Structural and mechanical stability, lattice dynamics and electronic structure of the novel CrVZ (Z= S, Se, & Te) half-Heusler alloys
To meet energy demand, half-Heuslers (HH) are proved to be a cost-effective and energy-
efficient choice for advanced spintronic and energy storage applications. The structural …
efficient choice for advanced spintronic and energy storage applications. The structural …
Prediction of some physical properties in new half Heusler alloy NbAgSi
A first principle investigation of structural, dynamical, mechanical, thermodynamic and
electronic properties of 'NbAgSi'alloy was performed using the density functional theory …
electronic properties of 'NbAgSi'alloy was performed using the density functional theory …
Investigation of the structural, mechanical, anisotropic, thermal conductivity, electronic, and phonon properties of RhTiZ (Z: As, sb) half heusler compounds under high …
This investigation delves into the effects of pressure on the structural, elastic, thermal
conductivity, anisotropy, electronic, and phonon properties of the RhTiZ (Z: As, Sb) …
conductivity, anisotropy, electronic, and phonon properties of the RhTiZ (Z: As, Sb) …
A first principles study of stability, electronic and thermoelectric characteristics of novel high temperature half-heusler alloys ScAgX (X= Si, Ge, Sn)
R Rani, MM Sinha - Physica B: Condensed Matter, 2024 - Elsevier
To meet the ever-increasing renewable energy demand Half-Heusler (HH) materials can be
a potential candidate. Heusler materials are seeking popularity as efficient high-temperature …
a potential candidate. Heusler materials are seeking popularity as efficient high-temperature …
Theoretical Investigation of Half-metallicity and Pressure-induced Half-metallic Band Gap in Half Heusler RuMnZ (Z= Si, Ge, Sn, P, As, Sb, Se, and Te) Alloys
NN Puthusseri, B Natesan - Journal of Superconductivity and Novel …, 2023 - Springer
We predict a series of XYZ-type half-Heusler RuMnZ (Z= Si, Ge, Sn, P, As, Sb, Se, and Te)
alloys, using density functional theory (DFT) calculations. Structural, electronic structure …
alloys, using density functional theory (DFT) calculations. Structural, electronic structure …
Computational analysis of the physical properties of AlNi ıntermetallic compound: pressure effect
Some physical properties of AlNi alloy, which is known to be suitable for high-temperature
applications, were analyzed theoretically by the DFT method under pressure. Structural …
applications, were analyzed theoretically by the DFT method under pressure. Structural …
DFT analysis of mechanical and dynamic properties of CuBe
In this study, we have presented a comprehensive theoretical calculation to analyze the
mechanical, and dynamic properties of the CuBe with the Density Functional Theory (DFT) …
mechanical, and dynamic properties of the CuBe with the Density Functional Theory (DFT) …
[PDF][PDF] Journal of Science
IK DURUKAN, YO CIFTCI - scholar.archive.org
Intermetallic compounds have managed to attract the attention of scientists from different
fields such as materials science, condensed matter physics, and geophysics for decades [1 …
fields such as materials science, condensed matter physics, and geophysics for decades [1 …