articlePhysica B Condensed MatterJan 5, 2026Closed access

Electronic structure, optical, phonon, mechanical, thermodynamic, and hydrogen storage properties of A2VH6 (A = Ca, Sr, Ba) perovskite hydrides by DFT calculations

KEK. El KihelZEZ. El FatouakiATA. TahiriMIM. IdiriMEM. El Bouziani

Chouaib Doukkali University · University of Hassan II Casablanca · +1 more institution

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6
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54.41
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100%
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5

Topics & keywords

Topics
Keywords
  • Hydrogen storage
  • Hydride
  • Perovskite (structure)
  • Density functional theory
  • Hydrogen
  • Ground state
  • Structural stability
  • Phase (matter)
UN Sustainable Development Goals
  • Affordable and clean energy
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