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• W95334792 abstract "Lithium borohydride (LiBH4) has lately been the subject of intense inquiry within the hydrogen storage community. Quasi-elastic neutron scattering spectra were measured for LiBH4 in the high-temperature hexagonal crystal phase. The elastic incoherent structure factor associated with the rapid BH4– anion reorientations was determined at 400, 410, and 420 K for momentum transfers as high as 4.2 Å–1. The results strongly suggest a BH4– reorientational mechanism approaching quasi-free, trigonal-axis rotation of three borohydride H atoms, combined with reorientational jump exchanges between these delocalized “orbiting” H atoms and the remaining axial borohydride H atom. This mechanism is consistent with previously reported diffraction and spectroscopy studies." @default.
• W95334792 created "2016-06-24" @default.
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• W95334792 date "2011-12-28" @default.
• W95334792 modified "2023-10-17" @default.
• W95334792 title "The Nature of BH₄^– Reorientations in Hexagonal LiBH₄" @default.
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• W95334792 doi "https://doi.org/10.1021/jp211754g" @default.
• W95334792 hasPublicationYear "2011" @default.
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