Add to ORKGDensity functional theory calculations are performed to investigate the electrical electronic, magnetic, and thermoelectric properties of CrTiRhAl quaternary Heusler alloy (QHA). The type-I atomic configuration is found to be the most stable structure of this alloy. The CrTiRhAl QHA exhibits a half-metallic ferromagnetic structure with a narrow band gap at one spin channel (semiconductor), and a metallic behavior at the other spin channel. This corresponds to a 100% spin-polarization, making it ideal for potential spintronic applications. Applying the semi-classical Boltzmann theory, the Seebeck coefficient, electrical conductivity, and electronic thermal conductivity of CrTiRhAl alloy were calculated. The predicted figure of merit (ZT) was...
Heusler alloys are theoretically predicted to become half-metals at room temperature (RT). The advan...
Heusler alloys are theoretically predicted to become half-metals at room temperature (RT). The advan...
Abstract By using density functional theory, we have explored the structural, electro-mechanical, th...
The structural, dynamical, electronic, and thermoelectric properties of rock-salt and wurtzite Cd1-x...
The electronic, magnetic, and thermoelectric properties of transition-metal based compounds were inv...
Thermoelectric materials have potential properties for utilizing waste heat. The computations are us...
818-824The ab initio calculations based on the density functional theory (DFT) using the self-consis...
The ab initio calculations based on the density functional theory (DFT) using the self-consistent fu...
Structural, half-metallic, magneto-optic, and thermoelectric properties of CrTiZ (Z = As, P) half-He...
In this report, the structural, electronic, magnetic and thermoelectric properties of CoX′NbGa (X′ =...
The half-metallic ferromagnets are likely materials to the spintronics systems for the next generati...
Spin semimetals are a recently discovered new class of spintronic materials, which exhibit a band ga...
Half-metallic ferromagnetic (HMF) materials show high spin polarization and are therefore interestin...
The thermoelectric properties of 54 different group 4 half-Heusler (HH) alloys have been studied fro...
We synthesize CoFeRuSn equiatomic quaternary Heusler alloy using arc-melt technique and investigate ...
Heusler alloys are theoretically predicted to become half-metals at room temperature (RT). The advan...
Heusler alloys are theoretically predicted to become half-metals at room temperature (RT). The advan...
Abstract By using density functional theory, we have explored the structural, electro-mechanical, th...
The structural, dynamical, electronic, and thermoelectric properties of rock-salt and wurtzite Cd1-x...
The electronic, magnetic, and thermoelectric properties of transition-metal based compounds were inv...
Thermoelectric materials have potential properties for utilizing waste heat. The computations are us...
818-824The ab initio calculations based on the density functional theory (DFT) using the self-consis...
The ab initio calculations based on the density functional theory (DFT) using the self-consistent fu...
Structural, half-metallic, magneto-optic, and thermoelectric properties of CrTiZ (Z = As, P) half-He...
In this report, the structural, electronic, magnetic and thermoelectric properties of CoX′NbGa (X′ =...
The half-metallic ferromagnets are likely materials to the spintronics systems for the next generati...
Spin semimetals are a recently discovered new class of spintronic materials, which exhibit a band ga...
Half-metallic ferromagnetic (HMF) materials show high spin polarization and are therefore interestin...
The thermoelectric properties of 54 different group 4 half-Heusler (HH) alloys have been studied fro...
We synthesize CoFeRuSn equiatomic quaternary Heusler alloy using arc-melt technique and investigate ...
Heusler alloys are theoretically predicted to become half-metals at room temperature (RT). The advan...
Heusler alloys are theoretically predicted to become half-metals at room temperature (RT). The advan...
Abstract By using density functional theory, we have explored the structural, electro-mechanical, th...