Investigations on full-Heusler alloys Mn2TaAl and Mn2WAl for spintronic and thermoelectric applications

XP Wei, X Liu, JY Zhang, YL Zhang, X Tao - Iscience, 2024 - cell.com
Half-metallic materials are widely used as spintronic devices such as electrodes, magnetic
tunneling junction, and giant magnetoresistance. In this work, we have systematically …

Investigation of the physical properties of CoRuVAl equiatomic quaternary Heusler alloy using first-principles calculations

V Aravindan, AK Rajarajan, V Vijayanarayanan… - Physica B: Condensed …, 2022 - Elsevier
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 …

Insight on structural, electronic and thermoelectric properties of perovskite AgBaCl3 by an Ab-initio for solar cell and renewable energy

A Saxena, A Dixit, D Behera, JA Abraham… - Materials Today …, 2023 - Elsevier
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 …

First-principles calculations on novel Co-based equiatomic quaternary heusler alloys for spintronics

V Aravindan, AK Rajarajan, V Vijayanarayanan… - Materials Science in …, 2022 - Elsevier
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 …

DFT+ U investigations and Monte Carlo simulations on the structural, mechanical, electronic and magnetic properties of the half-heusler alloy CoMnSe for spintronics …

Y Toual, S Mouchou, A Azouaoui… - Physica B: Condensed …, 2023 - Elsevier
We report the structural stability and half-metallicity of the half-Heusler alloy CoMnSe via the
density functional theory (DFT). The γ-phase ferromagnetic of CoMnSe is more energetically …

[HTML][HTML] Integrating Experimental and Computational Insights: A Dual Approach to Ba2CoWO6 Double Perovskites

RK Raji, T Ramachandran, M Dhilip, V Aravindan… - Ceramics, 2024 - mdpi.com
Double perovskite materials have emerged as key players in the realm of advanced
materials due to their unique structural and functional properties. This research mainly …

XRD peak broadening modelling for Al-alloys characterization compared with Rietveld profile analysis

MYA Mostafa, A Mostafa, M Abdel-Rahman… - Materials Today …, 2023 - Elsevier
In this work, a facile novel modeling approach was used for XRD microstructural elements,
such as Scherrer (Sch.) size of crystallite, Williamson-Hall (WH) size of crystallite, and …

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 …

Electrical characteristics of Mg doped GeO2 NWs based device

A Choudhury, A Dey, A Mondal - Materials Today: Proceedings, 2023 - Elsevier
In this article, the growth of a undoped GeO 2 and Mg doped GeO 2 nanowires (NWs) by
electron beam evaporation method and analysis of its electrical properties has been …