4.7 Article

Local atomic structural investigations of precursory phenomenon of the hydrogen release from LiAlD4

Journal

JOURNAL OF ALLOYS AND COMPOUNDS
Volume 586, Issue -, Pages 244-247

Publisher

ELSEVIER SCIENCE SA
DOI: 10.1016/j.jallcom.2013.09.209

Keywords

Hydrogen storage; Complex hydride; Local atomic structure; Total neutron scattering; Pair distribution function

Funding

  1. Neutron Science Proposal Review Committee of J-PARC/MLF [2011A0026]
  2. S-type neutron research project of IMSS, KEK [2009S06]
  3. Division of Scientific User Facilities Office of Basic Energy Sciences, U.S. Department of Energy [DE-AC05-00OR22725]
  4. UT Battelle, LLC
  5. New Energy and Industrial Technology Development Organization (NEDO)
  6. Tohoku University
  7. JSPS KAKENHI [22244039, 23686101, 24241034 and 25220911]
  8. MEXT, Japan
  9. Grants-in-Aid for Scientific Research [23686101] Funding Source: KAKEN

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Local atomic structural investigations of LiAlD4, which is composed of Li+ and [AlD4] , at 40-300 K were studied by total neutron scattering combined with pair distribution function (PDF) analysis for understanding of hydrogen release from LiAlD4. The results showed that the Al-D pair distribution almost unchanged, while the Li-D pair distribution clearly started to broaden and shrink above 200-250 K. The shrinking of the Li-D pair distribution might lead to the local generation of LiD, which was speculated as the precursory phenomenon for the hydrogen release from LiAlD4. (C) 2013 Elsevier B.V. All rights reserved.

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