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Issue 48, 2010
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Structure and dynamics of ammonium borohydride

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Abstract

Synchrotron powder X-ray diffraction, ab initio molecular dynamics calculations and solid state 1H and 2H NMR are used to refine the structure of crystalline NH4BH4 including H atoms. Rapid reorientations of both ions mean that on average half-hydrogens occupy the corners of a cube around B or N.

Graphical abstract: Structure and dynamics of ammonium borohydride

  • This article is part of the themed collection: Hydrogen
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Publication details

The article was received on 16 Aug 2010, accepted on 06 Oct 2010 and first published on 29 Oct 2010


Article type: Communication
DOI: 10.1039/C0CC03297B
Citation: Chem. Commun., 2010,46, 9164-9166
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    Structure and dynamics of ammonium borohydride

    R. Flacau, C. I. Ratcliffe, S. Desgreniers, Y. Yao, D. D. Klug, P. Pallister, I. L. Moudrakovski and J. A. Ripmeester, Chem. Commun., 2010, 46, 9164
    DOI: 10.1039/C0CC03297B

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