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Role of Lithium Decoration on Hydrogen Storage Potential

Hydrogen storage potential of two sets of lithium containing systems, viz., Li-doped borazine derivatives and various bondstretch isomers of Li3Al4 - is studied at the B3LYP/6-311+G(d) level of theory occasionally supplemented by the results from the associated MP2/6-31+G(d) calculations. Negative v...

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Pubblicato in:Journal of the Mexican Chemical Society
Autori principali: Sudip Pan, Swastika Banerjee, Pratim K. Chattaraj
Natura: Artigo
Lingua:Inglês
Pubblicazione: Sociedad Química de México 2012
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Accesso online:https://www.redalyc.org/articulo.oa?id=47524533002
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