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Effect on Au Adatom of the Different Configurations of BnNn (n = 1 ∼ 3) Co-Doped Graphene

Yan-ni Wen, Chuan Zhang, Pan Zhao,Quan Zhang,You Xie

COMPUTATIONAL AND THEORETICAL CHEMISTRY(2025)

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关键词
BN co-doped graphene,Structural properties,Electronic properties,Au adatom,First-principles calculations
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