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Md. Rabbi Talukder

Observed names: Md Rabbi Talukder, Md Rabbi Talukder
ORCID: 0009-0008-9999-7280
Observed ORCID: 0009-0008-9999-7280
OpenAlex ID: A5058853717
Theoretical insights into novel RbMH3 (M = Zn, Nb, and Ru) cubic perovskites for hydrogen storage applications: A first-principles DFT Study
2025 · Md Rabbi Talukder · International Journal of Hydrogen Energy · 57
Effect of transition metal on the physical and hydrogen storage properties of the dynamically stable novel ARhH3 (A = Mg, Ca, and Sr) hydrides for solid-state hydrogen storage application: A DFT and AIMD study
2025 · Md. Rabbi Talukder, Md Rasidul Islam · Fuel Processing Technology · 45
A DFT Investigation of Structural, Electronic, Optical, and Mechanical Properties of Lead‐Free Novel InGeX3 (X = Cl, Br, and I) Perovskites for Potential Applications in Multijunctional Solar Cells
2025 · Md. Amran Sarker, Md. Mehedi Hasan, et al. · Energy Science & Engineering · 39
Indirect to direct band gap transition of ABI3 (A = Rb, Cs; B = Ca, Sr) perovskites under hydrostatic pressure for photovoltaic and optoelectronic applications: A DFT study
2024 · Md. Rabbi Talukder, Md. Safin Alam, et al. · Physica B Condensed Matter · 37
Investigating pressure-driven semiconductor-to-metal transition in lead-free perovskites AlGeX 3 (X = F, Cl, and Br): insights from first-principles calculations
2024 · Md. Amran Sarker, Md. Mehedi Hasan, et al. · Materials Advances · 34
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Tuning band gap and improving optoelectronic properties of lead-free halide perovskites FrMI3 (M = Ge, Sn) under hydrostatic pressure
2024 · Md. Rabbi Talukder, Wahidur Rahman Sajal, et al. · Solid State Communications · 29
Control of B-cation and X-anion atoms in inorganic Pb-free novel Mg 3 BX 3 (B = P, N; X = Br, I) perovskites: a first-principles framework
2025 · Md. Mehedi Hasan, Md. Rabbi Talukder, et al. · New Journal of Chemistry · 27
Theoretical insights into novel Ba3MX3 (M = P, Sb; X = F, Cl) perovskites for advanced optoelectronics: A first-principles DFT study
2025 · Md Rabbi Talukder, Md. Mehedi Hasan, et al. · Computational and Theoretical Chemistry · 26
A DFT and AIMD Study on the Physical and Optoelectronic Properties of Novel A3PF3 (A = Ca, Sr, and Ba) Perovskites for Energy Harvesting Applications
2025 · Md. Rabbi Talukder, Md Mehedi Hasan, et al. · Journal of Inorganic and Organometallic Polymers and Materials · 22
Exploring pressure-driven semiconducting to metallic phase transition in lead-free InGeX3 (X=F, Cl) perovskites with tunable optoelectronic and mechanical properties via DFT
2025 · Md Mehedi Hasan, Md Amran Sarker, et al. · Physica B Condensed Matter · 22
Exploring the Physical Properties of Novel Inorganic Perovskite AMgBr 3 (A = Ga, Na, Tl)
2025 · Md. Bayjid Hossain Parosh, Md Saiduzzaman, et al. · Nano Select · 18
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First principles analysis of the impact of pressure on the properties of the inorganic Sr3SbBr3 perovskite for energy harvesting
2025 · Md Mehedi Hasan, Md Rabbi Talukder, et al. · Materials Science and Engineering B · 16
Pressure-guided band gap tuning from the ultraviolet to the visible region and enhancing optoelectronic features of inorganic AMgCl3 (A = Ga, In, and Tl) perovskites
2025 · Md. Rabbi Talukder, Md. Mehedi Hasan, et al. · Computational Condensed Matter · 13
First-principles analysis of eco-friendly Sr 3 BiX 3 (X = I, Br, and Cl) inorganic perovskites for optoelectronic applications: a DFT–ML hybrid approach
2025 · Md Rasidul Islam, Md Rabbi Talukder, et al. · New Journal of Chemistry · 6
Comprehensive DFT Study on the Structural, Electronic, Optical, Mechanical, and Thermodynamic Behavior of Lead‐Free AZnX 3 (A = Al, Ag; X = Cl, Br) Perovskites for Optoelectronic Applications
2025 · Mushfique Azad Takin, Md Shoab Uddin, et al. · Energy Science & Engineering · 6
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Exploring Dynamically Stable Li‐Based Novel RELiH 3 (RE = La, Ce, Pr, Nd) Rare Earth Hydrides for Sustainable Energy Applications: A DFT Study
2026 · Md. Rabbi Talukder, Jahirul Islam, et al. · International Journal of Energy Research · 3
Effect of halogen variation on the optoelectronic properties of AlSnX3 (X = F, Cl, Br and I) perovskites: a first-principles DFT investigation
2025 · Mushfique Azad Takin, Md Rabbi Talukder, et al. · Bulletin of Materials Science · 2
Structural, electronic, optical, phonon, thermodynamic, and hydrogen storage properties of XCo3H8 (X = Ti, V, Cr) hydrides: A first-principles insights
2026 · Md Rabbi Talukder, Md Saiduzzaman, et al. · Computational Condensed Matter · 1
Exploring LiM3H8 (M = Ti, Ni) hydrides as potential solid-state hydrogen storage materials: A first-principles study
2026 · Md. Rabbi Talukder, Tasmi Akter, et al. · Journal of Power Sources · 1
Uniaxial and Biaxial Mechanical Behavior of Nb 4 C 3 MXene Under Temperature, Strain Rate, and Vacancy Effects: A Molecular Dynamics Study
2026 · Avijit Das Pritom, Jahirul Islam, et al. · Advanced Theory and Simulations · 1
DFT insights into the dynamically stable CaTcH3 and SrTcH3 perovskite hydrides: Promising candidates for solid-state hydrogen storage
2026 · Mushfique Azad Takin, Md. Mafidul Islam, et al. · Materials Today Communications · 1
Exploring the influence of transition metals in AlMH3 (M = Sc, Cr, and Zr) hydrides for solid-state hydrogen storage applications: A DFT and AIMD approach
2026 · Mushfique Azad Takin, Md. Rabbi Talukder, et al. · Surfaces and Interfaces · 1
First-principles investigation of structural, electronic, magnetic, optical and hydrogen storage properties of rare earth-based XLiH3 (X = Pm, Sm, Eu and Gd) perovskite hydrides
2026 · Anika Hossain, Tasmi Akter, et al. · Journal of Rare Earths
First-principles investigation of X-site cation effects on the hydrogen storage properties of XNi3H8 (X = Ti, V, Cr) hydrides
2026 · Md. Rabbi Talukder, Tasmi Akter, et al. · Polyhedron
Effect of cation substitution on the physical and hydrogen storage properties of XNi3H8 (X = Mn, Fe, Co) complex hydrides: A first-principles study
2026 · Md Rabbi Talukder, Md Saiduzzaman, et al. · Materials Today Communications
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Works count: 30
Citation count: 407
H-index: 13
I10-index: 13
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