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Potential of Binary Lithium Magnesium Nitride for Hydrogen Storage Applications

✍ Scribed by Lu, Jun; Fang, Zhigang Zak; Choi, Young Joon; Sohn, Hong Yong


Book ID
127325552
Publisher
American Chemical Society
Year
2007
Tongue
English
Weight
318 KB
Volume
111
Category
Article
ISSN
1932-7447

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Energetics of the lithium-magnesium imid
✍ Oleg I. Velikokhatnyi; Prashant N. Kumta πŸ“‚ Article πŸ“… 2007 πŸ› Elsevier Science 🌐 English βš– 483 KB

An ab initio study within the density functional theory of the recently described reversible hydrogen storage reaction Mg(NH 2 ) 2 + 2LiH ⇔ Li 2 Mg(NH) 2 + 2H 2 has been conducted. The electronic structure, structural parameters, vibrational spectra, and enthalpies of formation of all the reactants