Modulating the gas sensing properties of nitrogen coordinated dopants in graphene sheets: A first-principles study
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DOI: 10.1016/j.apsusc.2017.09.010
Abstract: Abstract The stable geometry, electronic property and chemical reactivity of dopants (Co, Mo and B) incorporated N4 centers in graphene sheets (D-GN4) are investigated using the first-principles calculations. It is found that the GN4 sheet… read more here.
Keywords: gas; graphene sheets; modulating gas; gn4 ... See more keywords