Surface-enhanced Raman scattering (SERS) provides detailed information about the
binding of molecules at interfaces and their interactions with the local environment due to …

This critical review highlights recent advances in using electronic structure methods to study
surface-enhanced Raman scattering. Examples showing how electronic structure methods …

There has been a great interest in understanding the interactions between light and noble
metal nanoparticles ever since Michael Faraday's study of the ruby-red color of colloidal …

The enhancement mechanism due to the molecule-surface chemical coupling in surface-
enhanced Raman scattering (SERS) has been characterized using time-dependent density …

2D transition metal dichalcogenide (TMD) materials have been recognized as active
platforms for surface‐enhanced Raman spectroscopy (SERS). Here, the effect of crystal …

p-aminothiophenol (PATP) is an important molecule for surface-enhanced Raman
spectroscopy (SERS). It can strongly interact with metallic SERS substrates and produce …

Using density functional theory, we have studied the interactions between pyridine (Py) and
coinage metals (silver, copper, and gold) as well as the transition metal platinum. We …

Surface-enhanced Raman scattering (SERS) on two-dimensional (2D) layered materials
has provided a unique platform to study the chemical mechanism (CM) of the enhancement …

Since the mid‐1990s, surface‐enhanced Raman scattering (SERS) has advanced greatly
and gained wider application and a renewal of interest. There have been several new and …

We present time dependent density functional theory (TDDFT) calculations for a tetrahedral
Au20 complex interacting with pyridine for the purpose of modeling absorption and surface …