The present study deals with the investigation of the change in the hyperpolarizability of
Pentacene-2, 5-dione (PD) on the introduction of the gold (Au) and silver (Ag) nanoclusters …

Abstract A novel chemosensor (H 3 NTS) has been designed for a fast and accurate
detection of F− in acetonitrile medium. The UV–Vis, 1 H, 13 C NMR experiments and …

Optical chemosensors caused a revolution in the field of sensing due to their high specificity,
sensitivity, and fast detection features. Imidazole derivatives have offered promising features …

The detection and removal of the environmentally harmful substance methyl mercury
(MeHg) have become an increasingly important issue due to its devastating effects on …

In this study, the performance of predicting fluorescence properties using 11 density
functional theory (DFT) functionals was evaluated through a comparison with experimental …

Polyaromatic hydrocarbons (PAHs) are widely spread pollutants in the environment,
including soil and water. Anthracene (anth) and phenanthrene (phen) pose severe health …

H‐acid, a prevalent pollutant in dyeing wastewater, is primarily utilized in the pharmaceutical
and textile industries. However, H‐acid treatment remains a challenge because of its high …

Herein, a novel fluorescent sensor has been developed for the detection of biothiols based
on theoretical calculations of the stability constant of the complex between a Cu2+ ion and …

A novel strategy was developed for the fluorescence detection of nitrite (NO2−) in real
samples. The method is based on the reaction of water-dispersible graphite-like carbon …

Adsorption of nitropyrene (NPy) on silver has been analysed through theoretical and
experimental techniques. Using density functional theory (DFT), variations in geometrical …