First principles study of structural, elastic, electronic, magnetic and thermoelectric properties of ZrRhYZ (Y= Hf, La; Z= Al, Ga, In) quaternary Heusler alloys
R Meenakshi, RAS Srinivasan… - … Physical Journal Plus, 2022 - epjplus.epj.org
The structural, mechanical, electronic structure, magnetic, and thermoelectric properties of
ZrRhYZ (Y= Hf, La; Z= Al, Ga, In) quaternary Heusler alloys at normal pressure are studied …
ZrRhYZ (Y= Hf, La; Z= Al, Ga, In) quaternary Heusler alloys at normal pressure are studied …
Computational Study of the Structural, Mechanical, Electronic, Half-Metallic, and Magnetic Properties of CoCrYZ (Z= In, Sn, Tl, and Pb) Quaternary Heusler Alloys
Q Yu, HM Huang, HJ Wang, ST Xue, JT Yang… - … of Superconductivity and …, 2022 - Springer
The structural, electronic, half-metallic (HM), and elastic properties of the new quaternary
Heusler (QH) CoCrYZ (Z= In, Sn, Tl, and Pb) were investigated using density functional …
Heusler (QH) CoCrYZ (Z= In, Sn, Tl, and Pb) were investigated using density functional …
Exploring the structural, electronic, optical properties and stability of Na2SrX (Si and Ge) full-Heusler alloys: A first principle investigation
The full-potential linearized augmented plane wave (FP-LAPW) method, based on the
density functional theory (DFT) with the generalized gradient approximation (GGA) plus …
density functional theory (DFT) with the generalized gradient approximation (GGA) plus …
Robust half-metallicity in CoZrMnZ (Z= P, As and Sb) quaternary Heusler alloys
The spin-polarized full-potential linearized augmented plane wave (FP-LAPW) method
based on the density functional theory (DFT) and the exchange and correlation potential is …
based on the density functional theory (DFT) and the exchange and correlation potential is …
New quaternary half-metallic materials CoZrFeZ (Z= As, Sb): A first-principle study
We employ the full-potential linear augmented plane wave method, utilizing the density
functional theory in the generalized gradient approximation with the modified Becke …
functional theory in the generalized gradient approximation with the modified Becke …
Structural, Electronic, and Magnetic Properties of Sr (_ {1-x}) Mn (_ {x}) F (_ {2}) Alloys Studied by First-principles Calculations
In this work, the structural, electronic, and magnetic properties of the Sr (_ {1-x}) Mn (_ {x}) F
(_ {2})(x= 0, 0.25, 0.5, 0.75, and 1) compounds are investigated using first-principles …
(_ {2})(x= 0, 0.25, 0.5, 0.75, and 1) compounds are investigated using first-principles …
Investigation of the elastic, mechanical, electronic, magnetic and optical properties of NbBiCs half-Heusler by density functional theory method
H Rezazadeh - Biquarterly Journal of Optoelectronic, 2022 - jphys.journals.pnu.ac.ir
potential candidate for using in spintronic and optoelectronic devices. Using first principle
calculations based on density functional theory within generalized gradient approximation …
calculations based on density functional theory within generalized gradient approximation …