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Chemicals, plastics and rubber industries

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Reversible storage of hydrogen in destabilized LiBH4

Article Abstract:

Destabilization of LiBH4 for reversible hydrogen storage using MgH2 is studied as a destabilizing additive. Formation of MgH2 upon dehydrogenation stabilizes the dehydrogenated state and thus destabilizes the LiBH4.

Author: Vajo, John J., Skeith, Sky L., Mertens, Florian
Publisher: American Chemical Society
Publication Name: Journal of Physical Chemistry B
Subject: Chemicals, plastics and rubber industries
ISSN: 1520-6106
Year: 2005
Industrial Gas Manufacturing, Industrial gases, Hydrogen, Lithium Compounds, Chemical reactions

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Computational evidence of bubble ZnS clusters

Article Abstract:

Simulated annealing method is used to obtain the global minima of several ZnS clusters. The comparison of energies of these clusters with the energies of bulklike clusters is also presented.

Author: C. Richard A. Catlow, Spano, Eleonora, Hamad, Said
Publisher: American Chemical Society
Publication Name: Journal of Physical Chemistry B
Subject: Chemicals, plastics and rubber industries
ISSN: 1520-6106
Year: 2003
Sulfur Compounds, Usage, Density functionals, Density functional theory, Zinc compounds, Structure, Sulphur compounds, Bubbles

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Subjects list: Research, Chemical properties
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