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Adsorption and Gas-Sensing Properties of Ag(n) (n = 1–4) Cluster Doped GeSe for CH(4) and CO Gases in Oil-Immersed Transformer
The adsorption mechanism of CO and CH(4) on GeSe, modified with the most stable 1–4 Ag-atom clusters, is studied with the help of density functional theory. Adsorption distance, adsorption energy, total density of states (TDOS), projected density of states (PDOS), and molecular orbital theory were a...
Autores principales: | Dong, Aijuan, Sun, Meiling, Gui, Yingang |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9739156/ https://www.ncbi.nlm.nih.gov/pubmed/36500826 http://dx.doi.org/10.3390/nano12234203 |
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