Computational characterization of structural, optoelectronic and thermoelectric properties of some double half-Heusler alloys X 2 FeY′Sb 2 (X: Hf, Zr ;Y′: Ni, Pd)

Structural parameters, electronic structure and linear optical functions of LuXCo2Sb2 (X = V, Nb and Ta) double half Heusler alloys

(2023) S. Sâad Essaoud et al.   PHYSICA B-CONDENSED MATTER

DFT-based investigation of electronic-structure, magnetic and thermoelectric properties of Dy2CoMnO6 double perovskite

(2023) Saber Saad Essaoud et al.   PHYSICA SCRIPTA

Investigation of electronic, optical, and thermoelectric properties of half-metallic spinel X2NO4 (X=B, Al): First-principles calculations

(2023) Anas Y. Al-Reyahi et al.   Computational Condensed Matter

Structural, mechanical, electronic, and thermoelectric properties of TiZrCo2Bi2, TiHfCo2Bi2, and ZrHfCo2Bi2 double half Heusler semiconductors

(2023) Amel Slamani et al.   Emergent Materials

Pressure dependence of the electronic, optical, thermoelectric, thermodynamic properties of CsVO3: first-principles study

(2022) S. Sâad Essaoud et al.   PHILOSOPHICAL MAGAZINE

Opto-electronic, thermodynamic and charge carriers transport properties of Ta2FeNiSn2 and Nb2FeNiSn2 double half-Heusler alloys

(2022) Khadidja Berarma et al.   SEMICONDUCTOR SCIENCE AND TECHNOLOGY

Stability, electronic band structure, magnetic, optical and thermoelectric properties of CoXCrZ (X = Fe, Mn and Z = Al, Si) and FeMnCrSb quaternary Heusler

(2022) K. Bouferrache et al.   CHINESE JOURNAL OF PHYSICS

First-principles calculation of magnetic, structural, dynamic, electronic, elastic, thermodynamic and thermoelectric properties of Co2ZrZ (Z = Al, Si) Heusler alloys

(2021) S. Sâad Essaoud et al.   JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS

Origin of pseudo gap and thermoelectric signatures of semimetallic Ru2TaGa: Structural stability from phonon dynamics, mechanical, and thermodynamic predictions

(2021) Shakeel Ahmad Khandy et al.   JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS

Spin-polarized electromagnetic and optical response of full-Heusler Co2VZ (Z = Al, Be) alloys for spintronic application

(2021) Junaid Munir et al.   European Physical Journal Plus

Thermoelectric properties, phonon, and mechanical stability of new half-metallic quaternary Heusler alloys: FeRhCrZ (Z = Si and Ge)

(2020) Shakeel Ahmad Khandy et al.   JOURNAL OF APPLIED PHYSICS

Strain engineering of electronic structure, phonon, and thermoelectric properties of p-type half-Heusler semiconductor

(2020) Shakeel Ahmad Khandy et al.   JOURNAL OF ALLOYS AND COMPOUNDS

Novel half-metallic L21 structured full-Heusler compound for promising spintronic applications: A DFT-based computer simulation

(2019) Shakeel Ahmad Khandy et al.   JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS

A high dielectric constant non-fullerene acceptor for efficient bulk-heterojunction organic solar cells

(2018) Xi Liu et al.   Journal of Materials Chemistry A

Local Bonding Influence on the Band Edge and Band Gap Formation in Quaternary Chalcopyrites

(2017) Anna Miglio et al.   Advanced Science

Basics and prospective of magnetic Heusler compounds

(2015) Claudia Felser et al.   APL Materials

The Open Quantum Materials Database (OQMD): assessing the accuracy of DFT formation energies

(2015) Scott Kirklin et al.   npj Computational Materials

Heusler-alloy films for spintronic devices

(2013) Atsufumi Hirohata et al.   APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING

Materials Design and Discovery with High-Throughput Density Functional Theory: The Open Quantum Materials Database (OQMD)

(2013) James E. Saal et al.   JOM

Curvature of the lanthanide contraction: An explanation

(2010) Kenneth N. Raymond et al.   COMPTES RENDUS CHIMIE

First-principles study of structural, elastic, electronic and optical properties of rutile GeO2 and α-quartz GeO2

(2010) Qi-Jun Liu et al.   SOLID STATE SCIENCES

“All-Heusler alloy” current-perpendicular-to-plane giant magnetoresistance

(2009) Konstantin Nikolaev et al.   APPLIED PHYSICS LETTERS

Current-perpendicular-to-plane giant magnetoresistance of a spin valve using Co2MnSi Heusler alloy electrodes

(2009) K. Kodama et al.   JOURNAL OF APPLIED PHYSICS

Tunnel magnetoresistance in epitaxially grown magnetic tunnel junctions using Heusler alloy electrode and MgO barrier

(2009) S Tsunegi et al.   JOURNAL OF PHYSICS D-APPLIED PHYSICS

Spin-dependent tunnelling characteristics of fully epitaxial magnetic tunnel junctions with a Heusler alloy Co2MnGe thin film and a MgO barrier

(2009) Tomoyuki Taira et al.   JOURNAL OF PHYSICS D-APPLIED PHYSICS

Current-perpendicular-to-plane giant magnetoresistance in spin-valve structures using epitaxial Co2FeAl0.5Si0.5/Ag/Co2FeAl0.5Si0.5 trilayers

(2008) T. Furubayashi et al.   APPLIED PHYSICS LETTERS