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DFT Study of Zn-Modified SnP(3): A H(2)S Gas Sensor with Superior Sensitivity, Selectivity, and Fast Recovery Time
The adsorption properties of Cu, Ag, Zn, and Cd-modified SnP(3) monolayers for H(2)S have been studied using density functional theory (DFT). Based on phonon spectrum calculations, a structurally stable intrinsic SnP(3) monolayer was obtained, based on which four metal-modified SnP(3) monolayers wer...
Autores principales: | , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2023
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10609550/ https://www.ncbi.nlm.nih.gov/pubmed/37887932 http://dx.doi.org/10.3390/nano13202781 |