Vibrational and thermodynamic properties of LiBH4 polymorphs from first-principles calculations
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DOI: 10.1016/j.ijhydene.2018.02.042
Abstract: Abstract The study of phonons describes the thermodynamic properties behavior of compounds with small atoms because phonons have an important influence on its properties. Lithium borohydride, LiBH4, is one of the suitable materials for hydrogen… read more here.
Keywords: polymorphs first; thermodynamic properties; properties libh4; vibrational thermodynamic ... See more keywords