4.6 Article

Ammonia-Borane Dehydrogenation by Means of an Unexpected Pentacoordinate Boron Species: Insights from Density Functional and Molecular Dynamics Studies

Journal

CHEMISTRY-A EUROPEAN JOURNAL
Volume 19, Issue 52, Pages 17673-17678

Publisher

WILEY-V C H VERLAG GMBH
DOI: 10.1002/chem.201303263

Keywords

ammonia-borane; boronium cations; hydrogen storage; molecular dynamics

Funding

  1. DST FASTRACK [NO-SR/FT/CS-118/2011]
  2. [INT/NOR/RCN/P-03/2011]

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