Substitution of nickel in Mg2Ni and its hydride with elements from groups XIII and XIV: An ab initio study
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DOI: 10.1016/j.ijhydene.2021.02.011
Abstract: Abstract We have performed ab initio calculations with equilibrium supercells of the Mg2Ni compound and its hydride Mg2NiH4 doped with elements X = Al, Ga, In, Si, Ge and Sn. Two concentrations of X in both structures… read more here.
Keywords: substitution nickel; mg2ni hydride; hydrogen; enthalpy ... See more keywords