Coherence refers to correlations in waves. Because matter has a wave-particle nature, it is
unsurprising that coherence has deep connections with the most contemporary issues in …

The construction of multiple heptagonal rings in nanographene is the key step for obtaining
exotic carbon nanostructures with a negative curvature and intriguing properties. Herein, a …

The commonly used Franck–Condon (FC) approximation is inadequate for explaining the
electronic spectra of compounds that possess vibrations with substantial Herzberg–Teller …

Nuclear scattering events with large momentum transfer in atomic, molecular, or solid-state
systems may result in electronic excitations. In the context of atomic scattering by dark matter …

Fluorescence-encoded infrared (FEIR) spectroscopy is an emerging technique for
performing vibrational spectroscopy in solution with detection sensitivity down to single …

While dark transitions made bright by molecular motions determine the optoelectronic
properties of many materials, simulating such non-Condon effects in condensed phase …

Although molecular vibronic spectra generation is pivotal for chemical analysis, tackling
such exponentially complex tasks on classical computers remains inefficient. Quantum …

The first order and second order corrected photoluminescence quantum yields are
computed and compared to experiment for naphthalene in this manuscript discussing …

In this contribution, we assess the computational machinery to calculate the
phosphorescence properties of a large pool of heteroleptic [Ir (C^ N) 2 (N^ N)]+ complexes …

We report a deep learning‐based approach to accurately predict the emission spectra of
phosphorescent heteroleptic Ir (C^ N) 2 (NN)+ complexes, enabling the rapid discovery of …