Browsing by Author "Mahmood, A."

Now showing items 1-3 of 3

Density functional theory-based study of the magnetic and optical properties of PbMO sub(3) (M = Cr, Fe) using the modified BeckeJohnson mBJ functional

Mahmood, Q.; Hassan, M.; Bhamu, K.C.; Yaseen, M.; Ramay, S.M.; Mahmood, A. (Journal of Physics and Chemistry of Solids. 128; 2019; 275-282.)

In this study, we employed the density functional theory (DFT) approach using WIEN2k code to study the magnetic and optical behaviors of PbCrO sub(3) and PbFeO sub(3) perovskites in both cubic and tetragonal phases. We ...
Magnetism, optical, and thermoelectric response of CdFe sub(2)O sub(4) by using DFT scheme

Mahmood, Q.; Yaseen, M.; Bhamu, K.C.; Mahmood, A.; Javed, Y.; Ramay, S.M. (Chinese Physics B. 27(3); 2018; ArticleID_037103.)

Comparative analysis of electronic, magnetic, optical, and thermoelectric properties of CdFe sub(2)O sub(4), calculated by employing PBEsol + mBJ has been done. The PBEsol reveals metallic nature, while TB-mBJ illustrates ...
Study of electronic, magnetic and thermoelectric properties of AV sub(2)O sub(4) (A = Zn, Cd, Hg) by using DFT approach

Mahmood, Q.; Hassan, M.; Ahmad, S.H.A.; Bhamu, K.C.; Mahmood, A.; Ramay, S.M. (Journal of Physics and Chemistry of Solids. 128; 2019; 283-290.)

We have investigated the electronic structure, magnetic and thermoelectric behavior of AV sub(2)O sub(4) (A = Zn, Cd, Hg) by using first principle calculations. Various properties are extracted from the computed band ...

Now showing items 1-3 of 3

Search IR