In-depth theoretical understanding of the chemical interaction of aromatic compounds with a gold nanoparticle

Abstract

Gold Nanoparticles (GNPs), owing to their unique properties and versatile preparation strategy, have been demonstrated to exhibit promising applications in diverse fields, which includes bio-sensors, catalysts, nanomedicines, radiotherapy. Yet, the...

Raman spectra and DFT calculations of thiophenol molecules adsorbed on a gold surface

“…Now that the geometry is optimized, and vibrational modes and Raman spectra have been calculated. Using GGA DFT calculations, Tandiana et al 50 have recently demonstrated that the IR spectrum of aromatic compounds in interaction with a gold nanoparticle was changed as a result of the molecular orientation: they have considered the ''flat'' and ''perpendicular'' configurations. Here, we have calculated the Raman spectra of the different orientations shown in Fig.…”

Marigold Like Structure from Methionine Mediated Growth of Positively Charged Gold Nanorod

“…The above stretching frequency range can be assigned to the different mode of C=O binding with Au 0 and Au + surface. [17] In addition to MetÀ S!Au + interaction, confirmed by XPS, the formation of Au + is also stabilized by the carboxylate group. The competing binding modes of Met(S) and Met(CO À…”

Understanding the Interaction Mechanism between the Epinephrine Neurotransmitter and Small Gold Nanoclusters (Aun; n = 6, 8, and 10): A Computational Insight

“…32 Recently, a theoretical study by Tandiana et al reported the chemical interactions of aromatic compounds with AuNPs and predicted noncovalent interactions with dative, dispersive, and repulsive nature. 33 The interactions of NPs with neurotransmitters, which are necessary for brain cell communication, are one of the attractive areas of research. The development of novel treatment strategies for neurological disorders can be improved by an understanding of how NPs interact with neurotransmitters.…”

“…Recently, a theoretical study by Tandiana et al. reported the chemical interactions of aromatic compounds with AuNPs and predicted noncovalent interactions with dative, dispersive, and repulsive nature …”

“…A number of investigations focused on the various aspects of the AuNP/AuNC interaction with biomolecular systems. − Kyriazi et al designed DNA-AuNP assemblies with multiple and synergistic functions, proposing the potential to advance sensing and drug delivery in cells. To understand the interactions of AuNPs with common blood proteins, an array of photophysical measurements were performed by Lacerda et al They reported that AuNPs strongly associate with essential blood proteins.…”