Cd-do**-assisted tuning of transparency and conductivity of MnIn2O4 by density functional quantum theoretical approach
Spinel oxides have attracted huge attention from researchers owing to their fundamental
potential and applied prospects. In particular, it is highly desirable to enhance …
potential and applied prospects. In particular, it is highly desirable to enhance …
Study of lanthanide based Ln2MgSe4 (Ln= Er, Pm) spinels for spintronic and optoelectronic applications
Herein, the full potential linearized augmented plane wave (FP-LAPW) method within the
framework of density functional theory (DFT) is used to examine the physical features of Ln 2 …
framework of density functional theory (DFT) is used to examine the physical features of Ln 2 …
First-Principles Insights on Different Physical Properties of MoFe2O4 Ferrites for Magnetic and Energy Applications
Structural, electronic, and magnetic properties of MoFe2O4 have been investigated using
DFT with the Perdew-Burke-Ernzerhof generalized-gradient approximation as the exchange …
DFT with the Perdew-Burke-Ernzerhof generalized-gradient approximation as the exchange …
Application of DFT for magnetic anisotropy energy calculations of vanadium ferrite VFe2O4
Structural, electronic and magnetic properties of vanadium ferrite are studied using density
functional theory with Perdew Burke Ernzerhof Generalized Gradient Approximation (PBE …
functional theory with Perdew Burke Ernzerhof Generalized Gradient Approximation (PBE …
Theoretical predictions of structural electronic and optical properties of vanadium ferrite
The structural properties of Vanadium Ferrite VFe2O4 are reported for temperature range 0–
1000 K using Density Functional Theory. A comparative study with the available …
1000 K using Density Functional Theory. A comparative study with the available …