In recent years, a variety of new designs of coronene‐based polycyclic aromatic
hydrocarbons (PAHs) with diverse functions have emerged to serve as complementary …

This review is dedicated to the application of the self-consistent-charge density-functional-
based tight-binding (SCC-DFTB) approach to describe the structures, energetics …

Interactions between water and polycyclic aromatic hydrocarbons are essential in many
aspects of chemistry, from interstellar and atmospheric processes to interfacial …

Although clusters made of polycyclic aromatic hydrocarbon and water monomers are
relevant objects in both atmospheric and astrophysical science, little is known about their …

Context. Indene, a small PAH, has been detected in the gas phase in the cold dense cloud
TMC-1. Due to the low temperature in the cloud, below indene condensation temperature, its …

The interaction of polycyclic aromatic hydrocarbon molecules with water (H2O= W) is of
fundamental importance in chemistry and biology. Herein, size-selected microhydrated …

Context. The UV photoreactivity of polycyclic aromatic hydrocarbons (PAHs) in porous
amorphous solid water has long been known to form both oxygenated photoproducts and …

In dense interstellar environments, Polycyclic Aromatic Hydrocarbons (PAHs) are likely to
condense onto or integrate into water ice mantles covering dust grains. Understanding the …

Polycyclic Aromatic Hydrocarbons (PAHs) are a family of molecules which represent the
best candidates to explain the observation of one set of features in the Interstellar Medium …

We present results of a combined vacuum ultraviolet (VUV) and infrared (IR)
photoabsorption study of amorphous benzene: water mixtures and layers to investigate the …