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The nature of small molecules adsorbed on defective carbon nanotubes
In this work, we perform a comprehensive theoretical study on adsorption of representative 10-electron molecules H(2)O, CH(4) and NH(3) onto defective single-walled carbon nanotubes. Results of adsorption energy and charge transfer reveal the existence of both chemical adsorption (CA) and physical a...
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| Publicado no: | R Soc Open Sci |
|---|---|
| Main Authors: | , , , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
The Royal Society
2019
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6731717/ https://ncbi.nlm.nih.gov/pubmed/31598250 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1098/rsos.190727 |
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