Adsorption of NO2, SO2, H2S, and NH3 on Os-Doped WSe2 Monolayers : A First-Principles Study
In this study, DFT calculations are used to analyze the adsorption of industrial waste gases (NO2, SO2, H2S, and NH3) on WSe2 monolayers. The adsorption energy, energy band, density of states, charge transfer, and recovery time of the adsorption structures between the target gas molecules and the Os...
Ausführliche Beschreibung
Bibliographische Detailangaben
| Veröffentlicht in: | Langmuir : the ACS journal of surfaces and colloids. - 1999. - 39(2023), 42 vom: 24. Okt., Seite 15142-15151
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| 1. Verfasser: |
Lin, Long
(VerfasserIn) |
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| Weitere Verfasser: |
Li, Xinchun,
Xue, Chaowen,
Cai, Xiaolin,
Tao, Hualong,
Zhang, Zhanying |
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| Format: | Online-Aufsatz
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| Sprache: | English |
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| Veröffentlicht: |
2023
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| Zugriff auf das übergeordnete Werk: | Langmuir : the ACS journal of surfaces and colloids
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| Schlagworte: | Journal Article |
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