Surface modification of graphene with functionalized carbenes and their applications in the sensing of toxic gases: a DFT study

Graphene and other 2D materials have gained significant attention in the development of gas sensors. In this study, we employed Density Functional Theory (DFT) to investigate the adsorption properties of diazomethanes (1a–1g) with various functional groups (R = OH (a), OMe (b), OEt (c), OPr (d), CF(...

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Detalles Bibliográficos
Autores principales: Aldulaijan, Sarah, Ajeebi, Afnan M., Jedidi, Abdesslem, Messaoudi, Sabri, Raouafi, Noureddine, Dhouib, Adnene
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2023
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10305792/
https://www.ncbi.nlm.nih.gov/pubmed/37388147
http://dx.doi.org/10.1039/d3ra02557h

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10305792/
https://www.ncbi.nlm.nih.gov/pubmed/37388147
http://dx.doi.org/10.1039/d3ra02557h

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