Theoretical Study of Dissolved Gas Molecules in Transformer Oil Adsorbed on Intrinsic and TM (Ta, V)-Doped MoTe2 Monolayer

In this paper, CH4, C2H2, H2, and CO adsorbed on intrinsic MoTe2 monolayer and transition metal atom (Ta, V)-doped MoTe2 monolayer have been investigated with density functional theory based on first-principles study. The adsorption energy, geometries, band structures, and density of states of four...

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Publié dans:Langmuir : the ACS journal of surfaces and colloids. - 1985. - 40(2024), 28 vom: 16. Juli, Seite 14652-14662
Auteur principal: Deng, Hui (Auteur)
Autres auteurs: Ni, Jiaming, Lin, Jiawen, Wang, Wei, Chen, Yuhua
Format: Article en ligne
Langue:English
Publié: 2024
Accès à la collection:Langmuir : the ACS journal of surfaces and colloids
Sujets:Journal Article