DFT study of the electronic and structural properties of single Al and N atoms and Al-N co-doped graphyne toward hydrogen storage

Published 2019 View Full Article

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Title
DFT study of the electronic and structural properties of single Al and N atoms and Al-N co-doped graphyne toward hydrogen storage
Authors
Keywords
Graphyne, 2-D carbon structure, Doping, Hydrogen storage, Adsorption, DFT-D
Journal
APPLIED SURFACE SCIENCE
Volume -, Issue -, Pages -
Publisher
Elsevier BV
Online
2019-05-24
DOI
10.1016/j.apsusc.2019.05.272

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