The interaction between hydrogen donor and acceptor molecules, known well as hydrogen
bonding, forms a ubiquitous network in the natural and synthesis world. The hydrogen …

The effects of solvents on electronic spectra can be treated efficiently by combining an
accurate quantum mechanical (QM) method for the solute with an efficient and accurate …

Coumarins often function in the solution phase for a diverse range of optoelectronic
applications. The associated solvent effects on the UV–vis absorption and/or fluorescence …

Twisting intramolecular charge transfer (TICT) is a common nonradiative relaxation pathway
for a molecule with a flexible substituent, effectively reducing the fluorescence quantum yield …

Metal–organic frameworks (MOFs) constructed by metal ions/clusters and organic linkers
are used to encapsulate fluorescent guest species with aggregation-caused quenching …

Solute–solvent intermolecular photoinduced intramolecular charge transfer (ICT) and
twisted intramolecular charge transfer (TICT) states are proposed to account for the unusual …

The effect of both solvent polarity and hydrogen bonding (HB) on the electronic transition
energy of Coumarin 102 (C102) has been examined using the time‐dependent density …

In this work, the excited‐state hydrogen bonding dynamics of photoexcited coumarin 102 in
aqueous solvent is reconsidered. The electronically excited states of the hydrogen bonded …

The rotational reorientation dynamics of 7-aminocoumarin derivatives with different
alkylation degrees in methanol, dimethylformamide, and dimethyl sulfoxide have been …

Complementary experimental and theoretical studies presented in this work examine the
structure, organization, and solvating properties of methanol at a silica/methanol, solid/liquid …