Detection of H2S, HF and H2 pollutant gases on the surface of penta-PdAs2 monolayer using DFT approach
Abstract In this research, the adsorption of targeted noxious gases like H2S, HF and H2 on penta-PdAs2 monolayer are deeply studied by means of the density functional theory (DFT). After the capturing of three kind of pollutant gases (H2S, HF and H2), it is observed that, the electronic properties a...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
Nature Portfolio
2023-01-01
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| Series: | Scientific Reports |
| Online Access: | https://doi.org/10.1038/s41598-023-27563-x |