DFT assessment on stabilities, electronic and thermal transport properties of CoZrSb1−xBix half-Heusler alloys and their superlattices
Herein, an ab initio study was conducted to investigate the properties of CoZrSb1− x Bi x half-
Heusler alloys and their (CoZrSb) n/(CoZrBi) n superlattices. The structural stability revealed …
Heusler alloys and their (CoZrSb) n/(CoZrBi) n superlattices. The structural stability revealed …
Co2CrGa as a novel promising thermoelectric and magnetocaloric material
Abstract The optimization of Co 2 CrGa structure by full-potential linearized augmented
plane wave (FPLAPW) with the Perdew–Burke–Ernzehof generalized gradient …
plane wave (FPLAPW) with the Perdew–Burke–Ernzehof generalized gradient …
A comparative study of physical and thermoelectrical characteristics of the new full‐Heusler alloys Ag2TiGa and Ag2VGa with ab initio calculations
IA Elkoua, R Masrour - International Journal of Quantum …, 2024 - Wiley Online Library
This paper will focus on the comparative study of the structural, electronic, magnetic, optical,
and thermoelectric properties of the two Heusler systems Ag2TiGa and Ag2VGa in the …
and thermoelectric properties of the two Heusler systems Ag2TiGa and Ag2VGa in the …
Computational study of structural, electronic, elastic, half-metallic and thermoelectric properties of CoCrScZ (Z= Al, Si, Ge, and Ga) quaternary Heusler alloys
S Berri - Journal of Superconductivity and Novel Magnetism, 2020 - Springer
The structure, electronic, half-metallic, elastic, and thermoelectric properties of the innovative
quaternary Heusler (QH) CoCrScZ (Z= Al, Si, Ge, and Ga) alloys are studied by using …
quaternary Heusler (QH) CoCrScZ (Z= Al, Si, Ge, and Ga) alloys are studied by using …
Electronic and magnetic properties of the Co2-based Heusler compounds under pressure: first-principles and Monte Carlo studies
MA Zagrebin, VV Sokolovskiy… - Journal of Physics D …, 2016 - iopscience.iop.org
Structural, magnetic and electronic properties of stoichiometric Co 2 YZ Heusler alloys (Y=
Cr, Fe, Mn and Z= Al, Si, Ge) have been studied by means of ab initio calculations and …
Cr, Fe, Mn and Z= Al, Si, Ge) have been studied by means of ab initio calculations and …
Theoretical study of the structural, electronic and magnetic properties of film surface and bulk based quaternary Heusler alloys Ni-Co-Mn-In
In this work, we will the theoretical study of the electronic and magnetic properties of thin (0 0
1) surface layers of about 1 μ m in size based on Heusler Ni 50 Mn 34.5 In 15.5 quaternary …
1) surface layers of about 1 μ m in size based on Heusler Ni 50 Mn 34.5 In 15.5 quaternary …
Effect of Disorder on Electronic, Magnetic, and Optical Properties of Co2CrZ Heusler Alloys (Z = Al, Ga, Si, Ge)
This paper presents the effect of disorder on electronic, magnetic, and optical properties of
Co 2 CrZ (Z= Al, Si, Ga, Ge) Heusler alloy using density functional theory. Binary mixing is …
Co 2 CrZ (Z= Al, Si, Ga, Ge) Heusler alloy using density functional theory. Binary mixing is …
First-principles study on structural, electronic, elastic and thermodynamic properties of the full-Heusler alloys Co2YZ (Y= Sc, Cr and Z= Al, Ga)
Y Li, H Yuan, J Xia, G Zhang, M Zhong… - The European Physical …, 2015 - epjap.org
First-principles calculations based on density functional theory (DFT) and quasi-harmonic
Debye model are performed to study the structural, elastic, electronic and thermodynamic …
Debye model are performed to study the structural, elastic, electronic and thermodynamic …
Synthesis of Copper Nanosheets Coatings onto Glass and Glass/CrSe2 Substrates Using Ion Coating Technique for Terahertz Technology
LHK Alfhaid, AF Qasrawi - Crystal Research and Technology, 2023 - Wiley Online Library
In this study, copper (Cu) nanosheets are utilized as semitransparent conducting optical
windows for the fabrication of terahertz band filters based on chromium selenide (CrSe2) …
windows for the fabrication of terahertz band filters based on chromium selenide (CrSe2) …
GGA and GGA plus U study of half-metallic quaternary Heusler compound CoCrScSn
C Zhang, H Huang, C Wu, Z Zhu, Z He, G Liu - Frontiers in Physics, 2020 - frontiersin.org
The structural, mechanical, electronic, magnetic, and half-metallic properties of quaternary
Heusler compound CoCrScSn are studied using the GGA and GGA+ U method based on …
Heusler compound CoCrScSn are studied using the GGA and GGA+ U method based on …