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Comparative study on the dehydrogenation properties of TiCl4-doped LiAlH4 using different doping techniques

✍ Scribed by Jie Fu; Lars Röntzsch; Thomas Schmidt; Marcus Tegel; Thomas Weißgärber; Bernd Kieback

Book ID
119262277
Publisher
Elsevier Science
Year
2012
Tongue
English
Weight
942 KB
Volume
37
Category
Article
ISSN
0360-3199

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Mg 2 NiH 4 , with fast sorption kinetics, is considered to be a promising hydrogen storage material. However, its hydrogen desorption enthalpy is too high for practical applications. In this paper, first-principles calculations based on density functional theory (DFT) were performed to systematicall