Thermoelectric properties, phonon, and mechanical stability of new half-metallic quaternary Heusler alloys: FeRhCrZ (Z= Si and Ge)
Computer simulations within the framework of density functional theory are performed to
study the electronic, dynamic, elastic, magnetic, and thermoelectric properties of a newly …
study the electronic, dynamic, elastic, magnetic, and thermoelectric properties of a newly …
Cobalt-based full Heusler compounds Co2FeZ (Z= Al, Si, and Ga): A comprehensive study of competition between XA and L21 atomic ordering with ab initio …
Y El Krimi, R Masrour - Materials Science and Engineering: B, 2022 - Elsevier
To study the structural properties of Co 2 FeZ (Z= Al, Si, Ga)(CFZ) alloys, we will use the
approximation method GGA-PBE based on the method of plane waves increased by linear …
approximation method GGA-PBE based on the method of plane waves increased by linear …
Effect of L21 and XA ordering on structural, martensitic, electronic, magnetic, elastic, thermal and thermoelectric properties of Co2FeGe Heusler alloys
Based on density functional theory (DFT), the structural, martensitic transition, band
structure, density of states, elastic, magnetic, and thermoelectric properties of L2 1 and XA …
structure, density of states, elastic, magnetic, and thermoelectric properties of L2 1 and XA …
Stability, magnetic, electronic, elastic, thermodynamic, optical, and thermoelectric properties of Co2TiSn, Co2ZrSn and Co2HfSn Heusler alloys from calculations …
Abstract Structural, magnetic, electronic, elastic, thermodynamic, optical, and thermoelectric
properties of full-Heusler alloys Co2YSn (Y= Ti; Zr; Hf) were determined using density …
properties of full-Heusler alloys Co2YSn (Y= Ti; Zr; Hf) were determined using density …
Structural, thermodynamics, optical, electronic, magnetic and thermoelectric properties of Heusler Ni2MnGa: An ab initio calculations
IA Elkoua, R Masrour - Optical and Quantum Electronics, 2022 - Springer
Optoelectronic properties of the quaternary Heusler Ni2MnGa alloy were analyzed by using
the full-potential linearized augmented-plane wave (FPLAPW), which is based on density …
the full-potential linearized augmented-plane wave (FPLAPW), which is based on density …
Robust thermoelectric performance and high spin polarisation in CoMnTiAl and FeMnTiAl compounds
TM Bhat, DC Gupta - RSC Advances, 2016 - pubs.rsc.org
New quaternary Heusler materials, CoMnTiAl and FeMnTiAl, have been investigated. These
alloys are found to be stable in a ferromagnetic phase in Y1 type structure; the stability is …
alloys are found to be stable in a ferromagnetic phase in Y1 type structure; the stability is …
Structural, Electronic, Magnetic, Elastic, Thermoelectric, and Thermal Properties of Co2FeGa1−xSix Heusler Alloys: First-Principles Calculations
In this study, we have investigated the structural, electronic, magnetic, elastic, thermoelectric,
and thermal properties of Co2FeGa1− xSix with 0≤ x≤ 1 through the first-principles density …
and thermal properties of Co2FeGa1− xSix with 0≤ x≤ 1 through the first-principles density …
Robust stability, half-metallic ferrimagnetism and thermoelectric properties of new quaternary Heusler material: a first principles approach
Like full or half-heusler materials, equiatomic quaternary Heuslers (EQH) also display
various intriguing physical properties. We carried out the strict and rigorous density …
various intriguing physical properties. We carried out the strict and rigorous density …
Structural stability, electronic, magnetic, elastic, thermal, thermoelectric and optical properties of L21 and xa phases of Ti2fege heusler compound: GGA and GGA+U …
Both L21 and XA type phases ordering of Ti2FeGe compound were investigated based on
density functional theory. The structural, magnetic, band structure, density of states …
density functional theory. The structural, magnetic, band structure, density of states …
Half metallic Heusler alloys XMnGe (X= Ti, Zr, Hf) for spin flip and thermoelectric device application–Material computations
The ground state properties of XMnGe (X= Ti, Zr, Hf) magnetic half Heusler alloys have been
investigated through density functional theory. Two different exchange correlation …
investigated through density functional theory. Two different exchange correlation …