalcopyrite materials through the full-potential linearized augmented plane wave method. The ge...

N. Taguida, S. Benlamari, H. Meradji, Z. Chouahda, S. Ghemid… in Indian Journal of Physics (2023)

Article

First-principles predictions of the physical properties of GaN_xAs_1–x: Materials for futuristic optoelectronic devices

Knowledge of the physical properties of a material is crucial to realising its practical technological applications. In this regard, a study related to phase stability, transition pressure, electronic properti...

S Gagui, S Ghemid, H Meradji, B Zaidi, Bakhtiar Ul Haq, R Ahmed, B Hadjoudja… in Pramana (2023)

Article

First-principle investigations of structural, electronic, thermal, and mechanical properties of AlP_1−xBi_x alloys

In this work, a comprehensive study concerning the physical properties of ternary alloys system (AlP_1−xBi_x) at different concentrations is presented. The obtained results from our first-principle calculations are...

F. Oumelaz, O. Nemiri, A. Boumaza, H. Meradji, S. Ghemid… in Journal of Molecular Modeling (2023)

Article

A study of the physical properties of GaN, GaP and their mixed ternary alloys for the applications in optoelectronics devices

In this study, for the concentrations of x=0.0, 0.25, 0.5, 0.75 and 1.0, the calculations of the physical properties of GaP_1–xN_x mixed alloys are presented. To perform these calculations, we employ WIEN2k computa...

S Gagui, H Meradji, S Ghemid, Y Megdoud, B Zaidi, B Ul Haq… in Bulletin of Materials Science (2023)

Article

Analysis of phase stability, elastic, electronic, thermal, and optical properties of Sc_1-xY_xN via ab initio methods

Understanding the physical properties of a material is crucial to know its applicability for practical applications. In this study, we investigate the phase stability, elastic, electronic, thermal, and optical...

S. Gagui, H. Meradji, S. Ghemid, S. Naeem, Bakhtiar Ul Haq… in Journal of Molecular Modeling (2022)

Article

First-principles computational study on structural, elastic, magnetic, electronic, and thermoelectric properties of Co₂MnGe: a potential Heusler ternary compound

In this research work, first-principles computational study is performed on the structural, elastic, thermal, magnetic, electronic, and thermoelectric properties of the ternary Heusler compound Co₂MnGe in its cub...

R. Amraoui, S. Kadri, H. Meradji, M. Berkani… in The European Physical Journal B (2022)

Article

Phosphide in gallium bismuth: structural, electronic, elastic, and optical properties of GaP_xBi_1−x alloys

The structural, electronic, elastic, and optical properties of ternary alloys GaP_xBi_1−x as a function of phosphorus concentration were studied using ab initio calculations. We have used the full-potential lineari...

S. Touam, N. Mounis, A. Boumaza, S. Ghemid, H. Meradji… in Journal of Molecular Modeling (2022)

Article

Insight into the Structural, Magneto-electronic, and Mechanical Characteristic of Y₂MnZ (Z = Al, Ga, In) via DFT Computation

The first-principle calculations of density functional theory were used to study the structural, electronic, magnetic, mechanic, and half-metallic behavior of Y₂MnZ (Z = Al, Ga, In) within the spin generalized gr...

C. Zouaneb, F. Dahmane, T. Seddik… in Journal of Superconductivity and Novel Mag… (2022)

Article

Structural and Electronic Properties of ZnSiAs₂, ZnSnAs₂, and Their Mixed Crystals ZnSi_{1 –} _xSn_xAs₂

In this work, the structural and electronic properties of the ternary chalcopyrite semiconductors ZnSiAs₂ and ZnSnAs₂ and their related ZnSi_{1 –} _xSn_xAs₂ quaternary alloys are presented. The density functional theo...

B. Mecheri, H. Meradji, S. Ghemid, H. Bendjeddou, M. Boukhtouta in Semiconductors (2021)

Article

DFT-Based Calculations of the Structural Stability, Electronic and Elastic Characteristics of BBi_1-xSb_x Ternary Ordered Alloys

The structural, phase stability, elastic and electronic properties of Sb-doped BBi have been systematically investigated in the zinc blende phase by means of the first-principle approach based on the density f...

A. Boumaza, S. Ghemid, H. Meradji, O. Nemiri, R. Belghit… in Journal of Electronic Materials (2021)

Article

Structural, electronic, and optical properties of the gallium nitride semiconductor by means of the FP-LAPW method

In the present paper, the structural, electronic, and linear optical properties of different phases of the gallium nitride (GaN) have been investigated. The zinc blende and wurtzite phases of the GaN have been...

