Structural, mechanical, magnetic, electronic, and thermal investigations of Ag2YB (Y = Nd, Sm, Gd) full-Heusler alloys

B Asma, F Belkharroubi, A Ibrahim, B Lamia… - Emergent …, 2021 - Springer
A series of full-Heusler based on rare earth Ag2YB (Y= Nd, Sm, Gd) are studied by
linearized augmented plane waves with total potential (FP-LAPW) method. We have …
Αποθήκευση Παράθεση Γίνεται αναφορά σε 82 Σχετικά άρθρα Όλες οι 3 εκδοχές

Investigation of structural, elastic, electronic, and magnetic proprieties for X2LuSb (X = Mn and Ir) full-Heusler alloys

L Samia, F Belkharroubi, A Ibrahim, BF Lamia… - Emergent …, 2022 - Springer
A study on the structural, elastic, electronic, and magnetic properties of full-Heusler X2LuSb
(X= Mn and Ir) compounds by using the first principle calculations within generalized …
Αποθήκευση Παράθεση Γίνεται αναφορά σε 70 Σχετικά άρθρα

DFT analysis of elastic and optoelectronic properties of Cs2NaXCl6 (X= In, La, Sc, Y) double perovskite compounds

S Shakeel, P Song, SH Shah, Z Zada, T Huang… - Materials Chemistry and …, 2024 - Elsevier
This study employs first-principles Density Functional Theory (DFT) to investigate the
structural, electronic, and optical properties of double perovskites Cs 2 NaXCl 6 (X= In, La …
Αποθήκευση Παράθεση Γίνεται αναφορά σε 10 Σχετικά άρθρα

Investigation of the physical properties of the equiatomic quaternary Heusler alloy CoYCrZ (Z= Si and Ge): a DFT study

S Idrissi, H Labrim, S Ziti, L Bahmad - Applied Physics A, 2020 - Springer
In this manuscript, we investigate the physical properties such as the magnetic and the
electronic properties of the Co-based equiatomic quaternary Heusler alloy CoYCrZ (Z= Si …
Αποθήκευση Παράθεση Γίνεται αναφορά σε 85 Σχετικά άρθρα Όλες οι 4 εκδοχές

Impact of 5d electrons on half metallic ferromagnetism, and thermoelectric properties of Cs2Z (Cl/Br) 6 (Z= Os, Ir) for spintronic applications

Q Mahmood, G Nazir, A Rahim, J Alzahrani… - Materials Chemistry and …, 2022 - Elsevier
Half metallicity is an appealing platform for emerging spintronic applications. The
researchers are focusing to find out the best material for such an application. Here, we …
Αποθήκευση Παράθεση Γίνεται αναφορά σε 27 Σχετικά άρθρα

First-principles calculations to investigate structural stability, half-metallic behavior, thermophysical and thermoelectric properties of Co2YAl (Y= Mo, Tc) full Heusler …

A Kumar, SA Sofi, T Chandel, N Thakur - Computational and Theoretical …, 2023 - Elsevier
The present manuscript reports structural stability, half-metallic behavior, thermophysical
and thermoelectric properties of Co 2 MoAl and Co 2 TcAl full Heusler compounds using first …
Αποθήκευση Παράθεση Γίνεται αναφορά σε 19 Σχετικά άρθρα

Origin of semiconductor and half‐metallic behaviors in the perovskite materials RbXF3 (X = Co, Mn, Fe or V): A GGA + U approach

S Idrissi, A Jabar, L Bahmad - International Journal of Quantum …, 2024 - Wiley Online Library
In this paper, we study and discuss the structural, and electronic properties of the RbXF3 (X=
Co, Mn, V or Fe) Perovskite Materials using the Density Functional Theory (DFT). Also, the …
Αποθήκευση Παράθεση Γίνεται αναφορά σε 15 Σχετικά άρθρα
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Semiconducting Heusler Compounds beyond the Slater-Pauling Rule

M Parzer, F Garmroudi, A Riss, M Reticcioli… - PRX Energy, 2024 - APS
Heusler compounds with semiconducting properties represent an important class of
functional materials. Usually, research on these systems is guided by simple electron …
Αποθήκευση Παράθεση Γίνεται αναφορά σε 2 Σχετικά άρθρα Όλες οι 4 εκδοχές

Earth-abundant nontoxic ternary calcium nitrides inverse perovskites for single-junction solar cells: Ab-initio simulations

S Dahbi, N Tahiri, O El Bounagui… - Materials Science in …, 2022 - Elsevier
A single-junction solar cell with a direct and ideal photovoltaic forbidden bandgap value
which maximizes the photon absorbed is needed for the diversity of solar energy …
Αποθήκευση Παράθεση Γίνεται αναφορά σε 17 Σχετικά άρθρα

Determination of structural stability, elastic, thermal and half metallic behavior of CoZrVZ (Z= Al, Ga, In, Sn) quaternary Heusler alloys: A DFT study

M Shakil, H Sadia, MI Khan, SSA Gillani… - Physica B: Condensed …, 2022 - Elsevier
Physical characteristics of new quaternary Heusler alloys (QHAs) CoZrVZ (Z= Al, Ga, In, Sn)
are determined employing first-principles calculations. Perdew-Burke-Ernzerhof (PBE) …
Αποθήκευση Παράθεση Γίνεται αναφορά σε 15 Σχετικά άρθρα Όλες οι 3 εκδοχές