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The Adsorption Mechanisms of SF(6)-Decomposed Species on Tc- and Ru-Embedded Phthalocyanine Surfaces: A Density Functional Theory Study

Designing high-performance materials for the detection or removal of toxic decomposition gases of sulfur hexafluoride is crucial for both environmental monitoring and human health preservation. Based on first-principles calculations, the adsorption performance and gas-sensing properties of unsubstit...

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Detalles Bibliográficos
Autores principales:	Xue, Rou, Jiang, Wen, He, Xing, Xiong, Huihui, Xie, Gang, Nie, Zhifeng
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2023
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10608908/ https://www.ncbi.nlm.nih.gov/pubmed/37894617 http://dx.doi.org/10.3390/molecules28207137

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