Understanding the properties of electronically excited states is a challenging task that
becomes increasingly important for numerous applications in chemistry, molecular physics …

We concisely review the main methodological approaches to model nonadiabatic dynamics
in isotropic solutions and their applications. Three general classes of models are identified …

Quantics is a general purpose program package to simulate the time-evolution of a
molecular system by solving the time-dependent Schrödinger equation. The main code is …

Several electronic-structure methods are available to study the photochemistry and
photophysics of organic molecules. Among them, ADC (2) stands as a sweet spot between …

The scientific community is allocating more and more resources to space missions and
astronomical observations dedicated to the search for life beyond Earth. This experimental …

Despite many studies, the mechanisms of nonradiative relaxation of uracil in the gas phase
and in aqueous solution are still not fully resolved. Here we combine theoretical UV …

We present an efficient approach for surface hopping-based nonadiabatic dynamics in the
condensed phase. For the systems studied, a restricted Kohn–Sham orbital formulation of …

La photo-isomérisation sub-picoseconde est la principale réaction initiant la conversion
d'énergie dans les protéines de rétinal, si bien qu'elle fait l'objet de travaux théoriques et …

This chapter is an authoritative and extensive review on the use of organic dyes in the new
and exciting field of optogenetics. The authors begin by outlining the essence of …

Predictive atmospheric models are essential to inform political and social decisions
regarding the behavior of chemicals and pollutants in the atmosphere. However …