First‐Principles Calculations to Investigate Electronic, Elastic, Magnetic, and Optical Properties for B1, B2, and B3 Phase for Sr0.875Mn0.125O with and Without …
In this work, the structural, electronic, elastic, optical, and magnetic properties for the B1, B2,
and B3 phases of Sr0. 875Mn0. 125O with relaxed structure (RS) and unrelaxed structure …
and B3 phases of Sr0. 875Mn0. 125O with relaxed structure (RS) and unrelaxed structure …
First-principles calculations of structural, electronic, elastic, and thermal properties of phase M2CdC (M = Sc, V, and Nb)
Using the first-principle methods based on the density functional theory, in order to study
structural, elastic, and electronic properties of MAX phases M 2 CdC with M=(Sc, V, and Nb) …
structural, elastic, and electronic properties of MAX phases M 2 CdC with M=(Sc, V, and Nb) …
Stability and physical properties of two novel magnetic MAX phase compounds Fe2AB (A= Cu and Zn) from density functional theory
M Rougab, A Gueddouh - Materials Today Communications, 2024 - Elsevier
MAX phases exhibit a wide range of important physical properties, making them a significant
area of research with various practical applications. In this paper, a theoretical study of two …
area of research with various practical applications. In this paper, a theoretical study of two …
Investigation of Structural, Magnetic, and Elastic Properties of a New Full-Heusler Alloy Ir2FeAl.
In this paper, we studied the magnetic stability, structural, elastic and electronic properties of
Ir< sub> 2 FeAl full Heusler compound in the regular phase (Cu< sub> 2 MnAl, prototype L2 …
Ir< sub> 2 FeAl full Heusler compound in the regular phase (Cu< sub> 2 MnAl, prototype L2 …
Structural, electronic, elastic, and magnetic properties of Os2-based full Heusler alloys: a first principal study
In this paper, we investigated the magnetic stability, structural, electronic, and elastic
properties of Os2YAl,(Y= Cr, Mn, and Fe) using the linearly augmented plane wave method …
properties of Os2YAl,(Y= Cr, Mn, and Fe) using the linearly augmented plane wave method …