Investigation of the physical properties of CoRuVAl equiatomic quaternary Heusler alloy using first-principles calculations
We have computed the structural, mechanical, and thermal stability, as well as electronic,
magnetic, and transport properties of the CoRuVAl equiatomic quaternary Heusler alloy. The …
magnetic, and transport properties of the CoRuVAl equiatomic quaternary Heusler alloy. The …
Insight on structural, electronic and thermoelectric properties of perovskite AgBaCl3 by an Ab-initio for solar cell and renewable energy
The physical properties of the Ag-based perovskite compound AgBaCl 3 has been studied
utilizing FP-LAPW approach as embedded in WIEN2k code. The PBE-GGA approximation …
utilizing FP-LAPW approach as embedded in WIEN2k code. The PBE-GGA approximation …
First-principles calculations on novel Co-based equiatomic quaternary heusler alloys for spintronics
The structural, mechanical, electronic, and magnetic properties of the new series of Co-
based Equiatomic Quaternary Heusler Alloys (EQHAs) XX'YZ (X= Co; X'= Zr, Ru; Y= Ti, V; Z …
based Equiatomic Quaternary Heusler Alloys (EQHAs) XX'YZ (X= Co; X'= Zr, Ru; Y= Ti, V; Z …
Thermoelectric performance of newly discovered LiHfPdZ (Z= Al, Ga, and In) quaternary Heusler compounds: A DFT study
L Suktel, SM Saini - Physica B: Condensed Matter, 2024 - Elsevier
Abstract Li-based quaternary Heusler LiHfPdZ (Z= Al, Ga, and In) compounds have been
investigated for their electronic properties, structural stability, phonon spectra, and …
investigated for their electronic properties, structural stability, phonon spectra, and …
Microstructure, optical and electrical characterizations of Bi-incorporated Sb2Te3 thermoelectric compound synthesized by mechanical alloying: A comparative study …
S Paul, SK Pradhan - Materials Today: Proceedings, 2022 - Elsevier
Bismuth incorporated antimony telluride has been synthesized within 3 h via the facile
mechanical alloying method at room temperature. The rhombohedral crystal structure …
mechanical alloying method at room temperature. The rhombohedral crystal structure …
First-principles study on rare earth-based equiatomic quaternary Heusler alloys YbCoCrSb and YbCoTiSn: New candidates for spintronics
V Aravindan, V Vijayanarayanan… - Materials Today …, 2024 - Elsevier
We have investigated the structural, mechanical, thermal, electronic, magnetic, and half-
metallic properties of new Yb-based EQHAs such as YbCoCrSb and YbCoTiSn using first …
metallic properties of new Yb-based EQHAs such as YbCoCrSb and YbCoTiSn using first …
Comparative analysis of electronic, mechanical, vibrational, thermodynamical and thermoelectric properties of Li based quaternary Heusler's LiNbRhAl, LiNbRhGa …
L Suktel, SM Saini - Computational Condensed Matter, 2025 - Elsevier
We have performed a comprehensive demonstration of electrical, structural, dynamical,
mechanical, thermodynamical and transport properties of Li based LiNbRhZ (Z= Al, Ga, and …
mechanical, thermodynamical and transport properties of Li based LiNbRhZ (Z= Al, Ga, and …
Comprehensive investigation of Li-based novel quaternary Heusler LiTiPdZ (Z= Al, Ga, In) compounds for thermoelectric performance
L Suktel, SM Saini - Physica Scripta, 2024 - iopscience.iop.org
In the present article, we used Density Functional Theory and the Boltzmann transport
equation to study the structural, electronic, and thermoelectric (TE) properties along with …
equation to study the structural, electronic, and thermoelectric (TE) properties along with …