Catechol Sensing Performance of Pd-Functionalized Two-Dimensional Polyaramid : A DFT Investigation

Catechol (Cc) molecule adsorption on a pristine and transition metal (TMs = Sc, Pd, and Cu)-functionalized two-dimensional polyaramid (2DPA) monolayer is systematically studied by the first-principles density functional theory method. The weak physisorption (-0.29 eV) and charge transfer of the Cc m...

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Veröffentlicht in:Langmuir : the ACS journal of surfaces and colloids. - 1999. - 40(2024), 5 vom: 06. Feb., Seite 2577-2590
1. Verfasser: Lakshmy, Seetha (VerfasserIn)
Weitere Verfasser: Mane, Pratap, Trivedi, Ravi, Kalarikkal, Nandakumar, Chakraborty, Brahmananda
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2024
Zugriff auf das übergeordnete Werk:Langmuir : the ACS journal of surfaces and colloids
Schlagworte:Journal Article