Electronic properties of Zintl phase hydride for hydrogen storage

Khadidja  Khodja; Youcef  Bouhadda

doi:10.54966/jreen.v17i2.435

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Published: 2014-06-30

DOI: https://doi.org/10.54966/jreen.v17i2.435

Keywords:

Hydrogen Storage, Zintl Phase, Metal Hydride, Electronic Properties, Density Functional Theory

Khadidja Khodja

Unité de Recherche Appliquée en Energies Renouvelables, URAER Centre de Développement des Energies Renouvelables, CDER 47378, Ghardaïa, Algeria

Youcef Bouhadda

Unité de Recherche Appliquée en Energies Renouvelables, URAER Centre de Développement des Energies Renouvelables, CDER 47378, Ghardaïa, Algeria

Abstract

In this paper we report the SrAl₂H₂ electronic properties which is a Zintl phase hydride in frame of the Density Functional Theory ‘DFT’ using the plane wave and pseudo potential method. We discuss the chemical bond nature using total and partial density of states ‘DOS and PDOS’, also we calculated the bonding distance of hydride compound and its precursor SrAl2 and the enthalpy formation of the SrAl₂H₂ for hydrogen storage.

Issue

Vol. 17 No. 2 (2014): Volume 17 (Regular)

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Articles

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How to Cite

[1]

“Electronic properties of Zintl phase hydride for hydrogen storage”, J. Ren. Energies, vol. 17, no. 2, pp. 201 – 206, Jun. 2014, doi: 10.54966/jreen.v17i2.435.