A DFT investigation of the Electronic, Elastic, Thermodynamic, and Optical Properties of the CeH9 Superhydride: A Promising High-Tc Superconductor
Materials Chemistry and Physics,
Journal Year:
2025,
Volume and Issue:
unknown, P. 130395 - 130395
Published: Jan. 1, 2025
Language: Английский
Comprehensive DFT analysis of Cr-based XCrH3 (X = Li, K, Cs) metal hydride perovskites: Unveiling multifaceted properties and hydrogen storage potential
Muhammad Mubeen Parvaiz,
No information about this author
Adnan Khalil,
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Abdul Hannan
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et al.
Next Materials,
Journal Year:
2025,
Volume and Issue:
8, P. 100559 - 100559
Published: Feb. 25, 2025
Language: Английский
Computational study of the mechanical stability, hydrogen storage and optoelectronic properties of new perovskite hydrides CsXH3 (X = Ca, Sr and Ba)
Y. Selmani,
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H. Labrim,
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A. Jabar
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et al.
Inorganic Chemistry Communications,
Journal Year:
2024,
Volume and Issue:
170, P. 113335 - 113335
Published: Oct. 19, 2024
Language: Английский
Exploring Zr-based perovskite hydrides XZrH3 (X: Na/Cs) for hydrogen storage applications: Insights from first-principles DFT calculations
International Journal of Hydrogen Energy,
Journal Year:
2025,
Volume and Issue:
126, P. 22 - 35
Published: April 9, 2025
Language: Английский