F. Z. Gasmi, R. Chemam, R. Graine, B. Boubir, H. Meradji in Journal of Molecular Modeling (2020)

Article

Ab-initio study of ordered III–V antimony-based semiconductor alloys $\mathbf{GaP }_{1-x}{} \mathbf{Sb} _{x} \mathbf{and} AlP _{1-x}{} \mathbf{Sb} _{x}$

In this work, we have investigated the structural, electronic and thermodynamic properties of GaP $_{1-x}$ ...

F Annane, H Meradji, S Ghemid, H Bendjeddou, F El Haj Hassan, Vipul Srivastava… in Pramana (2020)

Article

Phase stability and optoelectronic characteristics of Ba_1−xBe_xS: a DFT-based simulation

The structural stability and optoelectronic properties of the ternary Ba_1−xBe_xS alloys along with the pure binary compounds BaS and BeS in the rock-salt (B1) and zinc-blende (B3) phases were investigated by the d...

S. Gagui, H. Bendjeddou, H. Meradji, B. Chouial… in Journal of Molecular Modeling (2020)

Article

First-principles computations of $\hbox {Y}_{x}\hbox {Ga}_{1-{x}}$ As-ternary alloys: a study on structural, electronic, optical and elastic properties

In this work, the first-principles computational study on the structural, elastic, electronic and optical properties of $$\hbox {Y}_{x}\hbox {...

S Touam, R Belghit, R Mahdjoubi, Y Megdoud, H Meradji… in Bulletin of Materials Science (2019)

27 Result(s)

Structural electronic and optical properties of chalcopyrite compounds AuMTe₂ (M = Ga, In) from first-principles calculation

Exploring structural phase transition, electronic and optical characteristics of optoelectronic phosphides XSiP₂ (X = Mg, Cd, and Zn) through First principle computation

Theoretical investigations of Zr-concentration influence on the thermodynamic, elastic, electronic, and structural stability of D0₂₂/L1₂-Al₃Ti

Structural, Electronic, and Magnetic Characteristics of Co_1-xFe_xMnSb: Insight from DFT Computation

Aluminium do** effects on physical properties of semiconductors InSb for optoelectronic devices: a computational insight

First-principles investigations of physical properties of CdXP₂ (X = Si, Ge, and Sn) ternary chalcopyrite

First-principles predictions of the physical properties of GaN_xAs_1–x: Materials for futuristic optoelectronic devices

First-principle investigations of structural, electronic, thermal, and mechanical properties of AlP_1−xBi_x alloys

A study of the physical properties of GaN, GaP and their mixed ternary alloys for the applications in optoelectronics devices

Analysis of phase stability, elastic, electronic, thermal, and optical properties of Sc_1-xY_xN via ab initio methods

First-principles computational study on structural, elastic, magnetic, electronic, and thermoelectric properties of Co₂MnGe: a potential Heusler ternary compound

Correction to: Phosphide in gallium bismuth: structural, electronic, elastic, and optical properties of GaP_xBi_1−x alloys

Phosphide in gallium bismuth: structural, electronic, elastic, and optical properties of GaP_xBi_1−x alloys

Insight into the Structural, Magneto-electronic, and Mechanical Characteristic of Y₂MnZ (Z = Al, Ga, In) via DFT Computation

Structural and Electronic Properties of ZnSiAs₂, ZnSnAs₂, and Their Mixed Crystals ZnSi_{1 –} _xSn_xAs₂

DFT-Based Calculations of the Structural Stability, Electronic and Elastic Characteristics of BBi_1-xSb_x Ternary Ordered Alloys

Structural, electronic, and optical properties of the gallium nitride semiconductor by means of the FP-LAPW method

Ab-initio study of ordered III–V antimony-based semiconductor alloys \(\mathbf{GaP }_{1-x}{} \mathbf{Sb} _{x} \mathbf{and} AlP _{1-x}{} \mathbf{Sb} _{x}\)

Phase stability and optoelectronic characteristics of Ba_1−xBe_xS: a DFT-based simulation

First-principles computations of \(\hbox {Y}_{x}\hbox {Ga}_{1-{x}}\) As-ternary alloys: a study on structural, electronic, optical and elastic properties

Our Content

Other Sites

Help & Contacts