The Hydrogen Storage and Extraction Abilities of Cesium-Based Perovskite Hydrides Cs2Tl$$\:{\varvec{B}}^{\varvec{{\prime\:}}}$$H6($$\:{\varvec{B}}^{\varvec{{\prime\:}}}$$=In, Ga): First-Principles Calculations DOI
Hudabia Murtaza, Junaid Munir, Qurat Ul Ain

et al.

Journal of Inorganic and Organometallic Polymers and Materials, Journal Year: 2024, Volume and Issue: unknown

Published: Oct. 28, 2024

Language: Английский

Lead-Free Double Halide Perovskite Compounds: Unveiling the Structural, Optoelectronic, and Transport Properties of A2TlRhF6 (A = K, Rb) for Robust and Sustainable Green Energy Applications DOI

Abrar Nazir,

Arti Saxena, Ejaz Ahmad Khera

et al.

Journal of Inorganic and Organometallic Polymers and Materials, Journal Year: 2025, Volume and Issue: unknown

Published: Feb. 22, 2025

Language: Английский

Citations

2
First-principles analysis to assess the solar water splitting and hydrogen storage capabilities of Cs2XGaH6 (X= Al, Na) DOI
Hudabia Murtaza,

Quratul Ain,

Junaid Munir

et al.

International Journal of Hydrogen Energy, Journal Year: 2024, Volume and Issue: 83, P. 124 - 132

Published: Aug. 10, 2024

Language: Английский

Citations

10
Spin-polarized analysis of the magneto-electronic, mechanical and optical response of double perovskites Cs2XCeI6 (X=Li, Na): A DFT study DOI
Hudabia Murtaza,

Quratul Ain,

Junaid Munir

et al.

Materials Science in Semiconductor Processing, Journal Year: 2024, Volume and Issue: 181, P. 108645 - 108645

Published: June 27, 2024

Language: Английский

Citations

9
Computational exploration of pressure-dependent structural and optoelectronic features of novel Jahn-Teller-distorted halide double perovskites DOI
Diwen Liu,

Huan Peng,

Huihui Zeng

et al.

Solar Energy, Journal Year: 2024, Volume and Issue: 282, P. 112982 - 112982

Published: Oct. 10, 2024

Language: Английский

Citations

8
The screening of the potential features of potassium-based K2BGaI6 (B = Tl, Rb) double perovskites for eco-friendly technologies: a first-principles study DOI

Quratul Ain,

Junaid Munir, Hudabia Murtaza

et al.

Optical and Quantum Electronics, Journal Year: 2024, Volume and Issue: 56(7)

Published: June 6, 2024

Language: Английский

Citations

7
A spin-polarized DFT analysis of the physical attributes of vacancy ordered Rb2TcCl6 double perovskite for optoelectronic and spintronics DOI
Ijaz Ali, Junaid Munir,

Quratul Ain

et al.

Journal of Magnetism and Magnetic Materials, Journal Year: 2024, Volume and Issue: 601, P. 172180 - 172180

Published: May 25, 2024

Language: Английский

Citations

6
A DFT-based determination of the physical attributes of Cs2InBiF6 fluoroperovskite by using multiple potentials DOI
Hudabia Murtaza,

Quratul Ain,

Ahmed S. Jbara

et al.

Optical and Quantum Electronics, Journal Year: 2024, Volume and Issue: 56(9)

Published: Aug. 24, 2024

Language: Английский

Citations

5
A precise prediction for the hydrogen storage ability of perovskite XPH3 (X=Li, Na, K) hydrides: First-principles study DOI
Hudabia Murtaza,

Quratul Ain,

Shams A.M. Issa

et al.

International Journal of Hydrogen Energy, Journal Year: 2024, Volume and Issue: 94, P. 1084 - 1093

Published: Nov. 16, 2024

Language: Английский

Citations

5
The half-metallicity, thermoelectric and optoelectronic attributes of K2CeB’X6 (B’=Ag, Cu & X=Cl, Br) for spintronics and renewable energies: A spin-polarized DFT study DOI

Inamul Mursaleen,

Junaid Munir,

Quratul Ain

et al.

Journal of Physics and Chemistry of Solids, Journal Year: 2024, Volume and Issue: 193, P. 112187 - 112187

Published: July 11, 2024

Language: Английский

Citations

4
Pressure-induced modifications in the structural, thermodynamic, electronic, optical and mechanical attributes of CaTiF6 perovskite halide for optoelectronic applications DOI
Hudabia Murtaza, Junaid Munir,

Quratul Ain

et al.

Solar Energy, Journal Year: 2025, Volume and Issue: 290, P. 113360 - 113360

Published: March 2, 2025

Language: Английский

Citations

0