81 citations · 160 across the 7 of their papers we have counts for
9 papers
First-Principles Study of Large Gyrotropy in MnBi for Infrared Thermal Photonics
Md Roknuzzaman, Sathwik Bharadwaj, Yifan Wang +4
Nonreciprocal gyrotropic materials have attracted significant interest recently in material physics, nanophotonics, and topological physics. Most of the well-known nonreciprocal ma…
Elastic, electronic, optical and thermoelectric properties of K2Cu2GeS4: a new chalcogenide material
M. A. Ali, M. A. Hossain, M. A. Rayhan +5
We report the first principles study of structural, elastic, electronic, optical and thermoelectric properties of newly synthesized K2Cu2GeS4. The structural parameters are found t…
First-principles study of superconducting ScRhP and ScIrP pnictides
M. T. Nasir, M. A. Hadi, M. A. Rayhan +7
For the first time, we have reported in this study an ab initio investigation on elastic properties, Debye temperature, Mulliken population, Vickers hardness, and charge density of…
First-principles prediction of mechanical and bonding characteristics of new T2 superconductor Ta5GeB2
M. A. Hadi, M. T. Nasir, M. Roknuzzaman +3
In the present paper, DFT (Density Functional Theory) based first-principles methods are applied to investigate the mechanical and bonding properties of newly synthesized T2 phase…
Structural, elastic, and electronic properties of newly discovered Li2PtSi3 superconductor: Effect of transition metals
M. A. Alam, M. A. Hadi, M. T. Nasir +5
First-principles calculations within the density functional theory (DFT) with GGA-PBE exchange-correlation scheme have been employed to predict the structural, the elastic and the…
Physical properties of predicted Ti2CdN versus existing Ti2CdC MAX phase: An ab initio study
M Roknuzzaman, M A Hadi, M J Abedin +5
Ab intio calculations were done to investigate the structural, elastic, electronic and optical properties of the Cd-containing theoretically predicted MAX phase, Ti2CdN, in compari…