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  • Theoretical study of beryllium borohydride Be(BH₄)₂

    Creator:
    Alghamdi, Maha D.
    Abstract:
    Ab initio calculations using the B3LYP and CCSD(T) methods were employed in this work to explore the most stable structure of the intriguing compound Be(BH₄)₂, for which as many as seven different structures have been proposed in the literature. Use of the B3LYP density functional method with several large basis...
    Resource Type:
    Masters Thesis
    Full Text:
    cause of this could be line broadening caused by a short lifetime of any state due to rapid