9 citations · 15 across the 11 of their papers we have counts for
14 papers
Mechanical, optoelectronic and thermoelectric properties of half-Heusler p-type semiconductor BaAgP: A DFT investigation
F. Parvin, M. A. Hossain, M. I. Ahmed +2
We have explored the mechanical, electronic, optical and thermoelectric properties of p-type half-Heusler compound BaAgP for the first time using density functional theory based ca…
Influence of Se doping in recently synthesized NaInS2-xSex solid solutions for potential thermo-mechanical applications studied via first-principles method
M. M. Hossain, M. A. Ali, M. M. Uddin +6
In the present work, the structural and hitherto unexplored thermal and mechanical properties of NaInS2-xSex (x = 0, 0.5, 1.0, 1.5 and 2.0) compounds have been studied using the de…
Physical properties of new MAX phase borides M2SB (M = Zr, Hf and Nb) in comparison with conventional MAX phase carbides M2SC (M = Zr, Hf and Nb): Comprehensive insights
M. A. Ali, M. M. Hossain, M. M. Uddin +3
In this article, a detailed study of the recently synthesized MAX phase borides M2SB (M = Zr, Hf and Nb) has been performed via first principles technique. Investigation of mechani…
Optoelectronic and transport properties of Fe2TiGe with the Tran-Blaha modified Becke-Johnson potential
M. Anwar Hossain, M. A. Al Noman, Md. Taslimur Rahman
In this paper, we have performed first principles calculations to study optoelectronic, thermodynamic and transport properties of Fe2TiGe using density functional theory (DFT). The…
An ab-initio study on physical properties of Pd2+ incorporated double perovskites CaPd3B4O12 (B = Ti, V)
Mirza H. K. Rubel, Khandaker Monower Hossain, Anjuman Ara Khatun +8
Numerous physical properties of CaPd3Ti4O12 (CPTO) and CaPd3V4O12 (CPVO) double perovskites have been explored based on density functional theory (DFT). The calculated structural p…
Prediction of fundamental properties of Be-B-Ta based novel ternary compounds from first-principles calculations
Enamul Haque, M. Anwar Hossain, Catherine Stampfl
Be-B/B-Ta based compounds are very attractive to researchers because of their high density and ultra-hardness. But ternary Be-B-Ta compounds are neither synthesized nor predicted.…