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Effect of metal decoration on sulfur-based gas molecules adsorption on phosphorene
Based on first-principles calculation, the adsorption of sulfur-based gas molecules (H(2)S, SO(2), SO(3)) on various metal-decorated phosphorenes is researched systematically. Eleven metals (Li, Na, K, Rb, Cs, Ca, Sr, Ba, Ni, La, Tl) which can avoid the formation of clusters on the phosphorene are c...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Nature Publishing Group UK
2021
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8438081/ https://www.ncbi.nlm.nih.gov/pubmed/34518596 http://dx.doi.org/10.1038/s41598-021-97626-4 |