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19982026
most citedCombined DFT, SCAPS-1D, and wxAMPS frameworks for design optimization of efficient Cs2BiAgI6-based perovskite solar cells with different charge transport layers

423 citations

Showing 2016Show all

9 papers · 1 filter

cond-mat.mtrl-sci2016★ 48 cited

New Ternary Superconducting Compound LaRu2As2: Physical Properties from DFT Calculations

M. A. Hadi, M. S. Ali, S. H. Naqib +1

In this paper, we have presented the density functional theory (DFT) based calculations performed within the first-principles pseudopotential method to investigate the physical pro…

cond-mat.mtrl-sci2016★ 41 cited

Comparative study of Mo2Ga2C with superconducting MAX phase Mo2GaC: a first-principles calculations

M. A. Ali, M. R. Khatun, N. Jahan +1

The structural, electronic, optical and thermodynamic properties of Mo2Ga2C are investigated using density functional theory (DFT) within the generalized gradient approximation (GG…

physics.plasm-ph2016★ 12 cited

Effects of distinct ion temperatures on the head-on collision and phase shifts of dust acoustic one and multi-solitons in dusty plasmas

M. S. Alam, M. G. Hafez, M. R. Talukder +1

The propagation characteristics and interactions between the dust acoustic (DA) one and multi solitons in an unmagnetized dusty plasmas composing negatively charged mobile dust, Bo…

cond-mat.mtrl-sci2016★ 81 cited

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…

cond-mat.mtrl-sci2016★ 77 cited

Newly synthesized Zr2(Al0.58Bi0.42)C, Zr2(Al0.2Sn0.8)C, and Zr2(Al0.3Sb0.7)C MAX phases: A first-principles study

M. A. Ali, M. M. Hossain, N. Jahan +2

The structural, elastic, and electronic properties of newly synthesized Zr2(Al0.58Bi0.42)C, Zr2(Al0.2Sn0.8)C, and Zr2(Al0.3Sb0.7)C MAX nanolaminates have been studied using first-p…

physics.plasm-ph2016★ 35 cited

Characterization of atmospheric pressure H2O/O2 gliding arc plasma for the production of OH and O radicals

N. C. Roy, M. G. Hafez, M R Talukder

Atmospheric pressure steam/oxygen plasma is generated by a 88 Hz, 6kV AC power supply. The properties of the produced plasma are investigated by optical emission spectroscopy (OES)…