Theoretical screening into Ag-Embedded HfS2 monolayers as gas sensor for detecting SF6 decomposition gases
The adsorption properties of Ag embedded HfS2 (Ag-HfS2) monolayers to SF6 decomposition gases (SO2, H2S, HF, SOF2 and SO2F2) were investigated based on density functional theory (DFT). The embedded Ag atoms are stably bound to the sulfur vacancies of the monolayer HfS2, and still maintain the semico...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2022-05-01
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| Series: | Journal of Materials Research and Technology |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2238785422003933 |