First-principles calculation identification of ultrahigh hydrogen storage capacity in g-Mg3N2

Title
First-principles calculation identification of ultrahigh hydrogen storage capacity in g-Mg3N2
Authors
Keywords
Hydrogen storage, g, -Mg, 3, N, 2, First-principles calculations, Molecular dynamics
Journal
JOURNAL OF ALLOYS AND COMPOUNDS
Volume 867, Issue -, Pages 158744
Publisher
Elsevier BV
Online
2021-02-03
DOI
10.1016/j.jallcom.2021.158744

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