27 citations · 29 across the 5 of their papers we have counts for
6 papers
The Physical Properties of ThCr2Si2-type Nickel-based Superconductors BaNi2T2 (T = P, As): An ab-initio study
Md. Atikur Rahman, Md. Zahidur Rahaman, Md. Lokman Ali +1
Employing the first-principles computations based on the density functional theory (DFT), we have investigated the structural, mechanical, electronic, bonding, optical and thermody…
Insight into the physical properties of two niobium based compounds Nb3Be and Nb3Be2 via first principles calculation
Md. Zahidur Rahaman, Md. Lokman Ali
We investigate the structural, electronic, mechanical and elastic properties of two niobium based intermetallic compounds Nb3Be and Nb3Be2 by using the DFT based theoretical method…
Pressure-dependent mechanical and thermodynamic properties of newly discovered cubic Na2He
Md. Zahidur Rahaman, Md. Lokman Ali, Md. Atikur Rahman
Recently for the first time a stable compound of He and Na (Na2He) is predicted at high pressure. We explore the pressure dependent elastic, mechanical and thermodynamic properties…
Investigation on different physical aspects such as structural, elastic, mechanical, optical properties and Debye temperature of Fe2ScM (M = P and As) semiconductors: a DFT based first principles study
Md. Lokman Ali, Md. Zahidur Rahaman
With the help of first principles calculation method based on the density functional theory we have investigated the structural, elastic, mechanical properties and Debye temperatur…
Variation of the physical properties of four transition metal oxides SrTMO3 (TM = Rh, Ti, Mo, Zr) under pressure: An ab initio study
Md. Lokman Ali, Md. Zahidur Rahaman
Using first principles calculations, we have studied the structural and elastic properties of SrTMO3 (TM = Rh, Ti, Mo, Zr) under pressure by the plane wave pseudopotential method b…
The structural, elastic and optical properties of ScM (M = Rh, Cu, Ag, Hg) intermetallic compounds under pressure by ab initio simulations
Md. Lokman Ali, Md. Zahidur Rahaman, Md. Atikur Rahman
The influence of pressure on the structural and elastic properties of ScM (M = Rh, Cu, Ag, Hg) compounds has been performed by using ab initio approach pseudopotential plane- wave…