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 …
(X= Mn and Ir) compounds by using the first principle calculations within generalized …
First-principles investigations on the structural, optoelectronic, mechanical and transport properties of new stable lead-free double perovskites Cs2BB′ I6 (B= Ag/Rb …
Lead-free perovskite halides offer a promising alternative due to the successful replacement
of lead-based perovskites in various applications. Density functional theory simulations have …
of lead-based perovskites in various applications. Density functional theory simulations have …
Theoretical insight into the stability, magneto-electronic and thermoelectric properties of XCrSb (X: Fe, Ni) half-Heusler alloys and their superlattices
Within density functional theory (DFT), we have investigated the structural, elastic, electronic,
magnetic, and thermoelectric properties of XCrSb (X= Fe and Ni) half-Heusler (HH) alloys …
magnetic, and thermoelectric properties of XCrSb (X= Fe and Ni) half-Heusler (HH) alloys …
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 …
Computational determination of structural, electronic, magnetic and thermodynamic properties of Co2HfZ (Z= Al, Ga, Si and Sn) full Heusler compounds for spintronic …
HS Cherif, A Bentouaf, ZA Bouyakoub… - Journal of Alloys and …, 2022 - Elsevier
The aim of this paper is the prediction of the structural, electro-magnetic and mechanical
properties of the Co 2 HfZ (Z= Al, Ga, Si and Sn) full Heusler compounds using a full …
properties of the Co 2 HfZ (Z= Al, Ga, Si and Sn) full Heusler compounds using a full …
Enhanced thermoelectric performance of Mg3Sb2-xBix thermoelectric thin films through carrier concentration modulation by Bi alloying
Y Ran, W Ma, H Yu, W Li, D Zhou, F Wang… - Journal of Alloys and …, 2024 - Elsevier
Mg 3 Sb 2-based alloys exhibit promising characteristics as thermoelectric materials owing
to their non-toxicity, low cost, abundance of earth constituent elements, and high …
to their non-toxicity, low cost, abundance of earth constituent elements, and high …
First-principles calculations of electronic, magnetic, mechanical and thermoelectric properties of tetragonal Mn2PtSn-Ferromagnetic phase: Ab initio calculations
Y El Krimi, R Masrour - Modern Physics Letters B, 2024 - World Scientific
We present structural, electronic, magnetic, elastic and transport properties of tetragonal
Mn2PtSn (MPS) bulk material in stannite (ST) phase, we will use a FP-LAPW method based …
Mn2PtSn (MPS) bulk material in stannite (ST) phase, we will use a FP-LAPW method based …
Nonvolatile Memristive Materials and Physical Modeling for In‐Memory and In‐Sensor Computing
SX Go, KG Lim, TH Lee, DK Loke - Small Science, 2024 - Wiley Online Library
Separate memory and processing units are utilized in conventional von Neumann
computational architectures. However, regarding the energy and the time, it is costly to …
computational architectures. However, regarding the energy and the time, it is costly to …
Study of structural, elastic, electronic, optical and magnetic properties of Heusler Mn2NiAl: Ab initio calculations
Y El Krimi, R Masrour - Modern Physics Letters B, 2024 - World Scientific
In this paper, we will investigate the structural, electronic, mechanical, magnetic and optical
properties of Heusler Mn2NiAl (MNA) compound using the Perdew–Burke–Ernzerhof …
properties of Heusler Mn2NiAl (MNA) compound using the Perdew–Burke–Ernzerhof …
Structural, electronic, optical, elastic, mechanical, thermodynamic, and thermoelectric properties of lead-free and environmentally friendly CsSnX3 (X= Cl, Br) …
YA Khachai, N Baki, F Chiker, H Rozale… - Physica B: Condensed …, 2024 - Elsevier
In this study, we systematically examined the physical properties of CsSnX 3 (X= Cl, Br) by
employing the (FP-LAPW) method within the (GGA) and GGA+ mBJ approximations. The …
employing the (FP-LAPW) method within the (GGA) and GGA+ mBJ approximations. The …